smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@H](OC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 5750779 PYLFHPMSDGFQLG-WFASDCNBSA-N 407.423 2.865 5 40 HFBB Cc1c(C(=O)N2CCCN(S(=O)(=O)c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] 11004089 RHFWKXNBBTWRSR-UHFFFAOYSA-N 421.450 2.579 5 40 HFBB O=c1c2c3nc4ccccc4nc3n(C[C@@H]3CCCO3)c2ncn1C[C@H]1CCCO1 2220723 DJUCCVCQOMVAJM-CABCVRRESA-N 405.458 2.652 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 7982420 XBPFHDISNOEMIA-IBGZPJMESA-N 416.821 2.962 5 40 HFBB COCCn1/c(=N/C(=O)c2ccccc2[N+](=O)[O-])sc2cc(NC(C)=O)ccc21 100873110 NTPSQBONRNEZDI-VZCXRCSSSA-N 414.443 2.957 5 40 HFBB CC1CCN(c2ccc(C(=O)OCC(=O)N3C[C@H](C)O[C@@H](C)C3)cc2[N+](=O)[O-])CC1 4835454 YVYRCUMFOXIISJ-HOTGVXAUSA-N 419.478 2.624 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)CC2=O)cc1 6502074 YGEICLBHCPHQTO-AWEZNQCLSA-N 412.398 2.866 5 40 HFBB O=C(CC[C@H]1C(=O)OCN1C(=O)OCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 6529571 QIMAHYMAVGPFQZ-KRWDZBQOSA-N 413.386 2.835 5 40 HFBB Cc1c(C(=O)NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-] 17089587 MQOANARVJLFQRW-UHFFFAOYSA-N 413.503 2.782 5 40 HFBB Cc1nnc(S/C(=C\c2cc(Br)cc([N+](=O)[O-])c2O)C(=O)O)o1 38276280 FXAOHCJBMFOABM-OQFOIZHKSA-N 402.182 2.972 5 40 HFBB CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)s1 1781113 CUUPOVXBFXDRSP-UHFFFAOYSA-N 423.432 2.655 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(NCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 8054815 PMIXANXLYQCTNC-UHFFFAOYSA-N 407.448 2.966 5 40 HFBB CNc1ccc(C(=O)Nc2nc(CN3C[C@H](C)O[C@H](C)C3)cs2)cc1[N+](=O)[O-] 12587543 RRIMXLBYXJLFGS-TXEJJXNPSA-N 405.480 2.955 5 40 HFBB CNS(=O)(=O)c1ccc(Oc2ccc3c4c(c(=O)oc3c2)CCC4)c([N+](=O)[O-])c1 15163404 JWZROYLKWZGWME-UHFFFAOYSA-N 416.411 2.890 5 40 HFBB CCN(CC)c1ccccc1COC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 48311858 KXJDQHNOQIPBED-UHFFFAOYSA-N 411.414 2.780 5 40 HFBB Cc1noc(C)c1C(=O)NCCN1C(=O)S/C(=C/c2ccc([N+](=O)[O-])cc2)C1=O 96594248 DLFUANDOJPVJJZ-NTEUORMPSA-N 416.415 2.666 5 40 HFBB CCN(CC)C[C@@H](O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(C)cc1 1900871 IURCDXBVRVEDOC-LJQANCHMSA-N 421.519 2.801 5 40 HFBB CSCC[C@H](NC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12)C(=O)O 2114526 HNXLGVMVYWXMQD-INIZCTEOSA-N 401.440 2.648 5 40 HFBB biogenic CC(=O)N[C@H](CC(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 4219847 NATZQDGHXLBJGY-GOSISDBHSA-N 400.387 2.772 5 40 HFBB Cc1cc(=O)oc2cc(OCC(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3)ccc12 5018658 CPQHJWCFDCNEPV-UHFFFAOYSA-N 412.354 2.570 5 40 HFBB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] 15409531 WFGUFXSCVAXKNY-MRXNPFEDSA-N 419.459 2.613 5 40 HFBB CCc1nn(C)c(N2CCN(Cc3nc(-c4ccc(C)cc4)no3)CC2)c1[N+](=O)[O-] 95455264 ZEDGCUOTSWCRSG-UHFFFAOYSA-N 411.466 2.571 5 40 HFBB C[C@H](C(=O)N1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220414983 PVMHPZLEULRNHC-CQSZACIVSA-N 403.460 2.729 5 40 HFBB CCc1cccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 12527323 SWTLYKQQYNNISQ-UHFFFAOYSA-N 413.430 2.789 5 40 HFBB CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 408552771 NQOKQVABGQPKNS-ZDUSSCGKSA-N 421.475 2.998 5 40 HFBB COc1c2c(cc3c1[C@@H](C[C@H](O)c1ccc4c(c1)OCO4)[N+](C)(C)CC3)OCO2 1824624 JDIXVBCUSZMZDF-CVEARBPZSA-N 400.451 2.950 5 40 HFBB biogenic COc1cc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(C)=O)c2)c([N+](=O)[O-])cc1OC 3392593 KSUMPFMDLUMBBC-GFCCVEGCSA-N 416.386 2.999 5 40 HFBB O=C1CC2(CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)Oc2ccccc21 4505671 LXYHTTKBEZVOQE-UHFFFAOYSA-N 402.428 2.784 5 40 HFBB O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1 12810256 CWENAOJMQARMSJ-UHFFFAOYSA-N 403.460 2.699 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 408588938 DFBFHIWJUSFRQK-CYBMUJFWSA-N 407.448 2.607 5 40 HFBB O=c1nc2n(-c3ccc(Br)cc3)c3ccc([N+](=O)[O-])cc3cc-2c(=O)[nH]1 848937 SWOMLWGFXVZJJB-UHFFFAOYSA-N 413.187 2.850 5 40 HFBB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 5523318 MXADWNYWEUZBOY-SFHVURJKSA-N 412.402 2.879 5 40 HFBB C[C@H](c1ccccc1)N1C[C@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 7232520 OOEANLOYLASTTJ-GDBMZVCRSA-N 411.414 2.686 5 40 HFBB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cc([N+](=O)[O-])ccc1Cl 10542635 KHJFSUNLYAUSBD-UHFFFAOYSA-N 409.851 2.701 5 40 HFBB C[C@@H](C(=O)N(C)c1nc2ccccc2s1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 12863391 NGROBRBKZYXNBU-JTQLQIEISA-N 410.411 2.852 5 40 HFBB O=C1CCc2cc(OCC(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)ccc2N1 22520430 KMJPAIXFJXUDDX-UHFFFAOYSA-N 424.369 2.652 5 40 HFBB COc1ccc(S(=O)(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)c([N+](=O)[O-])c1 24471315 KXXXESAMIXFTSL-UHFFFAOYSA-N 414.443 2.958 5 40 HFBB COc1ccc(-n2ccc3nc4ccn(CCCN(C)C)c(=O)c4cc3c2=O)cc1 38829031 LZXCKBXUIGDQDT-UHFFFAOYSA-N 404.470 2.661 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1cccc(C)c1)S(C)(=O)=O 220132093 NCAMFNCIWFHLNU-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COc1ccc(-c2noc(CN(C)S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)n2)cc1 223772556 NLZIOWODXYDOQP-UHFFFAOYSA-N 418.431 2.783 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCc4ccccc43)C2=O)c([N+](=O)[O-])c1 4469016 VPTYPBADHJDSGW-OAQYLSRUSA-N 408.414 2.625 5 40 HFBB O=C(Nc1ccc(Br)cn1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 6392030 FAOGVQRBFRRXSU-UHFFFAOYSA-N 407.224 2.841 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c(C)c1 8039076 XGGUMOBCTAOYKM-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1C 8040062 UGJCHVYMWXRRIM-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCCS(=O)(=O)Nc1cccc(C(=O)NCCNc2ccccc2[N+](=O)[O-])c1 24749450 AMLHDGHKNBKITA-UHFFFAOYSA-N 406.464 2.588 5 40 HFBB CCOC(=O)c1cc(C(=O)N(C)C[C@H]2COc3ccccc3O2)cc([N+](=O)[O-])c1 32966870 YUIRIGHCJSWNME-INIZCTEOSA-N 400.387 2.684 5 40 HFBB Cc1ccc(N2CN=c3s/c(=C\c4ccc([N+](=O)[O-])cc4)c(=O)n3C2)cc1Cl 2340345 PDGWOZWYQUKAKR-IUXPMGMMSA-N 414.874 2.663 5 40 HFBB CCOc1ccc(CCNC(=O)COC(=O)c2ccc([N+](=O)[O-])o2)cc1OCC 7737891 OTHAJLOXZATXER-UHFFFAOYSA-N 406.391 2.501 5 40 HFBB Cc1ccc2nc(COc3ccc(S(=O)(=O)N4CCCC4)cc3[N+](=O)[O-])cn2c1 9739840 WRYCVLGODPUOKK-UHFFFAOYSA-N 416.459 2.914 5 40 HFBB CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O 3254990 DICOLFICVQMELX-QFIPXVFZSA-N 424.457 2.799 5 40 HFBB CC(C)OC(=O)[C@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC(C)C)C(=O)C[C@]1(C)O 4142572 LTAJSQLTORSAHL-IIMDRIAPSA-N 421.446 2.538 5 40 HFBB COc1cc(NC[C@H]2COc3c(ccc(OC)c3OC)C2=O)c([N+](=O)[O-])cc1OC 5550329 ZEHUUMPOOHZPLB-NSHDSACASA-N 418.402 2.933 5 40 HFBB COc1cc(NC[C@@H]2COc3c(ccc(OC)c3OC)C2=O)c([N+](=O)[O-])cc1OC 5550332 ZEHUUMPOOHZPLB-LLVKDONJSA-N 418.402 2.933 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)Cc1ccccc1F 225736047 WJRSQTWMXYTSJG-UHFFFAOYSA-N 415.830 2.788 5 40 HFBB COC(=O)c1ccc([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1 408567782 RHYRRVXJDJJTPF-WEMPKCCASA-N 407.426 2.528 5 40 HFBB COc1ccc(-c2nonc2NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1OC 8916415 FBFPIOUUCIISOI-UHFFFAOYSA-N 400.347 2.680 5 40 HFBB COc1ccc(S(=O)(=O)CC(=O)Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1 10219264 UNPOSOLUOOIXNG-UHFFFAOYSA-N 407.429 2.626 5 40 HFBB O=C(NCc1cccs1)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 28276353 SUPNBTBUHCBZJV-MRXNPFEDSA-N 409.489 2.516 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1ccccc1Cl 408653670 FISLQZQFPAZAHZ-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 408678859 DNRWERGCZQGOPY-CPLUKWAASA-N 417.421 2.959 5 40 HFBB Cc1cc(C)cc(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1 8037814 FZKFOCPTDJFGSS-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CC1CCN(c2ccc(C(=O)OCn3nnc4ccccc4c3=O)cc2[N+](=O)[O-])CC1 9283767 HUGYMZZGJYPYBX-UHFFFAOYSA-N 423.429 2.751 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 11001078 CCQGHIKJPUVWLM-UHFFFAOYSA-N 417.487 2.748 5 40 HFBB COc1ccccc1N(C(C)=O)c1nc(Cn2cc([N+](=O)[O-])ccc2=O)cs1 12947213 ZAPXVEPACGMXID-UHFFFAOYSA-N 400.416 2.955 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1cc(C)ccc1C)S(C)(=O)=O 33758796 INLCSPXSZDKKBZ-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB COc1cc(N2C(=O)[C@@H]3ON=C(c4ccccc4Cl)[C@H]3C2=O)c(C)cc1[N+](=O)[O-] 103540294 KJLCGKAQKQPAJY-NVXWUHKLSA-N 415.789 2.858 5 40 HFBB CCOC(=O)CN1C(=O)S/C(=C\c2ccc(Br)c([N+](=O)[O-])c2)C1=O 106744725 SUGNJNBJKOOJJK-WDZFZDKYSA-N 415.221 2.957 5 40 HFBB Cc1nn(C)c(C)c1CN(C)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)o1 2778109 ADCZQRGTZNBXSY-UHFFFAOYSA-N 400.439 2.672 5 40 HFBB CCc1ccccc1NC(=O)COC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 8040077 RSYYNJLHZXQKSV-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCC[C@@H](C)[C@@H]2C)cc([N+](=O)[O-])c1 14086038 JXMNEBWNEWMBLJ-XREXNNHRSA-N 406.435 2.868 5 40 HFBB CN(C)S(=O)(=O)c1ccc(CNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 47705913 YLWPGCRZAPFECF-UHFFFAOYSA-N 412.855 2.820 5 40 HFBB CCOc1ccc(C(=O)NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1OCC 59290805 NVQZJFFCOYOVOX-UHFFFAOYSA-N 424.431 2.520 5 40 HFBB COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CO)C[C@H](O)c2ccccc2)cc1SC 89423812 PLTJKMNEJPRJCX-CJNGLKHVSA-N 406.460 2.540 5 40 HFBB Cc1c(NC(=O)[C@@H](C)N(c2ccc(F)c(F)c2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220452912 AUPFGCHLACKNSJ-LLVKDONJSA-N 413.402 2.975 5 40 HFBB CC(=O)[C@H](C[C@@](C(C)=O)(C(=O)OC(C)C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)C 227144380 IWLSTPVDTVMQDS-RXVVDRJESA-N 421.446 2.920 5 40 HFBB CCOC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C 6551228 GEIJLIMGLPMWSR-UHFFFAOYSA-N 400.435 2.679 5 40 HFBB C[C@H](OC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)C(=O)Nc1ccccc1[N+](=O)[O-] 8760523 JLKPTUHKOONACC-HOCLYGCPSA-N 411.414 2.514 5 40 HFBB Cc1cc(C)cc(Oc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])c1 34800101 VZVJOBOTMNXJTN-UHFFFAOYSA-N 405.476 2.940 5 40 HFBB CCNC(=O)NC1CCC(OC(=O)c2c[nH]c(-c3cccc([N+](=O)[O-])c3)n2)CC1 97163184 NEHAQRONZVLYNL-UHFFFAOYSA-N 401.423 2.772 5 40 HFBB COc1ccc(NC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)c([N+](=O)[O-])c1 6875663 QRBXPNNTFNPRAR-VMPITWQZSA-N 410.474 2.873 5 40 HFBB COc1cc(COC(=O)[C@H](C)NC(=O)c2ccco2)c([N+](=O)[O-])cc1OC(F)F 24889093 PWHCKLNWRPEDFX-VIFPVBQESA-N 414.317 2.660 5 40 HFBB CCc1cccc(C)c1NC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O 408545809 AGXWZSZMGBJRLQ-UHFFFAOYSA-N 421.475 2.879 5 40 HFBB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)c(OC)c1 6052642 YIKZEOLZCHGFDY-GOSISDBHSA-N 412.402 2.879 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1ccccc1Cl 9525981 UMRZGLFDKWFLEC-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB O=C1[C@H]2C(c3ccc([N+](=O)[O-])cc3)=NO[C@H]2C(=O)N1c1cccc(C(F)(F)F)c1 103622056 GXOVXWRMIRKGNK-DZGCQCFKSA-N 405.288 2.906 5 40 HFBB C[C@H](C(=O)N[C@H]1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220420284 WKNVPKVTVXLQFL-KUHUBIRLSA-N 417.487 2.943 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1 224872561 BYHFFGMXXKYASV-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB O=C(CN1CCCCC1)Nc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 1722754 XAJOOQKIWJNEHF-UHFFFAOYSA-N 403.460 2.852 5 40 HFBB O=C(NC(=S)NC1C2CC3CC(C2)CC1C3)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 32119037 BPDQIWBZMLHRDU-UHFFFAOYSA-N 404.448 2.932 5 40 HFBB Cc1cnc(NC(=O)[C@H]2CSCN2C(=O)/C=C/c2cccc([N+](=O)[O-])c2)s1 69453681 CWRSXAUGGPOSBY-VBROQKIQSA-N 404.473 2.913 5 40 HFBB CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 536508173 MAFALEQWRFGZKU-KRWDZBQOSA-N 405.414 2.645 5 40 HFBB O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)c1cc(Cl)ccc1[N+](=O)[O-] 21867045 UVGRFRXYXWMCLI-UHFFFAOYSA-N 417.849 2.749 5 40 HFBB C[C@H](OC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2c(=O)[nH]1 23596606 LAMFGRSPOJCZGF-ZDUSSCGKSA-N 424.413 2.586 5 40 HFBB CC[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222522122 HMWISUWTQUAQPG-MRXNPFEDSA-N 422.419 2.686 5 40 HFBB COc1ccc(C)cc1S(=O)(=O)N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1C 408552271 KYDMMIGINLQWPF-CYBMUJFWSA-N 407.448 2.526 5 40 HFBB CCc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 8064221 NVWABKGLXPPOSJ-ZWKOTPCHSA-N 401.444 2.769 5 40 HFBB COc1ccc(C(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 408662276 XPFQOSSDTODSQW-HNNXBMFYSA-N 412.398 2.691 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccccc1 35593241 RXNTVGOPCCYPSL-OAHLLOKOSA-N 404.492 2.704 5 40 HFBB NC(=O)c1cc([N+](=O)[O-])cnc1NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 48290594 JYWVHUFKJSLTPA-UHFFFAOYSA-N 410.356 2.583 5 40 HFBB COc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420497 NJQVCIYQPGDUTE-KGLIPLIRSA-N 421.475 2.635 5 40 HFBB CCOc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2N2CCOCC2)cc1[N+](=O)[O-] 20611737 KOMFKVZOHDXSEZ-UHFFFAOYSA-N 416.390 2.991 5 40 HFBB CC(C)(C)c1nnc2sc(SCC(=O)c3ccc([N+](=O)[O-])cc3)nn2c1=O 27526483 QWFMNRCHMLMKOX-UHFFFAOYSA-N 405.461 2.727 5 40 HFBB CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 67286292 DXUIZLXWTAXJHR-SFHVURJKSA-N 402.451 2.642 5 40 HFBB CCn1c(=N)c(C(=O)NCc2ccccc2Cl)cc2c(=O)n3ccccc3nc21 101121757 JEIRYGCANBELOH-UHFFFAOYSA-N 407.861 2.732 5 40 HFBB Cc1ccc(-n2nnnc2Sc2nc([N+](=O)[O-])nn2Cc2ccccc2F)cc1 1443529 CZCQJMPOKKYILI-UHFFFAOYSA-N 412.410 2.809 5 40 HFBB COc1cc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)c([N+](=O)[O-])cc1OC 3544893 ANFBNTNQKQZPSP-GFCCVEGCSA-N 400.387 2.747 5 40 HFBB O=[N+]([O-])c1cnc(Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)c([N+](=O)[O-])c1 4417477 UHYDXORAWJMCEX-UHFFFAOYSA-N 422.404 2.899 5 40 HFBB O=[N+]([O-])c1ccc(Sc2nc(Nc3ccccc3)nc(N3CCOCC3)n2)nc1 9192225 XXNTVLMKCZPXLU-UHFFFAOYSA-N 411.447 2.906 5 40 HFBB C[C@H](NC(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 9355753 JZEXAGOSZSWMJQ-HNNXBMFYSA-N 417.487 2.873 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@@H]([C@H]4C(c5ccc([N+](=O)[O-])cc5)=NO[C@@H]34)[C@H]2C(=O)N1c1ccccc1 13727010 LOGYSZUFTVYLIL-GZKCFLEVSA-N 403.394 2.769 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)cc1[N+](=O)[O-] 14344207 NBYRJNOYAHBNTP-UHFFFAOYSA-N 404.429 2.769 5 40 HFBB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])C1=O 409015173 ARUPSQLJYQGLDJ-CULDGANSSA-N 410.404 2.600 5 40 HFBB CCOCCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 4834633 ZMHZRBLNNOYTRP-UHFFFAOYSA-N 407.448 2.552 5 40 HFBB CC(C)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 5294165 ZKDDEGCQUZDFBD-HNNXBMFYSA-N 408.455 2.589 5 40 HFBB COc1ccc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)cc1[N+](=O)[O-] 12783325 CCFAAYZFRVMMDS-VXGBXAGGSA-N 406.464 2.921 5 40 HFBB COc1cc(NC(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)c(C)cc1[N+](=O)[O-] 5973957 MNQPKICXJNVKBS-UHFFFAOYSA-N 418.450 2.885 5 40 HFBB CCOc1cc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1OC 23181858 VZCOZVGQCRJLJL-KBPBESRZSA-N 409.483 2.620 5 40 HFBB O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2nnc3ccccn23)C1 32935590 LFMJSVZTOGNFNY-AWEZNQCLSA-N 406.446 2.914 5 40 HFBB O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc2c(c1)OC(F)(F)O2 57911467 RVLLVJMQUVUIEG-UHFFFAOYSA-N 420.372 2.677 5 40 HFBB Cc1c(NS(=O)(=O)c2ccc(O[C@@H](C)C(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] 408592678 NYFZJMRHOAIXKP-AWEZNQCLSA-N 421.475 2.996 5 40 HFBB COC(=O)c1ccccc1NC(=O)CSc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 3075271 BDFVJMMOYYVWCY-UHFFFAOYSA-N 413.415 2.897 5 40 HFBB C[C@H](OC(=O)c1ccc(NCCO)c([N+](=O)[O-])c1)C(=O)N1CCCc2ccccc21 5895129 LTETVOLGPPBCPZ-AWEZNQCLSA-N 413.430 2.524 5 40 HFBB CCOCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 9668457 XJOIRNURDFIDOO-UHFFFAOYSA-N 407.448 2.552 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)cc1 36033897 JRPSUKYENLATSN-QXUMQBBKSA-N 419.393 2.864 5 40 HFBB O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)N1CCCCC1 835129 CKDHLOCDXXWOPN-UHFFFAOYSA-N 403.460 2.803 5 40 HFBB CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 13010976 DSQDQWMTUBCYRG-UHFFFAOYSA-N 408.418 2.910 5 40 HFBB O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)Nc1cccc([N+](=O)[O-])c1 15390201 DEJJDBMYZDLTQK-UHFFFAOYSA-N 403.460 2.781 5 40 HFBB C[C@@H](OC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1 21129552 JUQUKISDDRHJLI-OLZOCXBDSA-N 415.377 2.657 5 40 HFBB CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 65740484 GVJKLSTZIFMTKH-CQSZACIVSA-N 424.548 2.767 5 40 HFBB CC(C)[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCc1ccccn1 6831920 JWCSFGNSEPMRMQ-KRWDZBQOSA-N 404.854 2.757 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1 12625628 VZBDFUSNSQHLRC-UHFFFAOYSA-N 422.323 2.914 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1ccccc1Cl 408653672 FISLQZQFPAZAHZ-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB CC(C)N1C(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C(=O)NC1=S 8914147 XBDYUWLGNUAQFB-UZLBHIALSA-N 416.503 2.538 5 40 HFBB COC(=O)c1ccc(NC(=O)c2ccc(=O)n(Cc3cccc([N+](=O)[O-])c3)c2)cc1 10187944 QZJXZOGLLNRXPC-UHFFFAOYSA-N 407.382 2.844 5 40 HFBB COc1cc(N2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc(OC)c1OC 12980657 RARALCCJJOLLQW-LBPRGKRZSA-N 415.402 2.612 5 40 HFBB Cc1c2c(=O)n(-c3ccc([N+](=O)[O-])cc3)[nH]c2cc(=O)n1CCc1ccc(O)cc1 30822921 GDRITXUKWRKRJM-UHFFFAOYSA-N 406.398 2.645 5 40 HFBB O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCN(Cc3ccc(Cl)s3)CC2)c1 32775310 SUVNBFZIVSOWFR-OAHLLOKOSA-N 411.911 2.867 5 40 HFBB COc1ccc(NC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)c([N+](=O)[O-])c1 32895480 ZBVQQEGVBGKRBZ-KRWDZBQOSA-N 404.423 2.700 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)cc([N+](=O)[O-])c1 108854352 JXMNEBWNEWMBLJ-APNQJHFZSA-N 406.435 2.868 5 40 HFBB CC[C@H](C(=O)c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCC1=O 408643593 GGLIFEHUSIMPQF-QGZVFWFLSA-N 409.398 2.763 5 40 HFBB COC[C@H](C)NS(=O)(=O)c1ccc(Nc2cc(C)ccc2OC)c([N+](=O)[O-])c1 6831178 YGQDTQJGFATIDE-ZDUSSCGKSA-N 409.464 2.969 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 8433899 QTMKRARXJDDXNK-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB O=C(c1ccc(Cl)cc1)N1CCN(c2ccc(-n3cnnc3)cc2[N+](=O)[O-])CC1 70461893 NDNRNNWETLWSGH-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)N1CCc2ccccc21)S(C)(=O)=O 220392598 ACGSREKVZBYSPW-AWEZNQCLSA-N 403.460 2.647 5 40 HFBB COc1ccccc1NC(=O)CCC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 8416581 HHTOGNNYISTCMN-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1CN(c2ccc(F)cc2)C1=O 95469336 ASUIQPWNFFXLTG-LJQANCHMSA-N 415.424 2.825 5 40 HFBB O=C(CN(C(=O)c1ccc(Cl)cc1)N1C(=O)CCC1=O)c1ccc([N+](=O)[O-])cc1 408644705 HIXNSSGKZGTSRT-UHFFFAOYSA-N 415.789 2.637 5 40 HFBB COc1cc(/C=C(\Cl)c2nc3cc(C(=O)O)ccc3c(=O)[nH]2)cc([N+](=O)[O-])c1O 8748960 RTKATCXATHLTGO-WCIBSUBMSA-N 417.761 2.981 5 40 HFBB C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1S(=O)(=O)Cc1ccccc1 17092151 RNIBJLDMNUFDGN-CQSZACIVSA-N 420.447 2.544 5 40 HFBB O=C(c1cccc2c1OCCO2)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 97115130 XQJMIDYRODTRDD-UHFFFAOYSA-N 423.429 2.595 5 40 HFBB CCOc1ccc(-c2noc(CNS(=O)(=O)c3ccccc3[N+](=O)[O-])n2)cc1 223581158 LTISLSPWWVEPBW-UHFFFAOYSA-N 404.404 2.522 5 40 HFBB O=C(CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1 2063012 IOWHBACVOHNSEB-UHFFFAOYSA-N 401.331 2.648 5 40 HFBB COC(=O)N[C@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl 3168255 HZTBLEIGWZGJJA-QMMMGPOBSA-N 401.659 2.934 5 40 HFBB O=C(CC[C@@H]1C(=O)OCN1C(=O)OCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 6529572 QIMAHYMAVGPFQZ-QGZVFWFLSA-N 413.386 2.835 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)NC(=S)Nc1cc(C(=O)O)ccc1Cl 6883521 MAYNMZSAJXGRGT-UHFFFAOYSA-N 409.807 2.838 5 40 HFBB C[C@H](OC(=O)C[C@@H]1Sc2ccccc2NC1=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 12425361 NROHRHZEKCTYGD-ZBEGNZNMSA-N 415.427 2.968 5 40 HFBB C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 24716661 VNGVZKZWSBVHJG-HNNXBMFYSA-N 420.477 2.989 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])c1 40156375 DHIXIPUYYWUICK-CQSZACIVSA-N 423.495 2.701 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)/c1=N\C(=O)CC(C)C 103627983 SWHHKKAOSNXXSQ-GFMRDNFCSA-N 410.474 2.880 5 40 HFBB Cc1ccc(CNC(=O)[C@@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 220383866 ZUKBOPGPEZWZHL-OAHLLOKOSA-N 405.476 2.683 5 40 HFBB CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 10901454 ZMIFBTHGRCELAU-UHFFFAOYSA-N 423.878 2.961 5 40 HFBB Cc1nc2ccccc2n1CCNC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 15136154 OGFGLMGCGLNHHS-UHFFFAOYSA-N 423.429 2.757 5 40 HFBB COc1cc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])ccc1OC(=O)c1cccs1 34688639 GGEVPQVDHFWYET-GQCTYLIASA-N 415.383 2.843 5 40 HFBB CCOC(=O)C1CCN(c2ncnc(Nc3ccc4c(c3)OCO4)c2[N+](=O)[O-])CC1 40584153 NFJRJWWWGWMHLP-UHFFFAOYSA-N 415.406 2.637 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@@H]32)c1 4393683 ZFCSVHCGHLXAAN-ROUUACIJSA-N 401.444 2.824 5 40 HFBB CC(=O)Oc1cccc(NC2=C(Cl)C(=O)N(c3ccccc3[N+](=O)[O-])C2=O)c1 101597910 QLNWGEMHOSTLSD-UHFFFAOYSA-N 401.762 2.956 5 40 HFBB O=c1[nH]c(/C=C/c2ccc(-c3ccc([N+](=O)[O-])c(Cl)c3)o2)c([N+](=O)[O-])c(=O)[nH]1 107831590 GAICREDZDTXHPK-DUXPYHPUSA-N 404.722 2.963 5 40 HFBB C[C@@H](NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(F)cc1 220420952 CPXMHIXHFPNSEM-CHWSQXEVSA-N 409.439 2.766 5 40 HFBB Cc1c(Nc2c(C(=O)O)cc([N+](=O)[O-])cc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 6177569 RFUDIRJPDPUKHX-UHFFFAOYSA-N 413.346 2.743 5 40 HFBB CCOC(=O)[C@@H](Cc1c[nH]c2cc([N+](=O)[O-])ccc12)N1C(=O)c2ccccc2C1=O 6206378 CZNOUVMVFVPJSK-GOSISDBHSA-N 407.382 2.847 5 40 HFBB COC(=O)c1ccc(N2CCOCC2)c(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1 7389821 DVFKSSURYJINDL-VMPITWQZSA-N 411.414 2.870 5 40 HFBB Cc1cccc(OCCNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1 12780529 KSZHJMRUNAMZIR-UHFFFAOYSA-N 408.414 2.566 5 40 HFBB C[C@H](C(=O)N(C)c1nc2ccccc2s1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 12863400 NGROBRBKZYXNBU-SNVBAGLBSA-N 410.411 2.852 5 40 HFBB COc1ccccc1-n1nnnc1SCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 13400273 YHUIGNVSNFMUAC-UHFFFAOYSA-N 400.420 2.618 5 40 HFBB O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C2=NN=C(c3cccs3)CS2)CC1 36709961 SXWODFICOBQPST-UHFFFAOYSA-N 405.461 2.514 5 40 HFBB O=C(c1ccccc1F)N1CCC(Nc2ncc([N+](=O)[O-])c(NC3CC3)n2)CC1 40153693 XNZIJSAIRMKNHM-UHFFFAOYSA-N 400.414 2.815 5 40 HFBB O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 45317810 AHCKJTGDFMJPLK-SNVBAGLBSA-N 403.778 2.969 5 40 HFBB COc1ccccc1NC(=O)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 57524840 SBDDMXGVTVXMIK-UHFFFAOYSA-N 421.457 2.912 5 40 HFBB CC[C@@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@H](c3ccccc3[N+](=O)[O-])N2C1=O 2702870 OEMDJHNEOJSFJP-HOCLYGCPSA-N 419.459 2.823 5 40 HFBB O=C(OCC(=O)N1CCc2ccccc2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 4840557 YZEOTVFNDAIFRT-UHFFFAOYSA-N 409.442 2.937 5 40 HFBB CCCc1cc(=O)n(CC(=O)Nc2cccc([N+](=O)[O-])c2)c(-n2nc(C)cc2C)n1 5254736 OSRPAIAGZCIKOW-UHFFFAOYSA-N 410.434 2.545 5 40 HFBB C[C@@H](OC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 5750782 PYLFHPMSDGFQLG-DOMZBBRYSA-N 407.423 2.865 5 40 HFBB COc1ccccc1[C@@H](CNc1nc(N)c([N+](=O)[O-])c(N2CCCCC2)n1)N(C)C 35681942 VEKJVHAQJYRCPK-OAHLLOKOSA-N 415.498 2.681 5 40 HFBB CS(=O)(=O)c1ccc(N2CCCC[C@H]2CNC(=O)c2ccccc2)c([N+](=O)[O-])c1 72310228 TYKUFOKCPQXKQS-INIZCTEOSA-N 417.487 2.787 5 40 HFBB COc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3OC)C2)c(OC)c1 408647812 XNNXLEYRZYJMJF-GFCCVEGCSA-N 415.402 2.612 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)[C@H](C(=O)N1CCc2ccccc2C1)n1ccccc1=O 4679736 NEFXFJMHICOTJW-OAQYLSRUSA-N 417.421 2.765 5 40 HFBB CCOc1ccc(N2C[C@H](C(=O)OCC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1 7881409 QKAHBCZKTZMBLJ-OAHLLOKOSA-N 412.398 2.773 5 40 HFBB Cc1ccsc1CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)C1 16742586 USILFGZGNAHFOI-HNNXBMFYSA-N 424.500 2.559 5 40 HFBB COc1ccc(/C=C/c2nc3s/c(=C\c4cccc([N+](=O)[O-])c4)c(=O)n3n2)cc1 27022183 ZFKWRAVDAKJPTH-VXGMZCCXSA-N 406.423 2.786 5 40 HFBB CC1(C)NC(=O)N(Cc2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)C1=O 40123051 AXUXABFSMUHSKT-UHFFFAOYSA-N 411.418 2.747 5 40 HFBB C[C@@H](C(=O)NCc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 57456065 SQUMUOBFMKTKCY-KRWDZBQOSA-N 419.485 2.970 5 40 HFBB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 107550943 ZNRYCUZZDXKGGX-HLLBOEOZSA-N 419.478 2.529 5 40 HFBB CC[C@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 223795973 YOBQQXJSHKQNRK-KRWDZBQOSA-N 407.448 2.787 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)OC(=O)c1cccc(OC)c1OC 7181697 YDJMKMNPQFRSOK-LLVKDONJSA-N 404.375 2.805 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nncn1-c1ccccc1OC 9662080 HINMBRRZGYCNQY-UHFFFAOYSA-N 415.431 2.924 5 40 HFBB COc1ccccc1CNC(=O)COC(=O)c1ccc(Br)c([N+](=O)[O-])c1 22613626 PECRRXQSDZBPQI-UHFFFAOYSA-N 423.219 2.839 5 40 HFBB COC(=O)CN1C(=O)N/C(=C\c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)C1=O 107617678 QWQGTWLRRVTXSG-GHXNOFRVSA-N 405.750 2.574 5 40 HFBB CCc1ccccc1NC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O 113937441 CZDZLGRQANNMMA-UHFFFAOYSA-N 407.448 2.571 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NC[C@@H](C)c1ccccc1)S(C)(=O)=O 224058351 SGVIPANZTBVEMN-OAHLLOKOSA-N 405.476 2.589 5 40 HFBB CC(C)C[C@@H](NC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1)C(=O)O 2949193 ZAAHMCZTFYZBSA-UVQBRAAOSA-N 415.402 2.574 5 40 HFBB COC(=O)c1cc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc([N+](=O)[O-])c1 8349369 YQIDTEWUUMDGOQ-ZDUSSCGKSA-N 409.402 2.795 5 40 HFBB O=C(COc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2cc(Cl)ccc2F)CC1 40113287 NZYIEWFVOHTGQK-UHFFFAOYSA-N 421.812 2.751 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCc1ccc(Cl)cc1 13930262 KJHQLLSEXNRFKG-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB CN1CCC(Oc2ccc(CNS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 216941968 MNDHUFVOTMQHFQ-UHFFFAOYSA-N 405.476 2.546 5 40 HFBB O=C(c1ccc(Cn2ccc([N+](=O)[O-])n2)cc1)N1CCN(Cc2ccccc2)CC1 20149719 MZGXDQUNEIZAOD-UHFFFAOYSA-N 405.458 2.798 5 40 HFBB Cc1ccc(C)c([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 22347906 JCCFQHMWZDEZHR-HNNXBMFYSA-N 405.476 2.855 5 40 HFBB COc1cc(C(=O)Nc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc(OC)c1OC 39759734 ZADFIVGDVULHHA-UHFFFAOYSA-N 400.347 2.923 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCN(c2ccc(C(C)=O)cc2)CC1 57712377 NFBLFRLEMINFRA-UHFFFAOYSA-N 412.446 2.567 5 40 HFBB O=C1Nc2ccccc2/C1=C1/SC(=O)N(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O 409353893 UEARYDVRNFHCEG-NXVVXOECSA-N 409.379 2.836 5 40 HFBB COc1ccc(OCC(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 15534407 DDKWLPWCULWVGV-UHFFFAOYSA-N 405.838 2.984 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1COc2ccccc2O1 24663355 MYMMAHGRTXFZOL-OAHLLOKOSA-N 401.419 2.565 5 40 HFBB O=C(NCCS(=O)(=O)N1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl 58146850 UDWZMDFTTAXIJY-UHFFFAOYSA-N 424.866 2.762 5 40 HFBB O=C(CN1C(=O)N/C(=C/c2ccc(Cl)c([N+](=O)[O-])c2)C1=O)Nc1ccccc1F 409212558 NAXAXACRNKDLIP-VGOFMYFVSA-N 418.768 2.919 5 40 HFBB COc1ccc(-c2nc3ccccc3n3cc4c(=O)n(C)c(=O)n(C)c4c23)cc1OC 804798 LIGCLOQVIYUQBV-UHFFFAOYSA-N 416.437 2.722 5 40 HFBB CCc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 8433893 MYPVOFSNPYALLU-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB CC[C@H](C)N1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 8995959 MBRANFPVIJLCSR-KPFBPEDLSA-N 414.462 2.763 5 40 HFBB C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cc(Cl)c3c(c2)OCCO3)C1=O 9872998 BVNTWPGIUYSDJO-LJQANCHMSA-N 417.805 2.987 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(CN2CCCC2=O)cc1 223701773 TUOPGCYDSPVJGL-UHFFFAOYSA-N 403.460 2.504 5 40 HFBB COc1ccc(S[C@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 48340922 QGQHCKAJQZZGBH-CQSZACIVSA-N 402.476 2.828 5 40 HFBB COCc1cc([N+](=O)[O-])ccc1NC(=O)NCC1(N2CCOCC2)CCCCC1 79073003 HHUVZQBJWIRWCY-UHFFFAOYSA-N 406.483 2.898 5 40 HFBB Cc1cc2nc3s/c(=C\c4cc([N+](=O)[O-])cc([N+](=O)[O-])c4O)c(=O)n3c2cc1C 104393671 QAGVINXRMFZCNO-UUASQNMZSA-N 412.383 2.596 5 40 HFBB Cc1ccc([C@H](C)NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420850 VLHOLQUJUQIJKP-GJZGRUSLSA-N 405.476 2.935 5 40 HFBB COc1cccc2[nH]c(C(=O)N3CCN(C(=O)c4cccc([N+](=O)[O-])c4)CC3)cc12 12322172 AGGOUJBWTVTRDU-UHFFFAOYSA-N 408.414 2.683 5 40 HFBB CCOC(=O)c1c(C[N+]2(C)CCOCC2)n(C)c2cc(Br)c(O)cc12 2233726 OUMZDAFUYMQSQU-UHFFFAOYSA-O 412.304 2.800 5 40 HFBB CC[C@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@H](c3cccc([N+](=O)[O-])c3)N2C1=O 2256768 JETDMZPPGFJUQQ-ZBFHGGJFSA-N 419.459 2.823 5 40 HFBB CCOC(=O)c1c(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)sc(C(N)=O)c1C 2741901 XRFWOJFQPDJABZ-BQYQJAHWSA-N 403.416 2.892 5 40 HFBB CCOc1ccccc1NC(=O)COC(=O)CCC(=O)Nc1cccc([N+](=O)[O-])c1 8416561 DCFLWDVRPFGBGR-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB COc1ccc(S(=O)(=O)CCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 10218756 AEPXELAFHZRPNX-UHFFFAOYSA-N 408.432 2.805 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccccc2CN2CCOCC2)c1C 12997513 MPKIMUPPGOXAFP-UHFFFAOYSA-N 419.503 2.522 5 40 HFBB CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(NC)c([N+](=O)[O-])c1 57464780 YWHZQYOWPRVVJX-UHFFFAOYSA-N 403.435 2.998 5 40 HFBB Cc1c(NC(=O)[C@H](C)Oc2ccc(N(C)S(C)(=O)=O)cc2)cccc1[N+](=O)[O-] 223950798 BFICSJBTOMHGEJ-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408601051 DWIXACWLKHHWIF-UHFFFAOYSA-N 407.448 2.643 5 40 HFBB CCOc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1 9403063 UGIRRNXYFFLUPX-UHFFFAOYSA-N 400.420 2.700 5 40 HFBB COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cc([N+](=O)[O-])c1 14086033 JXMNEBWNEWMBLJ-ZOPJHEKZSA-N 406.435 2.868 5 40 HFBB CC(C)(C(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 40046890 MOTLBNZBNOTPQN-UHFFFAOYSA-N 405.476 2.504 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCC[C@H](C)[C@H]2C)cc([N+](=O)[O-])c1 6642098 JXMNEBWNEWMBLJ-ZBYUQBLASA-N 406.435 2.868 5 40 HFBB COc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 7881403 SGKIACVQFCDFER-ZFWWWQNUSA-N 412.398 2.771 5 40 HFBB Cc1nn(C(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1S(=O)(=O)N1CCC(C)CC1 16976202 OBBBYCSQSKYAHK-UHFFFAOYSA-N 406.464 2.517 5 40 HFBB Cc1c(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c(=O)n(-c2ccccc2)n1C 6483286 WJHWITZCMZCYCS-UHFFFAOYSA-N 411.443 2.519 5 40 HFBB CCc1c(C)[nH]c(-n2nc(C)cc2NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])nc1=O 7421954 KAGAKFCMCQOXMY-UHFFFAOYSA-N 416.825 2.949 5 40 HFBB O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 9356430 AHENWPMCVLYEMR-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB O=C(O)[C@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 13097438 WONHJMNHXDRKKF-HNNXBMFYSA-N 423.834 2.704 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)nc1 22799958 ARGMWDVBPPDHJW-UHFFFAOYSA-N 417.274 2.808 5 40 HFBB CCOC(=O)c1cc(C(=O)N(C)C[C@@H]2COc3ccccc3O2)cc([N+](=O)[O-])c1 32966868 YUIRIGHCJSWNME-MRXNPFEDSA-N 400.387 2.684 5 40 HFBB Cc1nc(CN2CCN(c3ccc([N+](=O)[O-])cc3N3CCOC3=O)CC2)cs1 78903680 YZYNQJKVAAJUPF-UHFFFAOYSA-N 403.464 2.639 5 40 HFBB Cn1cc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2ccc([N+](=O)[O-])c(=O)n2C3)c2ccccc21 524731208 NYGBFXZMBFEPAN-DOTOQJQBSA-N 420.469 2.827 5 40 HFBB biogenic O=[N+]([O-])c1cc([N+](=O)[O-])c(-c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1 104179173 PJTZYMXZEQWUHG-UHFFFAOYSA-N 424.194 2.803 5 40 HFBB COc1ccc(C(=O)N2CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)cc1 24831460 CZPCJICUWUUFKG-UHFFFAOYSA-N 403.822 2.855 5 40 HFBB CS(=O)(=O)c1ccc(NCCNC(=O)c2c(F)cccc2Cl)c([N+](=O)[O-])c1 32902691 YNPZMSHDFDCMCC-UHFFFAOYSA-N 415.830 2.633 5 40 HFBB O=C(NC1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1)c1ccc(F)cc1 32923143 PNGZPGNFUMOGOL-UHFFFAOYSA-N 424.436 2.844 5 40 HFBB C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 58171524 CAWVCNZEEVFYNT-CJNGLKHVSA-N 406.483 2.961 5 40 HFBB O=[N+]([O-])c1ccc(-n2cccc2[C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)cc1 223589344 YHPFMXHILZVEKZ-RTBURBONSA-N 409.471 2.745 5 40 HFBB Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ncccc1[C@@H]1CCCN1C 8659876 GYSBPRNPMCEKJM-LBPRGKRZSA-N 423.271 2.663 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N3CCC[C@H]3[C@@H]2C1=O 248118999 QWNBLHFUXGLTON-LEAZDLGRSA-N 419.437 2.738 5 40 HFBB CC(C)OC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 12382694 LTAJSQLTORSAHL-WKRCXCSHSA-N 421.446 2.538 5 40 HFBB CC(C)c1cccc(N2C[C@@H](C(=O)NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2=O)c1 23018495 XFANOAGEXOVLJB-FXAWDEMLSA-N 411.458 2.921 5 40 HFBB CCn1c(=N)c(C(=O)NCc2ccc(F)cc2)cc2c(=O)n3cccc(C)c3nc21 101136931 JRTGSIIRJMGTDL-UHFFFAOYSA-N 405.433 2.526 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(Cc3cccc4cccnc34)CC2)cc1 24496277 YSQPWGLSSFSOQB-UHFFFAOYSA-N 412.471 2.650 5 40 HFBB CC1CCN(S(=O)(=O)c2ccc(NC[C@@H](C)Cn3cccn3)c([N+](=O)[O-])c2)CC1 32935543 SIAQRGCRIVFQBG-MRXNPFEDSA-N 421.523 2.960 5 40 HFBB O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2nnc3ccccn23)C1 32935589 LFMJSVZTOGNFNY-CQSZACIVSA-N 406.446 2.914 5 40 HFBB O=C(CCCC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(F)cc1 46578985 OVQCDUGKBSGWNA-UHFFFAOYSA-N 400.410 2.831 5 40 HFBB CCOC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224777822 DNILSISAULDJIN-UHFFFAOYSA-N 422.459 2.979 5 40 HFBB COC(=O)CNC(=O)c1c(SCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3672225 MOGDMFFFHPGUKE-UHFFFAOYSA-N 405.388 2.698 5 40 HFBB CCc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1 6653054 IUTUOXFBYBJINF-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB CCc1sc(C(=O)NCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C 12537367 IPSAMXGHMSCWLG-UHFFFAOYSA-N 416.503 2.606 5 40 HFBB COc1ccc([C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c2nccn2C)cc1 12551229 ULWYHBKXISCCNF-SFHVURJKSA-N 416.459 2.942 5 40 HFBB COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 13946150 QBHLJDIPRMWSJN-UHFFFAOYSA-N 412.446 2.694 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)Nc1ccc(F)cc1F)S(C)(=O)=O 220387629 YWXFIHFHIFKZSY-NSHDSACASA-N 413.402 2.975 5 40 HFBB CC(C)OC(=O)[C@H]1C[C@](C)(O)C(=O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 3671410 DFQLPYSPKQLGGU-WCLQXYBISA-N 421.446 2.538 5 40 HFBB Cc1c(NC(=O)CN(Cc2ccccc2Cl)S(C)(=O)=O)cccc1[N+](=O)[O-] 223617434 BBPCHIBELQNASV-UHFFFAOYSA-N 411.867 2.957 5 40 HFBB CCOC(=O)CN(c1cccc(OCC)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225012675 JVNIGPZZXXHDON-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1[N+](=O)[O-])N1C(=O)CCCC1=O 408687164 SZEOTOPTOOLJLZ-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c1C 4508545 IITDLCVYSGFRCH-LBPRGKRZSA-N 417.418 2.821 5 40 HFBB COc1ccc(CCNC(=O)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1OC 4550961 SFVFVNLQGRWNJM-UHFFFAOYSA-N 401.419 2.690 5 40 HFBB CCc1ccc(N2C[C@@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1 7452386 LREUGFQLDFPRKR-SFHVURJKSA-N 422.485 2.859 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N1CCCc2ccccc21)S(C)(=O)=O 10333789 UDFXZEHVQRKMIS-UHFFFAOYSA-N 403.460 2.649 5 40 HFBB O=C(C1=NO[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]12)c1ccc2ccccc2c1 100355293 RXODAPJODQJMQG-YLJYHZDGSA-N 415.361 2.875 5 40 HFBB CC[C@@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(C)cc1 22523496 LSKZPVUPDGNBRM-GOSISDBHSA-N 405.476 2.937 5 40 HFBB COc1ccc(CCCNC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)cc1OC 66028480 AEKJYGXGPOBZFV-UHFFFAOYSA-N 404.419 2.748 5 40 HFBB CCS(=O)(=O)c1ccccc1C(=O)/N=c1/sc2cc([N+](=O)[O-])ccc2n1C 101072172 DLJGUVPMSLUWHR-ISLYRVAYSA-N 405.457 2.683 5 40 HFBB CN1CCN(c2cc3[nH]c(O)nc3cc2NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 408533093 OCAIJMWBUVSETB-QPJJXVBHSA-N 422.445 2.580 5 40 HFBB COc1cc(C(=O)OCC(=O)N2CCCc3ccccc32)c([N+](=O)[O-])cc1OC 3362416 NSSPMNOZNSBMLG-UHFFFAOYSA-N 400.387 2.748 5 40 HFBB COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1[N+](=O)[O-] 6653922 PJAKUKLREFUQGV-UHFFFAOYSA-N 410.285 2.720 5 40 HFBB COC(=O)c1cc(C(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)cc([N+](=O)[O-])c1 9402973 HENNQXOJXBKOCS-UHFFFAOYSA-N 410.390 2.535 5 40 HFBB COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(OC)c1OC 9493407 GXDVYCHOLZWBIT-UHFFFAOYSA-N 405.363 2.801 5 40 HFBB CCNS(=O)(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1OCC 408700313 CZJLXVIPWIXWPF-UHFFFAOYSA-N 407.448 2.852 5 40 HFBB CCOC(=O)c1[nH]c(COC(=O)c2ccc([N+](=O)[O-])cc2)c(C(=O)OCC)c1C 3158678 QCHBGGFNWCAMTE-UHFFFAOYSA-N 404.375 2.942 5 40 HFBB C[C@H]1CCCN(c2ccc(C(=O)OCn3nnc4ccccc4c3=O)cc2[N+](=O)[O-])C1 8687971 QMASIKXTDLPMTQ-AWEZNQCLSA-N 423.429 2.751 5 40 HFBB aggregator O=C(N1CCN(c2ccc([N+](=O)[O-])c3nonc23)CC1)C12CC3CC(CC(C3)C1)C2 11380772 CSFXOKMLQQFKDS-UHFFFAOYSA-N 411.462 2.996 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1CCN(C(=O)C2CC2)CC1 12522412 JXZVSAYMYAWFLZ-UHFFFAOYSA-N 403.482 2.672 5 40 HFBB O=C(NC1CCCC1)c1cc2c(=O)n3ccccc3nc2nc1NC[C@H]1CCCO1 26456963 QEPPDHSXTZECMU-OAHLLOKOSA-N 407.474 2.506 5 40 HFBB CS(=O)(=O)c1ccc2nc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)sc2c1 3212420 VZDFOPNGWDZSIN-UHFFFAOYSA-N 422.400 2.769 5 40 HFBB CCCn1c(COc2cccnc2[N+](=O)[O-])nc2cc(S(=O)(=O)N(C)C)ccc21 12627757 PAALFMSKKQQQAT-UHFFFAOYSA-N 419.463 2.579 5 40 HFBB Cc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)no1 1807193 YDOXZYDKIDASRR-UHFFFAOYSA-N 402.388 2.944 5 40 HFBB Cc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 17081875 SLSPRAXAFVZSNU-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB COc1cccc(-n2ccc3nc4ccn(C[C@@H]5CCCO5)c(=O)c4cc3c2=O)c1 38829102 FGTNYRZKRHRBQQ-KRWDZBQOSA-N 403.438 2.888 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420787 VLHOLQUJUQIJKP-CABCVRRESA-N 405.476 2.935 5 40 HFBB O=C(NCC(=O)N1CCC[C@H](c2c[nH]c3ncccc23)C1)Nc1cccc([N+](=O)[O-])c1 1648294630 YCBHHNBODONOLE-AWEZNQCLSA-N 422.445 2.999 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3Cl)C2=O)cc1[N+](=O)[O-] 3593774 HKAQIIXPXXGSNI-LJQANCHMSA-N 416.821 2.962 5 40 HFBB O=C1N(c2ccc([N+](=O)[O-])cc2)[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Cl)cc1 7718573 WCZLWBMQHGBKHG-JKSUJKDBSA-N 407.835 2.860 5 40 HFBB CCCN1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@@H]2c2ccccc2)C1=O 9429712 JPDBFJJDYVWNIZ-GCJKJVERSA-N 422.441 2.803 5 40 HFBB O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)NCCNc1ccc([N+](=O)[O-])cc1 9890854 HTTFLUQKRXOERP-UHFFFAOYSA-N 418.759 2.657 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O 24068361 UPRGVKRJQPWFEH-MPBGBICISA-N 402.451 2.979 5 40 HFBB CC[C@@H](C(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 24771419 IFRKMFCTPUGKNU-LJQANCHMSA-N 417.487 2.622 5 40 HFBB O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCN(c2ccccc2O)CC1 26525914 UHYHMQACAQIUOH-UHFFFAOYSA-N 410.474 2.866 5 40 HFBB O=C(O)CN(c1cccc(Br)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113877742 PWZJQMKACLHUQG-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB COc1ccccc1NC(=O)[C@H](C)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 220382127 QLLWSTQGEDGASP-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB O=C(O)COc1ccc(NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCOCC2)cc1 225563178 MIADHSXRBWFDKS-UHFFFAOYSA-N 400.387 2.745 5 40 HFBB CC1CCN(c2nc(N3CCN(Cc4ccccc4)CC3)nc(N)c2[N+](=O)[O-])CC1 20390230 ZOOKHPLZRCLMQT-UHFFFAOYSA-N 411.510 2.526 5 40 HFBB O=C(Oc1cccc(C(=S)N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 13590265 AMIVWHGPYKDMKY-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)Nc1cccc([N+](=O)[O-])c1 408660971 NWUGJNMKRMYPTD-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB CC[C@@H](NC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(C)cc1 32747526 QZZKMHCJXKJLEL-MRXNPFEDSA-N 420.491 2.620 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(OC)c(C)c1 224653153 XWSAXNBWANFHPE-UHFFFAOYSA-N 422.459 2.979 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2cccc(OC)c2)cc([N+](=O)[O-])c1 6642073 IGCJEZPYUYDEQC-LLVKDONJSA-N 402.359 2.574 5 40 HFBB Cc1cc(OCC(=O)Nc2ccc(N3CCNCC3)c([N+](=O)[O-])c2)ccc1Cl 20154337 ABFDIMWYHKPNEO-UHFFFAOYSA-N 404.854 2.984 5 40 HFBB Cc1ccc(-c2nc3n(n2)[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(=O)N3)cc1 20744450 UYOXWXGWNAXPOC-MRXNPFEDSA-N 406.402 2.992 5 40 HFBB CC(C)NC(=O)c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)c([N+](=O)[O-])c1 32869665 HUNXOCFRJPUHKW-UHFFFAOYSA-N 422.489 2.703 5 40 HFBB O=C(Oc1cccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 33688658 RJBGVRBYAORYSR-BQYQJAHWSA-N 424.325 2.682 5 40 HFBB CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)c1 40074785 VVYLDRRLYGHMPK-UHFFFAOYSA-N 417.447 2.754 5 40 HFBB CS(=O)(=O)N(CCCC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 408704515 OUHRMJQUXOCJQU-UHFFFAOYSA-N 421.431 2.508 5 40 HFBB C[C@@H](Oc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 5109254 ZCOYTFAOAQUNRE-CQSZACIVSA-N 419.459 2.785 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3F)CC2=O)cc1 7007612 FEFGYTBPXSDOQF-ZDUSSCGKSA-N 415.377 2.577 5 40 HFBB COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2-c1cccc(OC)c1 2299811 IAKSPLGRIVHGRP-UHFFFAOYSA-N 401.426 2.939 5 40 HFBB O=C1[C@@H]2N=NN(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccc(Br)cc1 18204029 WJSXHOGEHAKEBW-ZIAGYGMSSA-N 416.191 2.855 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H]1C[C@@H]2CC[C@@H]1C2 103005852 FWBOHCNVWBDEKI-KLZNWCGWSA-N 409.508 2.852 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O 408687547 UPEJNTMIWOMVFD-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB Cc1ccccc1OCCNc1cc(N2CCN(CCO)CC2)ccc1[N+](=O)[O-] 19537078 HLGGOSPQKXWACV-UHFFFAOYSA-N 400.479 2.508 5 40 HFBB NC(=O)c1ccc(CN2CCCN(c3ccc(C(F)(F)F)cn3)CC2)c([N+](=O)[O-])c1 96578140 RXWGFMDSAAXSDT-UHFFFAOYSA-N 423.395 2.820 5 40 HFBB O=C(O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113886175 ZLMABGWMVNAEAN-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@]2(CCCC[C@H]2NCc2cccnc2)C1 306133259 MGUIUDHIGPYTFL-IFMALSPDSA-N 410.474 2.933 5 40 HFBB CCN1C(=O)S/C(=C/c2cc([N+](=O)[O-])cc(I)c2O)C1=O 409100661 WAKCKXAWLHCTBH-RUDMXATFSA-N 420.184 2.961 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O 409148339 YQEBGZORBISXCK-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB O=C(CSc1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)s1)Nc1nccs1 9366092 CBZQVEYILUKCKD-UHFFFAOYSA-N 422.473 2.886 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NC[C@H](C)c3ccccc3)cc2[N+](=O)[O-])CC1 22644843 QAANCNISOCMSAO-INIZCTEOSA-N 410.474 2.797 5 40 HFBB Cc1c(CS(=O)(=O)[C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] 48252010 HLTQUPKRUUOXIG-CYBMUJFWSA-N 420.443 2.616 5 40 HFBB COc1ccc([C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])N(C)C)cc1OC 5638110 FCAZPQZPJLFFSQ-KRWDZBQOSA-N 423.491 2.730 5 40 HFBB CN(C)[C@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1Cl 23192439 CFMHPTKVBMGYSU-GOSISDBHSA-N 414.853 2.862 5 40 HFBB CCN(CC)S(=O)(=O)c1cc(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)n(C)c1 25834005 QAKBIASUTUHZFW-AWEZNQCLSA-N 422.507 2.797 5 40 HFBB CC1CCC(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 28276286 GJFZZTQQKZRPNK-JTTJXQCZSA-N 409.508 2.833 5 40 HFBB O=C(NCc1cccs1)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 28276351 SUPNBTBUHCBZJV-INIZCTEOSA-N 409.489 2.516 5 40 HFBB COC(=O)c1ccc([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1 408567778 RHYRRVXJDJJTPF-LMVRJCEZSA-N 407.426 2.528 5 40 HFBB C[C@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)Nc1cccc([N+](=O)[O-])c1 9074163 XNLJAVMDSWJMDH-JTQLQIEISA-N 401.400 2.823 5 40 HFBB COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)NC(C)C 8475952 KZKLWACPOCZXMF-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB CCOC(=O)N1CCc2c(sc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C(N)=O)C1 9347496 XPIIMRFGNXCHRQ-UHFFFAOYSA-N 418.431 2.522 5 40 HFBB C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCC(=O)Nc2ccc(F)cc2)C1=O 40122854 WZSRYFBSLSKQAL-LJQANCHMSA-N 400.366 2.530 5 40 HFBB Cc1cccc(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 408618688 DYNIUBVNYZEVAT-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB COc1cc(OC)cc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 3397717 UZOMGHHEPPHLQO-NSHDSACASA-N 404.375 2.805 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3Cl)C2=O)cc1[N+](=O)[O-] 3593773 HKAQIIXPXXGSNI-IBGZPJMESA-N 416.821 2.962 5 40 HFBB COc1ccccc1CC(=O)N1CCC(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 72054293 NEVMLXYDMXTQPL-UHFFFAOYSA-N 411.458 2.875 5 40 HFBB CCc1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCS(=O)(=O)C2)cc1 5046866 HDQUDSRSIYLPSC-IBGZPJMESA-N 402.472 2.987 5 40 HFBB Cc1cccc(N2C[C@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)c1C 7802878 CXMLVLDLXKNKLA-GOSISDBHSA-N 422.485 2.913 5 40 HFBB CCc1ccc(CC)c(CNC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 224145015 FCGFFHVWIPRBRD-UHFFFAOYSA-N 419.503 2.802 5 40 HFBB CC(C)CNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408589095 DPTMDTPNFDXOFE-AWEZNQCLSA-N 421.475 2.935 5 40 HFBB COc1ccc(C(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 408662278 XPFQOSSDTODSQW-OAHLLOKOSA-N 412.398 2.691 5 40 HFBB CC(C)CCNC(=O)CN(c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1 6306686 LNJZWUFKDGQNPT-UHFFFAOYSA-N 405.476 2.952 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@H](c2ccc(F)cc2)n2nnnc2N3)cc1 10296241 YCSVEDZFFOBPPG-INIZCTEOSA-N 406.337 2.578 5 40 HFBB CCN1C[C@@H](CN(C)C(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)Oc2ccccc21 7257053 XOKFSRZHCOUPQO-QGZVFWFLSA-N 413.430 2.741 5 40 HFBB O=C(Cn1cnc([N+](=O)[O-])n1)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 40154872 FTNFPEGKHYJXCZ-CQSZACIVSA-N 406.358 2.903 5 40 HFBB CC(=O)Nc1cccc(OCCCNC(=O)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 2570395 SGQYJTUYBVDIBG-UHFFFAOYSA-N 424.413 2.803 5 40 HFBB CN(C)CCCNC(=O)/C(=C\C=C\c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 4844314 BSEGQPBXJHNEMQ-RWCNVDKMSA-N 422.485 2.990 5 40 HFBB C[C@@H]1CCCN(c2ccc(C(=O)OCC(=O)NCC(F)(F)F)cc2[N+](=O)[O-])C1 7739662 HAWQBSUTFDTVRB-LLVKDONJSA-N 403.357 2.666 5 40 HFBB CC[C@@H](C)N1C(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@@H]32)C(=O)NC1=S 8744282 LKTGDKWMAZNANQ-CBLJQSSYSA-N 416.503 2.538 5 40 HFBB CCOc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])c1 13771054 XGZNWODIHIJQGO-UONOGXRCSA-N 414.487 2.971 5 40 HFBB O=C(CSc1nnc(-c2ccncc2)s1)Nc1cc(C(=O)O)cc([N+](=O)[O-])c1 15021547 WYSOMFAMZKBPRO-UHFFFAOYSA-N 417.428 2.937 5 40 HFBB COc1ccc(CN2CCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1F 24978010 XTASZJUYWCHGLR-UHFFFAOYSA-N 423.466 2.557 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(NC(=O)/C=C/c4ccc([N+](=O)[O-])cc4)cnc32)cc1 10251699 KLLZHPAKVDBMJT-IZZDOVSWSA-N 416.397 2.582 5 40 HFBB O=C(c1ccc(O)cc1)C1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 14199552 IUFNBZMMJKRKPR-UHFFFAOYSA-N 412.398 2.807 5 40 HFBB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 39985201 HUIKNNGNGJEJPW-UHFFFAOYSA-N 407.448 2.609 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1OCCOc1ccc(F)cc1 4579908 FJNWILHREGDXGO-UHFFFAOYSA-N 410.423 2.976 5 40 HFBB CCc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 8064218 NVWABKGLXPPOSJ-MSOLQXFVSA-N 401.444 2.769 5 40 HFBB O=C(Nc1cc(O)nc2nc(CCc3ccccc3)nn12)c1ccccc1[N+](=O)[O-] 17017014 KPPZJYUNAULRNN-UHFFFAOYSA-N 404.386 2.776 5 40 HFBB CC[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1cccc(OC)c1)S(C)(=O)=O 220619820 QNYNNBHREULRDY-QGZVFWFLSA-N 407.448 2.787 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CCCC(=O)NCc1ccc(F)cc1)S(C)(=O)=O 222377832 TWENHRKSRFNLFL-UHFFFAOYSA-N 423.466 2.905 5 40 HFBB O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 4778054 IMOFNYKBBDWGEE-UHFFFAOYSA-N 414.378 2.885 5 40 HFBB C[C@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1)c1ccc(F)cc1 12641716 BZBUXYWGBDLYMF-ZDUSSCGKSA-N 409.439 2.928 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 15533901 UQSGQVXQTHMETA-UHFFFAOYSA-N 420.809 2.884 5 40 HFBB COc1c(F)c(F)c(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2O)c(F)c1F 17091765 PBMIIZSNAPGENH-UHFFFAOYSA-N 419.312 2.992 5 40 HFBB O=[N+]([O-])c1ccc(CSC2=N[C@H]3CS(=O)(=O)C[C@H]3N2c2ccccc2)cc1 32640668 BZEMBVCEVLXDTJ-DLBZAZTESA-N 403.485 2.870 5 40 HFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cc2c(cc1Br)OCO2 7158204 UJDBHAPRNUYJRU-UHFFFAOYSA-N 405.160 2.882 5 40 HFBB COc1ccc(-c2ccc(C(=O)Nc3ccc(S(N)(=O)=O)cc3)o2)c([N+](=O)[O-])c1 8753725 IANPWEAQUOKKAY-UHFFFAOYSA-N 417.399 2.763 5 40 HFBB COCC(=O)Nc1ccc(C(=O)Nc2nnc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 9062450 RKHUNVABKZRPBT-UHFFFAOYSA-N 413.415 2.951 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1Cl)NCC(=O)Nc1ccc(F)c(F)c1F 9119923 FEFXGHCBXRRSIE-UHFFFAOYSA-N 417.727 2.799 5 40 HFBB COc1cccc([C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c2nccn2C)c1 12551337 NQMHMDYXZVSRMB-GOSISDBHSA-N 416.459 2.942 5 40 HFBB CCOC(=O)[C@H]1CCCN(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 14787641 XNMFRESAWUHPMA-AWEZNQCLSA-N 418.475 2.932 5 40 HFBB Cc1c(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cccc1[N+](=O)[O-] 33158687 FPYHUSQEDUCDAX-OAHLLOKOSA-N 403.460 2.943 5 40 HFBB CCN1C[C@@H](CN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)Oc2ccccc21 95428523 SEOKBTONWOFXIW-CQSZACIVSA-N 413.430 2.726 5 40 HFBB C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)Nc2ccccc2O)CC1 12749939 HNGAYTLLHNORPC-AWEZNQCLSA-N 412.446 2.978 5 40 HFBB Cc1cc(S(N)(=O)=O)cc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)c1C 24227820 XKRNWLQHINRAQI-UHFFFAOYSA-N 413.839 2.530 5 40 HFBB O=[N+]([O-])c1ccc(CSC2=N[C@H]3CS(=O)(=O)C[C@@H]3N2c2ccccc2)cc1 32640666 BZEMBVCEVLXDTJ-IRXDYDNUSA-N 403.485 2.870 5 40 HFBB CC[C@@H](NC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O)c1ccccc1 44948349 ZRCGNBJMBCKOHC-MRXNPFEDSA-N 421.475 2.637 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2ON=C(c3ccc(Cl)cc3)[C@@H]2C1=O 102562226 GNNCAMFHTUDLJS-HOCLYGCPSA-N 401.762 2.549 5 40 HFBB C[C@@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc2c(c1)CCC2 223174420 NFRVYYJKQCGRRQ-CQSZACIVSA-N 417.487 2.727 5 40 HFBB O=C(O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Br)cc1 224734824 WADWCWRNYQZDEY-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB COC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224785981 LOQIZLZFLMEXSQ-UHFFFAOYSA-N 400.359 2.550 5 40 HFBB O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 225084555 NBOWUNLRKQTYCY-UHFFFAOYSA-N 409.807 2.702 5 40 HFBB COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 6844658 SHMHYUCYSOFNKY-ZDUSSCGKSA-N 407.448 2.526 5 40 HFBB O=C(c1ccc([N+](=O)[O-])s1)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 31042795 KPDNZKKWLPKFFJ-UHFFFAOYSA-N 405.461 2.726 5 40 HFBB CCOC(=O)C[C@@H](C)CNc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] 89969055 RUGKQQOJPWOOCN-CYBMUJFWSA-N 401.485 2.627 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 8433896 BHZRKMZMORXXCZ-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=[N+]([O-])c1ccc(N2C(=S)N(c3ccc(F)cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 12421628 YHAQKJMTFXCZJQ-JKSUJKDBSA-N 407.448 2.511 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCc2nc(C(C)(C)C)no2)c([N+](=O)[O-])c1 13001374 ULMMPIMTSUCILL-UHFFFAOYSA-N 412.468 2.885 5 40 HFBB Cc1c(N(CC(=O)NCc2ccccc2Cl)S(C)(=O)=O)cccc1[N+](=O)[O-] 220029910 KCAKWTZPLNRIMJ-UHFFFAOYSA-N 411.867 2.639 5 40 HFBB O=c1c2ccccc2nc(SCCOc2cccc([N+](=O)[O-])c2)n1CCCO 40123078 CEHCVRXMPWVGIQ-UHFFFAOYSA-N 401.444 2.858 5 40 HFBB COc1ccccc1N1C(=O)c2cccc3c(NCCO)c([N+](=O)[O-])cc(c23)C1=O 95470802 AWJVVRSCHAICQV-UHFFFAOYSA-N 407.382 2.961 5 40 HFBB Cc1nnc(SCC(=O)NC(=O)c2cccc([N+](=O)[O-])c2)n1Cc1ccccc1 2616869 JIAYVEWRHBEBPL-UHFFFAOYSA-N 411.443 2.592 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9030193 NQSQSODDYSCIEY-HUBLWGQQSA-N 415.349 2.760 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(CCCc2ccccc2)CC1 35286704 WGOPLSRRJVPKGJ-UHFFFAOYSA-N 403.504 2.842 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@H](C)C2)CC1 43149611 APAAZJGSFAGIAD-HOTGVXAUSA-N 417.510 2.557 5 40 HFBB Cc1cc(C)cc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])c1 89585257 SIFZOLACUXTXIV-UHFFFAOYSA-N 406.460 2.812 5 40 HFBB O=C(O)CN(c1ccc(Br)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113876762 MLGHGHFXGSHQLG-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB COc1ccc(-c2nnc(CN(C)C(=O)Cc3ccc([N+](=O)[O-])cc3)o2)cc1OC 408714495 SACSYNUYEGHZGF-UHFFFAOYSA-N 412.402 2.863 5 40 HFBB CCOC(=O)C1=C(c2ccc([N+](=O)[O-])cc2)Nc2ncnn2[C@H]1c1cccc(O)c1 7987501 AEGOYKBFRRBTII-SFHVURJKSA-N 407.386 2.881 5 40 HFBB COc1ccc2c(=O)c3c(oc2c1)C(=O)N(CCN(C)C)[C@H]3c1cccc([N+](=O)[O-])c1 9215842 RJIJWOYXODVFAL-IBGZPJMESA-N 423.425 2.817 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc3n2[C@H](CS(=O)(=O)c2ccccc2)CS3)cc1 9614813 MHTLFQVCUHKZGT-AWEZNQCLSA-N 402.457 2.974 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H]3CCCN3[C@H](C(=O)c3ccccc3)[C@@H]2C1=O 20190816 QWNBLHFUXGLTON-NBYUQASBSA-N 419.437 2.738 5 40 HFBB COc1cccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 29111664 WAESMWNMTHGTAF-UHFFFAOYSA-N 403.822 2.855 5 40 HFBB NC(=O)c1cc([N+](=O)[O-])cn(Cc2csc(Cc3ccc(Cl)cc3)n2)c1=O 32331744 UALXDYJHTRZATP-UHFFFAOYSA-N 404.835 2.604 5 40 HFBB Nn1c(SCC(=O)Nc2ccc(O)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1 409157357 IWLLJTMXAVTDIY-UHFFFAOYSA-N 420.838 2.657 5 40 HFBB Cc1ccc(C(=O)COC(=O)[C@H](C)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C 6033133 ODAOHTVTBBDHEC-ZDUSSCGKSA-N 410.382 2.622 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 13427040 HRGJNHXILMPDRT-XUJVJEKNSA-N 415.349 2.760 5 40 HFBB COc1ccc(N([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 6478245 OWVGAUVCZBKWDW-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COC[C@@H](C)NS(=O)(=O)c1ccc(Sc2nc(C)c(C)o2)c([N+](=O)[O-])c1 12764470 OAWAEYGETSVLMV-SECBINFHSA-N 401.466 2.664 5 40 HFBB C[C@H]1CN(C(=O)COC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C[C@@H](C)O1 14093371 QBKNIJQHWIXGQR-IYBDPMFKSA-N 419.478 2.768 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1C 408701748 DYYPSLGUDXTQJC-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]2[C@H]2C=Cc3ccccc3N12 248380758 RCHZZIMMUJUXMH-IYWMVGAKSA-N 403.394 2.574 5 40 HFBB COc1cc(OC)c(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 2631797 IDUJJMFFYBZRRM-LLVKDONJSA-N 404.375 2.805 5 40 HFBB Cc1cc(C)nc(SCC(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1 4565052 XEFMUWQTWWETFR-UHFFFAOYSA-N 410.839 2.929 5 40 HFBB COc1cn(CC(=O)Nc2cccc([N+](=O)[O-])c2)c(CN2CCC(C)CC2)cc1=O 9621992 MJMPGFDBKCVMRE-UHFFFAOYSA-N 414.462 2.636 5 40 HFBB O=[N+]([O-])c1ccc([C@H](c2nnnn2-c2cccc(Cl)c2)N2CCOCC2)cc1 20149858 SIKGSOCWGQSONS-QGZVFWFLSA-N 400.826 2.646 5 40 HFBB C[C@H]1CCCN(c2nc(N)c([N+](=O)[O-])c(N3CCN(Cc4ccccc4)CC3)n2)C1 54147650 WDNKTSCSAZDHDZ-INIZCTEOSA-N 411.510 2.526 5 40 HFBB O=C(CSCc1ccc([N+](=O)[O-])cc1)NCc1cccc(CN2CCOCC2)c1 224706708 VNEKKBBDZHGUKG-UHFFFAOYSA-N 415.515 2.977 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 408685144 OULAJMANMABAGB-QGZVKYPTSA-N 417.421 2.959 5 40 HFBB COc1ccc(N2C[C@H](C(=O)OCc3cccc([N+](=O)[O-])c3)CC2=O)c(OC)c1 11834102 ARNWWWSRTFJHQH-CQSZACIVSA-N 400.387 2.708 5 40 HFBB COc1cccc([C@@H]2CC(c3ccc([N+](=O)[O-])cc3)=NN2C(=O)CN2CCOCC2)c1 89469799 IFYDLRJUYTYKPW-NRFANRHFSA-N 424.457 2.613 5 40 HFBB COC(=O)c1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 6552972 XTVZBHUSAVULQS-NSHDSACASA-N 402.359 2.574 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N 9373547 ZOTUIPMIOZKZFT-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1cc(Cl)ccc1[N+](=O)[O-] 10251205 BEGSRWBPNOXAOM-UHFFFAOYSA-N 410.777 2.528 5 40 HFBB CCCNC(=O)[C@@H]1CN(CC(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2O1 18935866 ZVVGBHZYSTWMCB-IBGZPJMESA-N 412.446 2.636 5 40 HFBB CCc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3CCC(O)CC3)c(O)n2n1 22855189 QUGCLOXBAXGPLU-OAHLLOKOSA-N 403.464 2.513 5 40 HFBB COc1cc(OC)c([N+](=O)[O-])cc1/C=C1/SC(=O)N(CC(=O)OC(C)C)C1=O 409107185 QTITUUZENGKEGU-MKMNVTDBSA-N 410.404 2.600 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 32740686 VPSMEOYEICHHAZ-ZDUSSCGKSA-N 401.419 2.915 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NCC3(C)CCCCC3)cc2[N+](=O)[O-])CC1 84752555 GSNRCGPCJCYAQU-UHFFFAOYSA-N 402.495 2.964 5 40 HFBB CC(C)OC(=O)[C@@H]1C(=O)[C@@](C)(O)C[C@@H](C(=O)OC(C)C)[C@H]1c1ccc([N+](=O)[O-])cc1 13136536 DFQLPYSPKQLGGU-VWXURSGXSA-N 421.446 2.538 5 40 HFBB C[C@@H]1CCc2c(sc3ncn(C[C@@H](O)COc4cccc([N+](=O)[O-])c4)c(=O)c23)C1 24834119 QBMNIJQMUARYLB-TZMCWYRMSA-N 415.471 2.931 5 40 HFBB CCN(CC)[C@@H](CNc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])Cc1ccccc1 32814791 WCDFSFHMVTUYOD-QGZVFWFLSA-N 420.535 2.868 5 40 HFBB Cc1c(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cccc1[N+](=O)[O-] 33158688 FPYHUSQEDUCDAX-HNNXBMFYSA-N 403.460 2.943 5 40 HFBB O=C(OCc1ccc([N+](=O)[O-])cc1)C1CCN(S(=O)(=O)c2ccccc2)CC1 862022 GNVGMDBDVQJTSG-UHFFFAOYSA-N 404.444 2.739 5 40 HFBB Cc1cccc(N2C[C@H](C(=O)OCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2=O)c1 8037413 GDELSFLQZGSVIT-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1Nc1ccc2c(c1)OCCO2 6815909 QTUZQSHYQWZJPO-UHFFFAOYSA-N 405.432 2.894 5 40 HFBB COc1ccc(OCC(=O)N2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1 6953533 HJFMQDGCRCPCGF-UHFFFAOYSA-N 405.838 2.984 5 40 HFBB O=C(NC(=S)Nc1cccc(F)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17082828 IVTWDOAEXPNLCZ-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB CC[C@H](C(=O)N(C)Cc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222512952 QCIAHUHSYFSUTI-GOSISDBHSA-N 405.476 2.798 5 40 HFBB NNc1nc(Nc2ccccc2[N+](=O)[O-])nc(OC(C(F)(F)F)C(F)(F)F)n1 6445612 YMEQBDXEJDXDKI-UHFFFAOYSA-N 413.238 2.681 5 40 HFBB COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCN(c2ccccc2OC)CC1 8408102 ZVAHZZCDXQEGKY-UHFFFAOYSA-N 416.390 2.625 5 40 HFBB COc1cc([N+](=O)[O-])cc2sc(NC(=O)c3cccc(S(C)(=O)=O)c3)nc12 9712701 XURCMPORFUTOHN-UHFFFAOYSA-N 407.429 2.869 5 40 HFBB C[C@@H](NC(=O)c1ccccc1)C(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 71186328 OBAXJFMTIZOHCF-OAHLLOKOSA-N 412.446 2.568 5 40 HFBB CC(C)[C@@H]1CN(C)CCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] 78824951 RJMNBONACNGXKG-FQEVSTJZSA-N 424.567 2.936 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O 409135657 RQNZYYASCJRDCK-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB O=[N+]([O-])c1ccc(NCCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c(Cl)c1 9720930 OCZIOASKALNPTP-UHFFFAOYSA-N 414.827 2.937 5 40 HFBB O=C(c1ccc([N+](=O)[O-])s1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 12551920 BOZVWKNUAOSLBB-UHFFFAOYSA-N 421.909 2.518 5 40 HFBB C[C@@H]1CN(Cc2csc(NC(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)n2)C[C@@H](C)O1 12565000 JWWPIZJERLHMGC-CHWSQXEVSA-N 419.507 2.979 5 40 HFBB C[C@@H](Sc1nnc(C(F)(F)F)n1N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36791588 DAHUHOAKCYXRLP-RXMQYKEDSA-N 410.765 2.692 5 40 HFBB COc1ccc(C)cc1Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 89618867 RACUGFXYERVONQ-UHFFFAOYSA-N 407.448 2.676 5 40 HFBB C[C@H](CCc1ccccc1)NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220413736 KYSLIEMQBVEPFP-HZPDHXFCSA-N 419.503 2.887 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCCCS2(=O)=O)cc1 5099738 QNMOXHRDXGFKBN-UHFFFAOYSA-N 405.432 2.786 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCCC(=O)Nc2ccccc2)c1 8412943 TYUUUAUBRRQPBV-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB CN(C)c1ccc(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)cc1[N+](=O)[O-] 32806173 NZBCHBWNTBUXLJ-UHFFFAOYSA-N 409.446 2.781 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1OCc1ccccc1Cl 89814015 YNNCBSZMSMPCBH-UHFFFAOYSA-N 412.851 2.848 5 40 HFBB CCOc1cc(/C=C2/NC(=S)NC2=O)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 105647423 OSCNXLLHOOLPBH-RIYZIHGNSA-N 413.411 2.558 5 40 HFBB Cc1cc(S(=O)(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c([N+](=O)[O-])s1 1561425982 PPTYLQDHSDOIJB-WDEREUQCSA-N 419.525 2.983 5 40 HFBB COc1ccc(OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c([N+](=O)[O-])c1 7441744 DZYHLSAOBWMWAS-UHFFFAOYSA-N 405.432 2.660 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2ccc([N+](=O)[O-])s2)c1 9490992 HZMOELQGYASCSI-UHFFFAOYSA-N 413.477 2.948 5 40 HFBB Cc1cc(N2CCN(CC(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)nc(C(C)C)n1 15032454 CNEIUYIBZXGANY-UHFFFAOYSA-N 412.494 2.886 5 40 HFBB O=C(CSc1nccn1-c1ccc([N+](=O)[O-])cc1)NCc1ccc2c(c1)OCO2 2723739 INOUUWPBCAYUJZ-UHFFFAOYSA-N 412.427 2.918 5 40 HFBB Cc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cc1 9128525 YABWFRIIGHTIRM-UHFFFAOYSA-N 424.378 2.998 5 40 HFBB Cc1[nH]nc(O)c1C(c1cc([N+](=O)[O-])cc(Br)c1O)c1c(O)n[nH]c1C 27904398 ZMGZWGPKCQEZPY-UHFFFAOYSA-N 424.211 2.717 5 40 HFBB CC[C@@H](c1nnnn1Cc1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 35290758 MVGPZGRUWWCVPN-SFHVURJKSA-N 413.507 2.964 5 40 HFBB O=c1c2cc3c(=O)n(C4CCCCCC4)ccc3nc2ccn1CCN1CCOCC1 38829340 ULTGRPKORPSIGK-UHFFFAOYSA-N 422.529 2.939 5 40 HFBB CCOC(=O)c1c(C)nn2c1ncc1c(=O)n(-c3cc([N+](=O)[O-])ccc3C)ccc12 40397935 QCKRLJLRLVLUHW-UHFFFAOYSA-N 407.386 2.735 5 40 HFBB CCOc1ccc([C@H]2CC(=O)N(Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2=O)cc1 100434874 FHLIDJUQFANQQG-CQSZACIVSA-N 400.347 2.771 5 40 HFBB CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])o2)sc2c1CCN(C(C)=O)C2 12378158 MNAIBLICVQWZRE-UHFFFAOYSA-N 407.404 2.583 5 40 HFBB O=C(NCCc1ccccn1)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 36392177 GWFVKSNYSPYPQR-UHFFFAOYSA-N 416.865 2.854 5 40 HFBB COc1ccc(-c2noc(CNC(=O)/C=C/c3cccc([N+](=O)[O-])c3)n2)c(OC)c1 217890983 UJJIFUHVHWMCKP-RMKNXTFCSA-N 410.386 2.992 5 40 HFBB CC(C)OC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC(C)C)C(=O)C[C@]1(C)O 4142553 LTAJSQLTORSAHL-UGNRZPKXSA-N 421.446 2.538 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCOCCOCCOCCO2 4311176 CYTOLFDVJSUOQU-UHFFFAOYSA-N 417.414 2.647 5 40 HFBB O=C(O)c1ccc(CCNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)cc1 6821113 RWMIDJPDQHEQDW-UHFFFAOYSA-N 419.459 2.732 5 40 HFBB Cc1cccn2cc(COc3ccc(S(=O)(=O)N4CCCC4)cc3[N+](=O)[O-])nc12 8394724 LQTYKYZNELFTOY-UHFFFAOYSA-N 416.459 2.914 5 40 HFBB CCOC(=O)c1sc(NC(=S)NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)nc1C 27837519 FBTORUOSMRQWCA-UHFFFAOYSA-N 424.460 2.672 5 40 HFBB Cc1cccc(CNC(=O)[C@@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220394068 GHADMNVFUJTTJM-OAHLLOKOSA-N 405.476 2.683 5 40 HFBB CCOc1ccccc1N1C[C@H](C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)CC1=O 408641836 DCBIKPSDIJKTMV-OAHLLOKOSA-N 412.398 2.773 5 40 HFBB CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc2c(c1=O)S[C@@H](C)C2 4107912 AJBRTLYATZNCJM-JTQLQIEISA-N 406.489 2.939 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 8245854 KAQAJZXFPQXFRU-AWEZNQCLSA-N 401.394 2.772 5 40 HFBB O=C(CN1CC(=O)Oc2ccccc21)Nc1cc([N+](=O)[O-])ccc1Br 938297 JADKHTLKNLXDIM-UHFFFAOYSA-N 406.192 2.721 5 40 HFBB O=[N+]([O-])c1cccc([C@H]2c3c(/C=C/c4ccccc4)nnc(O)c3Nc3nnnn32)c1 10297886 JBUUWACJXLCHMW-BBVFFXRHSA-N 414.385 2.942 5 40 HFBB CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Cn1cnc([N+](=O)[O-])c1 12544709 ZHRASYRSMWYASZ-UHFFFAOYSA-N 404.814 2.932 5 40 HFBB COc1ccc(S(=O)(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)cc1[N+](=O)[O-] 12550636 VLLOOTIXKLLYQB-CYBMUJFWSA-N 402.432 2.829 5 40 HFBB CCOC(=O)C1=C(COc2cccc([N+](=O)[O-])c2)NC(=O)N[C@H]1c1ccc(C)o1 31676957 FOSVSSVDWCORMI-KRWDZBQOSA-N 401.375 2.746 5 40 HFBB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1=O 408548524 IDSLBKIFEHXKSO-NTUHNPAUSA-N 405.750 2.574 5 40 HFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CNc1ccc(I)cc1 777999 PXTNZUPARZRESR-UHFFFAOYSA-N 423.166 2.865 5 40 HFBB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@@H](C)Oc1ccccc1[N+](=O)[O-] 7777444 BEVACMACDIVIJJ-CYBMUJFWSA-N 407.448 2.560 5 40 HFBB Cc1n[nH]c(O)c1C(c1cc(Br)cc([N+](=O)[O-])c1O)c1c(C)n[nH]c1O 9434737 QWSNUJFAOJDBKV-UHFFFAOYSA-N 424.211 2.717 5 40 HFBB CCCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)c1c(N)n(CCCC)c(=O)[nH]c1=O 13041226 RMLPHQBEUMNWAG-UHFFFAOYSA-N 417.466 2.582 5 40 HFBB O=C(Nc1ccccc1[N+](=O)[O-])C1CCN(S(=O)(=O)c2ccccc2F)CC1 19159301 MVXJIIOPSTYEBI-UHFFFAOYSA-N 407.423 2.773 5 40 HFBB CSc1n[nH]c(-n2ccc3nc4ccn(-c5cccc(C)c5)c(=O)c4cc3c2=O)n1 40398889 LESAWXRUDGWWCS-UHFFFAOYSA-N 416.466 2.838 5 40 HFBB O=C(CN(C(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)CCC1=O)c1ccc(Cl)cc1 408678133 CPUHKMIPUXNHFW-UHFFFAOYSA-N 415.789 2.637 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1c(OC)cccc1OC 3394722 GRJDBZNZPXMHQR-NSHDSACASA-N 404.375 2.805 5 40 HFBB CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)/C=C/c2cccs2)CC1 40118504 XGVUHFQXCLCSFC-SOFGYWHQSA-N 414.487 2.720 5 40 HFBB CC1CCN(c2nc(N)c([N+](=O)[O-])c(N3CCN(Cc4ccccc4)CC3)n2)CC1 54147641 DUAUCJJZZKRNGK-UHFFFAOYSA-N 411.510 2.526 5 40 HFBB CCc1ccc([C@@H](C)NC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 58166156 NIQNISOPEHYAKJ-CQSZACIVSA-N 405.476 2.703 5 40 HFBB Cc1cc(NC(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)n(-c2ccc(F)cc2)n1 89595664 GODYZQKPULBSRG-UHFFFAOYSA-N 405.773 2.682 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)[C@@H]1C[C@@H]2[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@H]12 100204837 NZMQAHHANQBGMI-XUBKROCYSA-N 403.394 2.769 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 408594301 OJCZVUODFYMARC-CYBMUJFWSA-N 407.448 2.607 5 40 HFBB Cc1c(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C 3234729 NNBAALUKDRACBW-CQSZACIVSA-N 424.413 2.577 5 40 HFBB O=C1[C@H]2[C@H]3C[C@@H]([C@@H]2C(=O)N1c1ccccc1)[C@H]1ON=C(c2ccc([N+](=O)[O-])cc2)[C@H]31 4744606 LOGYSZUFTVYLIL-ARHBBURHSA-N 403.394 2.769 5 40 HFBB Cc1cccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@H]32)c1C 7718541 YHYACIYGZHMSTF-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB CC(=O)c1cccc(NC(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 8416345 QJTLGULMOXYPPZ-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB CCOC(=O)CN(c1cccc(OC)c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224769777 GJXLLOZBAAMXRS-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=C1CCCN1C[C@H]1CC[C@]2(COCCN(Cc3c(Cl)cccc3[N+](=O)[O-])C2)O1 306127713 GFLHNVRLLUGWJJ-QRWLVFNGSA-N 423.897 2.621 5 40 HFBB O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 9356427 VTXKKOQLKJRCIM-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB CNc1ccc(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] 29999896 HZRRYHMFRFAACV-OAQYLSRUSA-N 411.506 2.745 5 40 HFBB COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 32855673 RCGSWNBNQFAWPK-UHFFFAOYSA-N 400.796 2.829 5 40 HFBB CCCCC(=O)/N=c1/c(C(=O)OCC)cc2c(=O)n3ccccc3nc2n1CCC 103627731 MISXUYNJBCDWIU-GFMRDNFCSA-N 410.474 2.853 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4144326 DXBNEPDFCBIQJD-GRDNDAEWSA-N 409.320 2.699 5 40 HFBB CN(C)CCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@@H]1c1cccc([N+](=O)[O-])c1 8374060 PLBBENKTWOWIDZ-SFHVURJKSA-N 411.389 2.947 5 40 HFBB CC(=O)c1cccc(NC(=O)CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 8415429 DASKQWOUBVXIOZ-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 97111794 KVUJUTLOSRBHAX-IEBWSBKVSA-N 415.421 2.890 5 40 HFBB COC(=O)C1=C(O)[C@@H](C(=O)OC)[C@H]2c3ccccc3[C@H]1[C@]2(c1ccccc1)[N+](=O)[O-] 106601733 WPDBGDWRNAAKCD-VXCZRNDOSA-N 409.394 2.828 5 40 HFBB Cc1ccc2nc3nc(NC[C@@H]4CCCO4)c(C(=O)NC4CCCC4)cc3c(=O)n2c1 19234377 OELHHNUKKORPEZ-INIZCTEOSA-N 421.501 2.814 5 40 HFBB O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 32769117 VMCMRLXAJNQLMR-PKOBYXMFSA-N 400.431 2.943 5 40 HFBB CCOC(=O)c1c(C)nn2c1ncc1c(=O)n(-c3ccc([N+](=O)[O-])cc3C)ccc12 40397913 RRINRQYJKWKNII-UHFFFAOYSA-N 407.386 2.735 5 40 HFBB CCCCn1ccc2nc3ccn(-c4[nH]nc(C)c4C(=O)OCC)c(=O)c3cc2c1=O 40399087 KZZNSCKVBQCNNV-UHFFFAOYSA-N 421.457 2.709 5 40 HFBB CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccc(C)cc2)c1=N 100851439 HZYMTQVJOSXODI-UHFFFAOYSA-N 402.454 2.971 5 40 HFBB COC(=O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225010052 ORBAEWQNZYFXEW-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB COc1ccc(OC)c([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])c1 408564922 GLHWNMJRVGJKMP-RJJVWVDVSA-N 409.442 2.758 5 40 HFBB Cc1ccc(CN2C[C@@H](C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2=O)cc1 6579691 CZEWYGJSUBIROF-IBGZPJMESA-N 422.485 2.601 5 40 HFBB COCCNC(=O)COc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13 6624632 GAIMSXWOUWAKHC-UHFFFAOYSA-N 401.422 2.733 5 40 HFBB biogenic CCCCNC(=O)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 7813877 RDJGVXQNGNELJJ-UHFFFAOYSA-N 403.888 2.565 5 40 HFBB COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(-n3ccnc3)cc2)cc1[N+](=O)[O-] 12550634 VLLOOTIXKLLYQB-ZDUSSCGKSA-N 402.432 2.829 5 40 HFBB Cc1ccc(C(=O)Nc2cc3c(cc2N2CCCC2)n(C)c(=O)n3C)cc1[N+](=O)[O-] 20178572 NLNOLSNAQRHTJW-UHFFFAOYSA-N 409.446 2.946 5 40 HFBB O=C(C1=NO[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]12)c1ccc2ccccc2c1 100355300 RXODAPJODQJMQG-PXNSSMCTSA-N 415.361 2.875 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1cc(OC)c(OC)c(OC)c1 6136384 XDVARXXJLDEGIZ-UHFFFAOYSA-N 421.431 2.756 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(O)c([N+](=O)[O-])c1 33912066 AFQVGTGXKPJKNQ-GOSISDBHSA-N 422.401 2.828 5 40 HFBB CN(C)C1CN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 95448389 SYSQZDWNAHSUEN-UHFFFAOYSA-N 405.458 2.762 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)O)S(=O)(=O)c1ccc(SC)cc1 224988847 CCHCAMOKJXPAAC-UHFFFAOYSA-N 412.445 2.605 5 40 HFBB CCOC(=O)c1sc2ncn(CC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)c2c1C 408602078 AHDXAOGXJTVPEM-UHFFFAOYSA-N 401.400 2.734 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)OCC(=O)c2ccc(C)cc2)CC1=O 408654780 QUJUPQCJFSOQLE-OAHLLOKOSA-N 412.398 2.691 5 40 HFBB Cc1cc(S(=O)(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c([N+](=O)[O-])s1 1561425981 PPTYLQDHSDOIJB-QWRGUYRKSA-N 419.525 2.983 5 40 HFBB COc1c2c(cc3c1[C@H](C[C@@H](O)c1ccc4c(c1)OCO4)[N+](C)(C)CC3)OCO2 1824627 JDIXVBCUSZMZDF-JKSUJKDBSA-N 400.451 2.950 5 40 HFBB biogenic COC(=O)c1c(NC(=O)c2cccc([N+](=O)[O-])c2)sc2c1CCN(C(C)=O)C2 4281075 OXSDILKZLVTZJP-UHFFFAOYSA-N 403.416 2.600 5 40 HFBB Cc1ccccc1OCCOC(=O)c1cc([N+](=O)[O-])ccc1Sc1nnnn1C 9254908 LAKRAKYHQFAWFE-UHFFFAOYSA-N 415.431 2.814 5 40 HFBB O=C1C[C@@H](c2ccccc2)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCN1 47229263 ZKINDVMGQKCJDH-IBGZPJMESA-N 408.458 2.898 5 40 HFBB CCSc1nc2c(c(=O)[nH]1)[C@H](c1ccc([N+](=O)[O-])cc1)C(C(=O)OC)=C(C)N2 100821689 HKKZFSTZVIXJDN-CYBMUJFWSA-N 402.432 2.795 5 40 HFBB O=C(Nc1c2c(nn1-c1ccc(F)cc1)CS(=O)(=O)C2)c1ccc([N+](=O)[O-])cc1 3009282 BJPBKLIYTNJLPW-UHFFFAOYSA-N 416.390 2.600 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4263335 KCHCKPCXEDFKQB-JKIFEVAISA-N 409.320 2.699 5 40 HFBB CNS(=O)(=O)c1ccc(N[C@H](c2ccccc2F)c2nccn2C)c([N+](=O)[O-])c1 12604245 ZKQXMRWLXMBACQ-QGZVFWFLSA-N 419.438 2.577 5 40 HFBB COc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 3563205 ILXJEXAUSWRHOB-NSHDSACASA-N 400.420 2.698 5 40 HFBB Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 9612647 WPQCRBPNZNLKHJ-UHFFFAOYSA-N 423.878 2.703 5 40 HFBB Cn1c(=O)/c(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)s/c1=C/C(=O)C(C)(C)C 96924524 PRIQCJDMVOMASG-UCXDMDGBSA-N 412.467 2.840 5 40 HFBB CCn1c(=N)c(S(=O)(=O)c2ccc(C)c(C)c2)cc2c(=O)n3ccccc3nc21 101234708 LEYAWLYPJDTGNA-UHFFFAOYSA-N 408.483 2.598 5 40 HFBB CC1CCN(C(=O)CN2C(=O)S/C(=C/c3ccc(O)c([N+](=O)[O-])c3)C2=O)CC1 409345727 NEEXVRZXLDAJJI-OQLLNIDSSA-N 405.432 2.595 5 40 HFBB COC(=O)c1c(NC(=O)c2ccccc2[N+](=O)[O-])sc2c1[C@@H](C(=O)OC)CC2 1779912 HJXBIAZJAQUURT-JTQLQIEISA-N 404.400 2.898 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1nc(-c2ccc(F)cc2)no1 7293897 YXZRLYQIHWBNMF-UHFFFAOYSA-N 414.349 2.647 5 40 HFBB O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc1 45797614 MCHQGHXCFOSXSF-UHFFFAOYSA-N 409.895 2.896 5 40 HFBB O=[N+]([O-])c1cc2c(c(COc3nc4ccccc4nc3N3CCOCC3)c1)OCOC2 2624871 AJEBLSPBRSRKBW-UHFFFAOYSA-N 424.413 2.820 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NCc3ccc(C)c(F)c3)cc2[N+](=O)[O-])CC1 12488031 LWENIOZBXVUKDB-UHFFFAOYSA-N 414.437 2.641 5 40 HFBB O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 12691793 BZLARMSZNMFQNE-UHFFFAOYSA-N 416.459 2.862 5 40 HFBB O=C(NC(=S)Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 17092957 HNQDEDPYFGXYKJ-UHFFFAOYSA-N 422.413 2.836 5 40 HFBB O=[N+]([O-])c1ccc(-c2ncn(CN3CCN(CCOc4ccccc4)CC3)n2)cc1 29499748 YTVMIBBSKYAUBR-UHFFFAOYSA-N 408.462 2.507 5 40 HFBB CCCCn1nnc(NC(=S)NC(=O)c2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 35169129 GRXVJQODOLQTBH-UHFFFAOYSA-N 415.435 2.768 5 40 HFBB O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H](O)COc1ccc(C(F)(F)F)cc1 89782965 GNLPCGAOVVTCMM-AWEZNQCLSA-N 416.327 2.851 5 40 HFBB CO[C@H]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1 97082005 NLIMULGZCVRILZ-CVEARBPZSA-N 409.483 2.978 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1c(OC)cccc1OC 3394725 GRJDBZNZPXMHQR-LLVKDONJSA-N 404.375 2.805 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@H]([C@H]2C(=O)N1Cc1ccccc1)[C@H]1N=NN(c2ccccc2[N+](=O)[O-])[C@H]31 4581091 IFMAYTGULJHYIV-SHWJXYDWSA-N 417.425 2.970 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 4682288 ITXMRRQVYIEXHX-UHFFFAOYSA-N 403.460 2.943 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NCCCn1ccnc1 15206464 TUKUBBBZZWQJAI-UHFFFAOYSA-N 407.496 2.858 5 40 HFBB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 44842326 BGIFPHDIGPZFME-JXMROGBWSA-N 419.459 2.942 5 40 HFBB C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)Nc1cc([N+](=O)[O-])ccc1F 59741948 BSAZMUVMTDWZJD-FQEVSTJZSA-N 412.377 2.671 5 40 HFBB C[C@@]1(CCCO)CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] 95455255 IOETUVMIZMNXQB-IBGZPJMESA-N 411.524 2.901 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)N1CCCN1[C@H]2c1ccc(Cl)cc1 100765521 PSIPYZBNSNOTQZ-BZSNNMDCSA-N 412.833 2.784 5 40 HFBB COc1ccc(C)cc1NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220406345 DXFWVHKOBDGFAN-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB O=C(CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)Nc1ccc(F)c(F)c1F 5700426 RFXWKEFPHCRLRL-UHFFFAOYSA-N 408.336 2.955 5 40 HFBB Cc1c(C(=O)NCCN2C(=O)S/C(=C\c3cccnc3)C2=O)cccc1[N+](=O)[O-] 6235749 WTSRMFGVNDBHJR-YBEGLDIGSA-N 412.427 2.765 5 40 HFBB COCc1n[nH]c(-n2ccc3nc4ccn(C5CCCCCC5)c(=O)c4cc3c2=O)n1 40399000 YNYFUPKWFPFDAN-UHFFFAOYSA-N 420.473 2.860 5 40 HFBB CCOc1ccc(NC(=S)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])c1 102885030 XGZNWODIHIJQGO-ZIAGYGMSSA-N 414.487 2.971 5 40 HFBB biogenic COc1cc(Cl)c([C@@H]2[C@H](C)N[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408569715 XELHHTRKORBTQX-GKOWETKXSA-N 417.849 2.925 5 40 HFBB Nc1nc(N2CCOCC2)nc2nc3c(c(-c4cccc([N+](=O)[O-])c4)c12)C(=O)CCC3 20673555 ZXTLHORMXYXSKR-UHFFFAOYSA-N 420.429 2.538 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1Cc1ccccc1)[C@@H]1C[C@@H]2[C@H]2N=NN(c3ccccc3[N+](=O)[O-])[C@H]12 100137936 IFMAYTGULJHYIV-LLTUXKBDSA-N 417.425 2.970 5 40 HFBB Cc1ccc(OCCOc2ccccc2/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1 107568619 MLULPYCFSYVNPL-DHZHZOJOSA-N 409.398 2.908 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 169546534 HRGJNHXILMPDRT-HUBLWGQQSA-N 415.349 2.760 5 40 HFBB Cc1cccc(C)c1NC(=O)CNc1ccc(S(=O)(=O)NC(C)C)cc1[N+](=O)[O-] 6912986 NYBWVINNMYDDDN-UHFFFAOYSA-N 420.491 2.949 5 40 HFBB COc1ccc([C@H](C)NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 20035916 NEPWCIGWGVCHGI-AWEZNQCLSA-N 421.475 2.555 5 40 HFBB CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCC1(CCO)CCC1 95429402 XWVUWOWNJVFERS-MRXNPFEDSA-N 411.886 2.672 5 40 HFBB Cc1ccc2c(COC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc(=O)oc2c1 3297100 JFQVZGGLOMTYJO-UHFFFAOYSA-N 417.395 2.770 5 40 HFBB COc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c([N+](=O)[O-])c1 4071180 MEFUTHMUTLVQKL-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB O=c1c([N+](=O)[O-])c(N2CCN(c3ncc(Cl)cc3Cl)CC2)nc2ccccn12 40153811 YRXBHUIDTPBQEV-UHFFFAOYSA-N 421.244 2.631 5 40 HFBB COC(=O)[C@H](C)Oc1cc(O[C@@H](C)C(=O)OC)c2c(=O)c3ccccc3oc2c1 4083847 RETDYBOPJHDCOD-RYUDHWBXSA-N 400.383 2.827 5 40 HFBB biogenic COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2C(c3ccccc3Cl)=NO[C@H]2C1=O 103540535 SZRKLXYKGLFIIP-GOEBONIOSA-N 401.762 2.549 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H]1C[C@H]2CC[C@H]1C2 108921383 FWBOHCNVWBDEKI-WBTNSWJXSA-N 409.508 2.852 5 40 HFBB COc1ccccc1[C@@H](C)NC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 223235040 ZEZSQFGUPRVEPL-CQSZACIVSA-N 421.475 2.555 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OC)c(C)c1 224651355 CMCFQHKRNLQYSM-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@H]32)c1 4393684 ZFCSVHCGHLXAAN-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB CN(CCc1ccccc1)C(=O)[C@@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 8952485 YYHMTADYAPAZLY-OAQYLSRUSA-N 419.437 2.882 5 40 HFBB COc1cc([N+](=O)[O-])cc2sc(NC(=O)c3ccc(S(C)(=O)=O)cc3)nc12 9712754 VEBJWXGRDQOQHY-UHFFFAOYSA-N 407.429 2.869 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)cc1 16401068 JRPSUKYENLATSN-ATNYCFDYSA-N 419.393 2.864 5 40 HFBB O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cnc(Br)c(Br)c1 79098106 BTGVBPLUDLMEFC-UHFFFAOYSA-N 419.033 2.740 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@@H]([C@H]2C(=O)N1Cc1ccccc1)[C@H]1N=NN(c2ccccc2[N+](=O)[O-])[C@H]31 100137934 IFMAYTGULJHYIV-WAXGZZNISA-N 417.425 2.970 5 40 HFBB CC[C@@H](C(=O)NCc1ccc(C)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222518249 FTDPBVSAZFSZKR-SFHVURJKSA-N 405.476 2.764 5 40 HFBB CN(c1cccc(NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1)S(C)(=O)=O 409138914 JTGQACBNPHYAFQ-UHFFFAOYSA-N 409.489 2.863 5 40 HFBB COc1cc(OC)c([N+](=O)[O-])cc1/C=c1\sc2nc3cc(C)c(C)cc3n2c1=O 409394275 YAHOWELXGXYQMF-LSCVHKIXSA-N 411.439 2.999 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(=O)(=O)c1ccc(F)cc1 113890007 WQQLWKMRWOPHPE-UHFFFAOYSA-N 412.395 2.501 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 138679589 PTTRALHJPRJYPB-CPLUKWAASA-N 417.421 2.959 5 40 HFBB COc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1 6911599 DTVOIBQADBMKLL-AWEZNQCLSA-N 421.475 2.797 5 40 HFBB O=C(Cn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O)Nc1ccc([N+](=O)[O-])cc1 12237709 BESAAADVUHMPHL-UHFFFAOYSA-N 424.804 2.783 5 40 HFBB O=C(CCn1cnc2c(cnn2-c2ccccc2[N+](=O)[O-])c1=O)Nc1ccc(F)cc1 40127918 VFQCIZAMYFBULH-UHFFFAOYSA-N 422.376 2.658 5 40 HFBB COC(=O)Nc1cccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 48365864 VVUZEOWMFYQNTF-UHFFFAOYSA-N 400.395 2.522 5 40 HFBB CCOc1cc(CNCCNc2ccc([N+](=O)[O-])cc2)cc(Cl)c1OCC(N)=O 6870219 DQRQFNDFAVSTPN-UHFFFAOYSA-N 422.869 2.713 5 40 HFBB O=C(Cn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O)Nc1cccc([N+](=O)[O-])c1 12237707 SPAMRVXTBAOYAO-UHFFFAOYSA-N 424.804 2.783 5 40 HFBB O=C(Oc1ccccc1C(=S)N1CCOCC1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 13590266 IRYBJZCBJVYTBL-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB COc1cc(C(=O)N(C)Cc2ccccc2N2CCOCC2)c([N+](=O)[O-])cc1OC 24191331 XMFRUFOLNHQORL-UHFFFAOYSA-N 415.446 2.721 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(CCc2ccc(OC)cc2)c1=N 100753228 BCGSPTNQSYENJY-UHFFFAOYSA-N 418.453 2.557 5 40 HFBB biogenic CN1CCC(Oc2ccc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 216942030 CRLMPCMJNJSTOC-UHFFFAOYSA-N 405.476 2.546 5 40 HFBB COc1ccccc1NC(=O)CCCN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222685732 CNTZKPQZXGMUMI-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB COc1ccc([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1OC 408565069 HOXYDFPYJNRIGW-AQZFEABFSA-N 409.442 2.758 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1OCc1cn2ccccc2n1 4406192 HYICWIXDDSLUBL-UHFFFAOYSA-N 402.432 2.606 5 40 HFBB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 7370579 HHUXAPBYSXKHII-CQSZACIVSA-N 415.450 2.729 5 40 HFBB Cc1ccc2cc(C(=O)NCCNc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])[nH]c2c1 12521473 CKVHKHRXSFKRIW-UHFFFAOYSA-N 416.459 2.630 5 40 HFBB C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)Nc1cc([N+](=O)[O-])ccc1F 59741952 BSAZMUVMTDWZJD-HXUWFJFHSA-N 412.377 2.671 5 40 HFBB Cc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3C[C@H](C)O[C@@H](C)C3)c(O)n2n1 227726027 ICPNSURZCLNRLC-PGUXBMHVSA-N 403.464 2.912 5 40 HFBB COc1ccc([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1OC 408565071 HOXYDFPYJNRIGW-DQMRONCHSA-N 409.442 2.758 5 40 HFBB O=C(CN(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCC1=O)c1ccc(Cl)cc1 408640639 BGGORRKSLKJSBP-UHFFFAOYSA-N 415.789 2.637 5 40 HFBB O=[N+]([O-])c1ccc(NCCCc2ccccc2)c(S(=O)(=O)N2CCOCC2)c1 4499395 SCMVOMFDLKMGLK-UHFFFAOYSA-N 405.476 2.660 5 40 HFBB COc1ccc(C)cc1NC(=O)c1cccn(OCc2cccc([N+](=O)[O-])c2)c1=O 5054894 GFBPSHUZWGDKCJ-UHFFFAOYSA-N 409.398 2.955 5 40 HFBB C[C@H](Sc1nnc(-c2ccco2)n1N)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8923956 WRAOWRUBRUGPSC-QMMMGPOBSA-N 408.827 2.933 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1COc2ccccc2O1 24663362 MYMMAHGRTXFZOL-HNNXBMFYSA-N 401.419 2.565 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2-n2cncn2)cc1[N+](=O)[O-] 9442587 UEYWOQBTVWMPJO-UHFFFAOYSA-N 409.811 2.638 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C(=O)NC(C)C 10009033 CNQKFXDIOUEBKW-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB Cn1nc(-c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3Cl)c2)ccc1=O 10324786 SKRYWSROXKXKKI-UHFFFAOYSA-N 420.834 2.810 5 40 HFBB CCn1/c(=N\C(=O)CS(=O)(=O)c2ccc(F)cc2)sc2cc([N+](=O)[O-])ccc21 12237979 ZMUYVGZIRSBWQN-HTXNQAPBSA-N 423.447 2.671 5 40 HFBB CCOc1ccc(NC(=O)CNc2cc([N+](=O)[O-])ccc2NCCO)cc1OCC 15125685 UKMJGDBXBRAXFF-UHFFFAOYSA-N 418.450 2.847 5 40 HFBB O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCN(Cc3ccc(Cl)s3)CC2)c1 32775311 SUVNBFZIVSOWFR-HNNXBMFYSA-N 411.911 2.867 5 40 HFBB CCN1CCN(C(=O)[C@H](C)OC(=O)c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 89977277 VEIWXFDGSDHWNG-AWEZNQCLSA-N 401.419 2.564 5 40 HFBB COC(=O)c1ccc(CN2C(=O)S/C(=C/c3ccc(O)c([N+](=O)[O-])c3)C2=O)o1 107736482 PPDIREXIHXEMGR-VGOFMYFVSA-N 404.356 2.917 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 220030318 WPXZWJDVIDWVAV-UHFFFAOYSA-N 422.419 2.525 5 40 HFBB COc1cc(OCC(=O)NCC2(c3ccccc3)CCOCC2)ccc1[N+](=O)[O-] 225669289 DHDDYXKFZNRWJK-UHFFFAOYSA-N 400.431 2.847 5 40 HFBB COc1ccccc1OCCC(=O)OCC(=O)Nc1cc(OC)c([N+](=O)[O-])cc1C 6084362 OTJVKXFSFRZLCM-UHFFFAOYSA-N 418.402 2.871 5 40 HFBB CS(=O)(=O)c1ccccc1-c1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)o1 9707617 FTAYKTPQOTYSGM-UHFFFAOYSA-N 422.806 2.954 5 40 HFBB COC(=O)CN1C(=O)S/C(=C/c2cccn2Cc2ccccc2[N+](=O)[O-])C1=O 205670439 LSLDPOXPUJYCPM-OQLLNIDSSA-N 401.400 2.654 5 40 HFBB COc1ccc(C(=O)[C@H](C)OC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 408651214 NHTDSPPLKOPFHH-DZGCQCFKSA-N 412.398 2.771 5 40 HFBB O=C1[C@@H]2[C@@H](c3ccc(Cl)cc3)N3CCCN3[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 102681044 BNSAJMZXAPGHAE-KZNAEPCWSA-N 412.833 2.784 5 40 HFBB CCCn1/c(=N\C(=O)CC(C)C)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 103627814 IZSHLJROTOBHIS-GFMRDNFCSA-N 410.474 2.709 5 40 HFBB COC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(OC)c(C)c1 224653416 XOYSVXVQNVZGMN-UHFFFAOYSA-N 408.432 2.589 5 40 HFBB Cc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2-c2ccccc2O)cc1[N+](=O)[O-] 5350489 VRRKHCCQSQBGMB-UHFFFAOYSA-N 406.398 2.617 5 40 HFBB CN1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H](c2ccccc2)C1 45864740 RTJUMNDMZPJJGH-LJQANCHMSA-N 424.457 2.798 5 40 HFBB Cc1ccc(NS(=O)(=O)c2ccc(N[C@H]3CCC(=O)NC3)c([N+](=O)[O-])c2)c(C)c1 58201788 FPUSJAFWGWOXGD-AWEZNQCLSA-N 418.475 2.703 5 40 HFBB CCOc1ccc(-c2noc(CN(C)S(=O)(=O)c3ccccc3[N+](=O)[O-])n2)cc1 223581568 CTGYWBOCUYGJAM-UHFFFAOYSA-N 418.431 2.864 5 40 HFBB Cc1ccc(C(=O)NCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] 10299233 KQJOLSVWVWVKJI-UHFFFAOYSA-N 424.457 2.510 5 40 HFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 12864635 WKOPWWIYXVGEQY-ZDUSSCGKSA-N 403.460 2.750 5 40 HFBB O=C1[C@@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@H]2C(=O)N1c1cccc(Br)c1 18118193 FIEBQJVMPZGUTK-UKRRQHHQSA-N 416.187 2.650 5 40 HFBB NC(=O)c1cccc(COc2cccc(OCc3cccc(C(N)=O)c3)c2[N+](=O)[O-])c1 95982870 FUPQHKBLVUIQLD-UHFFFAOYSA-N 421.409 2.951 5 40 HFBB Cc1cc(Br)ccc1NC(=O)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1 2787987 VSKMGOLFNMJZRL-UHFFFAOYSA-N 405.212 2.817 5 40 HFBB Cn1c(=O)c2c(SC3CCCC3)nc(-c3cccc([N+](=O)[O-])c3)nc2n(C)c1=O 4341391 CYCIGWQJDFCLSQ-UHFFFAOYSA-N 413.459 2.637 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1C(=O)N1CCCC1 7361356 GQVFHIIGGLQSAV-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB COc1ccc(CNC(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)cn1 9736539 UPNCQTGIULALJN-UHFFFAOYSA-N 405.842 2.684 5 40 HFBB COc1cc(N2C(=O)[C@H]3ON=C(c4ccccc4Cl)[C@@H]3C2=O)c(C)cc1[N+](=O)[O-] 18119704 KJLCGKAQKQPAJY-RDJZCZTQSA-N 415.789 2.858 5 40 HFBB CC[C@H](NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O)c1ccccc1 20494125 XMJNGMHEQVEVBE-KRWDZBQOSA-N 405.476 2.937 5 40 HFBB CC[C@@H](C(=O)Nc1ccccc1OC)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222516594 XAHANZVGSHTASC-INIZCTEOSA-N 407.448 2.787 5 40 HFBB CCc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 408661116 OEWWOPAGNQFEDE-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB O=C1C[C@H](c2cccc([N+](=O)[O-])c2)[C@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 5578170 IKZBGIQAPPMHCZ-QGPMSJSTSA-N 408.332 2.948 5 40 HFBB O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCN1C(=O)c2ccccc2C1=O 9768091 GEMBCZXPXDYGBK-UHFFFAOYSA-N 423.303 2.822 5 40 HFBB CC(C)(C)n1nc2c(c1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])CS(=O)(=O)C2 3008413 IXAISCXIZSLWGE-UHFFFAOYSA-N 412.855 2.880 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)c1 4393610 VYVZQJKUYYPXIG-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB Cc1cccc(NC(=O)COc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])c1 4579935 VLXXAEKUMJTJMF-UHFFFAOYSA-N 419.459 2.705 5 40 HFBB CCN1CCN(c2ccc(C(=O)OC)cc2NC(=O)c2ccc([N+](=O)[O-])cc2)CC1 4711663 QCEXAUURCHVGJK-UHFFFAOYSA-N 412.446 2.776 5 40 HFBB Cc1ccccc1N1C[C@H](C(=O)OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1=O 8039622 KTRYFXGBUPYEFM-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=[N+]([O-])c1ccccc1[C@H]1c2c(-c3ccc(F)cc3)nnc(O)c2Nc2nnnn21 10232644 OLZNGHPYVXPTFC-INIZCTEOSA-N 406.337 2.578 5 40 HFBB COC(=O)c1ccc(COC(=O)c2cc(N3CCOCC3)ccc2[N+](=O)[O-])cc1 16297019 HVHFZGDPJQJSMV-UHFFFAOYSA-N 400.387 2.575 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1nc2n(n1)[C@H](c1ccccc1)CC(=O)N2 17029315 FXRPIVYFTQTTRJ-SCOAYWHSSA-N 404.386 2.770 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O 7323169 KGBOBOZFQPZUNI-UHFFFAOYSA-N 405.432 2.703 5 40 HFBB CN(C)S(=O)(=O)c1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1Cl 7653535 USVHMXDTLIKBPF-UHFFFAOYSA-N 413.839 2.516 5 40 HFBB CCOc1ccc(N2C[C@H](C(=O)OCC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 7881407 GAKFNCUFDQGUIW-OAHLLOKOSA-N 412.398 2.773 5 40 HFBB NC1=Nc2nc3cc4c(cc3n2[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)N1)OCCCO4 12549544 SQDNSRTURGLERA-MRXNPFEDSA-N 414.809 2.856 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 408685148 OULAJMANMABAGB-ZULIPRJHSA-N 417.421 2.959 5 40 HFBB NC(=O)CSc1nc2ccc(N3C(=O)c4cccc([N+](=O)[O-])c4C3=O)cc2s1 13388151 AEJYATKVHLCXAE-UHFFFAOYSA-N 414.424 2.583 5 40 HFBB O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 40115903 CMFDXNXNBXMTCT-MOPGFXCFSA-N 401.413 2.864 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 97111793 KVUJUTLOSRBHAX-MJGOQNOKSA-N 415.421 2.890 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(F)cc1F 220089952 ICXAZGHODBZVCH-UHFFFAOYSA-N 419.793 2.931 5 40 HFBB CCCCn1c(=N)c(C(=O)NCc2cccnc2)cc2c(=O)n3cccc(C)c3nc21 2107132 KKQUQLYOZWJHRV-UHFFFAOYSA-N 416.485 2.562 5 40 HFBB CSCC[C@H](NC(=O)COc1ccccc1)C(=O)OCc1ccc([N+](=O)[O-])cc1 12945200 XNQVXFFWWFFRDV-SFHVURJKSA-N 418.471 2.955 5 40 HFBB COc1ccc(-c2nc3n(n2)[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(=O)N3)cc1 20728778 APXZOSXIEMMISZ-INIZCTEOSA-N 422.401 2.692 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1C 409391857 OWXVGBHHRXMBJH-UHFFFAOYSA-N 421.475 2.916 5 40 HFBB COc1ccc2c(c1)C=C([N+](=O)[O-])[C@@H]([C@@H]1OC(C)(C)O[C@@H]1[C@H]1COC(C)(C)O1)O2 5741824 XCSPWLQVNNIZQE-XDNAFOTISA-N 407.419 2.745 5 40 HFBB O=[N+]([O-])c1ccc([C@H]2c3c(/C=C/c4ccccc4)nnc(O)c3Nc3nnnn32)cc1 10297880 IMFQSRHGBSRFMP-QKIXSCASSA-N 414.385 2.942 5 40 HFBB CCN(Cc1ccccc1)c1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-] 12561540 BOZWKQCCVOZNCG-UHFFFAOYSA-N 418.519 2.557 5 40 HFBB Cc1cc(C)c2c(n1)sc1c2ncn2nc([C@H]3CCCN(S(C)(=O)=O)C3)nc12 13643704 COFQZGRWCFRYTC-LBPRGKRZSA-N 416.532 2.643 5 40 HFBB Cc1cc(OS(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)cc1CN1CCOCC1 20218680 QKORDWHCNDFGRN-UHFFFAOYSA-N 406.460 2.812 5 40 HFBB CCSc1n[nH]c(-n2ccc3nc4ccn(CCC(C)C)c(=O)c4cc3c2=O)n1 40398903 ULLBMOMNUSQPRO-UHFFFAOYSA-N 410.503 2.977 5 40 HFBB O=[N+]([O-])c1ccc(NC[C@@H]2COc3ccccc3O2)c(S(=O)(=O)N2CCCC2)c1 5693672 QHFCNWBGMNBOQX-OAHLLOKOSA-N 419.459 2.631 5 40 HFBB Cc1cccc(C)c1NC(=O)[C@@H](c1ccc([N+](=O)[O-])cc1)N1CCN(CCO)CC1 20149788 CWAZCFZARFPIRI-OAQYLSRUSA-N 412.490 2.501 5 40 HFBB CCS(=O)(=O)C(Br)(Br)[C@H](O)c1ccc([N+](=O)[O-])cc1 96520877 CTQFRYINPOMNPQ-SECBINFHSA-N 417.075 2.507 5 40 HFBB COCCCNC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)OCc1ccccc1 409000787 XYZNRTINMQXAJX-IBGZPJMESA-N 415.446 2.585 5 40 HFBB COc1ccc(OC)c([C@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)c1 5523452 OAECXCTZWRADMY-GOSISDBHSA-N 412.402 2.879 5 40 HFBB COc1ccc(N([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 8331161 TURZIIYWNRJVLO-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB O=C(c1cccc(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])cc2-n2cnnc2)CC1 70461848 YGKAKTSPYJFIPY-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB NC(=O)[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)C(c1ccccc1)c1ccccc1 206479917 BHLIFRKNCINWDV-HXUWFJFHSA-N 403.438 2.940 5 40 HFBB COc1ccc(C)cc1N([C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220336439 DFUWZBBOCZVIJN-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COC(=O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224756773 YRIPLWFTEVGFTM-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB CCOC(=O)COc1c(I)cc(/C=C/[N+](=O)[O-])cc1OCC 1410946 XSQGZGGXBPVTKE-AATRIKPKSA-N 421.187 2.879 5 40 HFBB COc1ccc(-n2nc3c(c2NC(=O)c2ccccc2[N+](=O)[O-])C[S@](=O)C3)cc1 4106094 AWIHYCRHJDUJAB-GDLZYMKVSA-N 412.427 2.804 5 40 HFBB CN(C)[C@@H](CNc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccco1 5688279 HJMDSBDAQOLIDB-KRWDZBQOSA-N 408.480 2.687 5 40 HFBB O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 17092824 UXNZINVHWNOWGL-UHFFFAOYSA-N 421.866 2.607 5 40 HFBB O=C(O)CN(c1ccccc1Br)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113875423 QICOQHJAGJOKAK-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@H](c1cccc([N+](=O)[O-])c1)N=2 408731590 LZQVOQAJZLHMDM-MJSCBBHESA-N 415.471 2.567 5 40 HFBB CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H](c2cccs2)N2CCOCC2)s1 95455262 QIHVGCPJZGSIJY-GFCCVEGCSA-N 417.534 2.607 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)N1CCCN21 100851223 VSDIHQASPCYNQC-SQNIBIBYSA-N 412.833 2.784 5 40 HFBB CC[C@H](C(=O)NCCc1ccccc1)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 222530992 GLWMQKPPFYDIAW-GOSISDBHSA-N 419.503 2.807 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225034761 CJLZXXUYHYJVSX-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1Sc1nnc2ccccn12 13117302 IYIHWAHIULJEMK-UHFFFAOYSA-N 405.461 2.573 5 40 HFBB Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)cc1[N+](=O)[O-] 4714589 NEDQRVYONGPCQV-UHFFFAOYSA-N 412.402 2.718 5 40 HFBB O=C(Nc1ccccc1C(=O)NC1CC1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 7814075 XRVCQKMIKNHOIY-UHFFFAOYSA-N 410.430 2.576 5 40 HFBB CCCCn1c(=N)c(C(=O)NCc2ccc(F)cc2)cc2c(=O)n3ccccc3nc21 101158461 RPUIGYMFZRRDDD-UHFFFAOYSA-N 419.460 2.998 5 40 HFBB CC[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CSc1nc2ccccc2c2nc(=O)c(C)nn12 102581827 ZYPSJPLZINNVOK-ZTENYAIWSA-N 423.542 2.979 5 40 HFBB Cc1c(NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 2512874 GIFLAXBYLWYJIS-UHFFFAOYSA-N 422.850 2.847 5 40 HFBB Cc1cccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)c1C 4393626 PPNGIYAGNYOUGD-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB CCOC(=O)C1=C(O)C(=O)N(c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(O)c(OC)c1 20064906 OQYQIRGGWJQMFF-QGZVFWFLSA-N 414.370 2.772 5 40 HFBB COC(=O)c1ccoc1COC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 24108258 CUTFQASKHGVJIX-UHFFFAOYSA-N 401.274 2.941 5 40 HFBB C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1cnn(Cc2ccccc2)c1 24395248 UZUIMMBMEVQHJT-INIZCTEOSA-N 421.457 2.617 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2ON=C(c3ccc(Cl)cc3)[C@H]2C1=O 102562236 GNNCAMFHTUDLJS-GDBMZVCRSA-N 401.762 2.549 5 40 HFBB CCc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)cc1 5936280 YBPJCUKWTWRTLZ-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB CC[C@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222519204 RKJVLXWCRBMUOM-OAHLLOKOSA-N 421.431 2.507 5 40 HFBB Cc1c(O)ccc2c(COC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)cc(=O)oc12 8408629 CFIZHNYWJIHJDF-UHFFFAOYSA-N 413.338 2.843 5 40 HFBB CC(C)CN1C[C@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)CC1=O 59253233 LNOWHJJJIRVSFP-CQSZACIVSA-N 401.385 2.990 5 40 HFBB CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 72289308 NNHJJRZLYXDTND-YOEHRIQHSA-N 418.473 2.609 5 40 HFBB COC(=O)c1ccc(CN2C(=O)S/C(=C/c3cc([N+](=O)[O-])ccc3O)C2=O)o1 107768761 CLLYWEVRXXGIPT-VGOFMYFVSA-N 404.356 2.917 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1c(C)cccc1C)S(C)(=O)=O 107938038 VSSRECZCTYFPDW-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB C[C@@H](C(=O)N[C@H](C)c1ccc(F)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220421088 CPXMHIXHFPNSEM-OLZOCXBDSA-N 409.439 2.766 5 40 HFBB O=C(NN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O)c1ccc([N+](=O)[O-])cc1 3015062 LMYNOEFSRUVTFO-UHFFFAOYSA-N 406.310 2.597 5 40 HFBB Cc1cccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)c1 12421631 XUNJDXMAHMHPNL-IAGOWNOFSA-N 403.485 2.680 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)Nc1ccc(F)cc1F)S(C)(=O)=O 220387695 YWXFIHFHIFKZSY-LLVKDONJSA-N 413.402 2.975 5 40 HFBB Cc1ccc(C)c(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 8038725 AFPOUSMVZDDHBM-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=C(C[C@@H](NCc1ccco1)C(=O)O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 65090343 OIWUAYBKSRSULD-CQSZACIVSA-N 416.415 2.883 5 40 HFBB CS(=O)(=O)N(CCCC(=O)NCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 222366881 SVAFGVDHTUODGY-UHFFFAOYSA-N 409.439 2.597 5 40 HFBB CC(C)NC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408588360 FQWAQORWMSWIQD-CYBMUJFWSA-N 407.448 2.688 5 40 HFBB Cc1cc(C)nc(SCC(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])n1 7778192 UJHGQTCDGUSQGV-UHFFFAOYSA-N 410.839 2.929 5 40 HFBB Nc1nc(SCc2cccc([N+](=O)[O-])c2)[nH]c(=O)c1NC(=O)c1ccccc1F 9518101 KIDHYHVVRALSNJ-UHFFFAOYSA-N 415.406 2.944 5 40 HFBB O=C(CCN1CCOCC1)N1N=C(c2ccccc2)C[C@H]1c1ccc([N+](=O)[O-])cc1 20624541 ASEZCMLGCJGZJK-NRFANRHFSA-N 408.458 2.995 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(NC(=O)NCc2ccccc2[N+](=O)[O-])cc1 47699725 UYKSAZDCFJJZAS-UHFFFAOYSA-N 406.464 2.947 5 40 HFBB Cc1ncc(-[n+]2csc(CCO)c2C)c(NSc2ccccc2[N+](=O)[O-])n1 5537717 UFASRCQNTXUZBD-UHFFFAOYSA-N 404.497 2.994 5 40 HFBB COc1ccc(OC)c(/C=C/C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c1 5675558 MYVOBTCPYNPNIS-FPYGCLRLSA-N 404.350 2.946 5 40 HFBB O=C(c1cc(N2CCOCC2)c2nc3ccccc3c(=O)n2c1)c1ccccc1O 6600474 FQONEOFKOJMPKJ-UHFFFAOYSA-N 401.422 2.621 5 40 HFBB O=[N+]([O-])c1ccc([C@@H]2c3c(/C=C/c4ccccc4)nnc(O)c3Nc3nnnn32)cc1 10297877 IMFQSRHGBSRFMP-PMQIGOLDSA-N 414.385 2.942 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC(C(=O)NCc2ccccc2)CC1 12821550 LYKIVYHHYVFRTM-UHFFFAOYSA-N 410.474 2.870 5 40 HFBB CC(=O)c1ccc(N2CCN(Cc3nc(N)c4ccccc4n3)CC2)c([N+](=O)[O-])c1 14322915 NBZCUYGVBIEPDK-UHFFFAOYSA-N 406.446 2.645 5 40 HFBB O=C(O)c1cc(N2C(=O)c3cc([N+](=O)[O-])cc4cc([N+](=O)[O-])cc(c34)C2=O)ccc1O 3146534 PAQACDRRAGKUNN-UHFFFAOYSA-N 423.293 2.861 5 40 HFBB O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 8883791 WONHJMNHXDRKKF-OAHLLOKOSA-N 423.834 2.704 5 40 HFBB CNc1ccc(C(=O)OCc2nc(N)nc(Nc3ccccc3C)n2)cc1[N+](=O)[O-] 9507511 KMJCCNZTKZTQAU-UHFFFAOYSA-N 409.406 2.813 5 40 HFBB COc1cc(NC(=O)CSc2nnc3nc(C)cc(C)n23)c(C)cc1[N+](=O)[O-] 9580556 LNDPPQOJJMALOB-UHFFFAOYSA-N 402.436 2.697 5 40 HFBB COc1ccc(OCCNc2ccc(S(=O)(=O)NC(C)C)cc2[N+](=O)[O-])cc1 12515043 AABOEHJWLRGXQW-UHFFFAOYSA-N 409.464 2.781 5 40 HFBB CN1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H](c2ccccc2)C1 45864738 RTJUMNDMZPJJGH-IBGZPJMESA-N 424.457 2.798 5 40 HFBB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C 408553142 OGLUVHJOJVHCOE-CYBMUJFWSA-N 407.448 2.526 5 40 HFBB O=C(COC(=O)c1cc(Br)ccc1O)Nc1cc([N+](=O)[O-])ccc1F 3274484 UIYGISDPIWWKKX-UHFFFAOYSA-N 413.155 2.998 5 40 HFBB CC[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1=O 5834468 URIWWDFKWVNYDU-HXUWFJFHSA-N 415.377 2.958 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(n2nnc3cc(C)ccc32)CC1 12640600 NCIXYHKLMSKZBR-UHFFFAOYSA-N 424.461 2.932 5 40 HFBB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO 21698801 SOMQVACDTLJEDG-UHFFFAOYSA-N 424.461 2.852 5 40 HFBB O=C(c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(OC[C@H]2CCCO2)CC1 96011254 KXTRNMBVLIEJIE-QGZVFWFLSA-N 400.435 2.785 5 40 HFBB CCCCn1/c(=N\C(=O)CCC)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 103628135 GRPKIMZRGIEBIO-GFMRDNFCSA-N 410.474 2.853 5 40 HFBB Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 7344387 ONDKDTOMUWLRSU-UHFFFAOYSA-N 413.356 2.594 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N1CCN(c2ccccn2)CC1 9468754 PJXOSVITDWBYSV-UHFFFAOYSA-N 416.381 2.610 5 40 HFBB COc1cccc(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 17090584 ITDLDKOAPDXHDB-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB COCCNc1ccc(C(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 24660438 ZECOOXFACQFSPT-OAHLLOKOSA-N 401.419 2.565 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3ccc(F)cc3)CC2=O)cc1[N+](=O)[O-] 8433894 LWQZGVNFZCOZEJ-CYBMUJFWSA-N 415.377 2.577 5 40 HFBB CCc1c(C(=O)Nc2ccc(N3CCOCC3)nc2)cnn1-c1ccc([N+](=O)[O-])cc1 32925430 RCRDSVAZTHPWNN-UHFFFAOYSA-N 422.445 2.827 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1 57851523 XPBXQEWMGBCHCV-AWEZNQCLSA-N 402.426 2.892 5 40 HFBB Cc1ccc(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 408619742 HDTYVYWNSBJJQE-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB O=C1N(c2ccc(Cl)cc2)[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc([N+](=O)[O-])cc1 7718574 WCZLWBMQHGBKHG-HOTGVXAUSA-N 407.835 2.860 5 40 HFBB C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CCC(=O)Nc1cccc([N+](=O)[O-])c1 29782316 SCMFKVOPHAQDGT-OAQYLSRUSA-N 408.414 2.922 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])OCC(=O)N1CCC(Cc2ccccc2)CC1 5061826 FCUMHXMHJYBNBR-UHFFFAOYSA-N 412.442 2.998 5 40 HFBB CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 72289341 BQGTWXFEMJVWKM-COXVUDFISA-N 401.467 2.816 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1cc2c(cc1Br)NC(=O)CO2 79055722 OJTHFOFRSDHIOC-UHFFFAOYSA-N 422.191 2.706 5 40 HFBB Cc1ccc(S(=O)(=O)NCc2ccccc2CN2CCCC2=O)cc1[N+](=O)[O-] 223697470 HHOXVGJAZJJKGD-UHFFFAOYSA-N 403.460 2.504 5 40 HFBB O=C([C@@H]1CCCN1C(=O)c1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 6345638 JZVBWQITBUDBNS-KRWDZBQOSA-N 414.487 2.610 5 40 HFBB C[C@@H](O)C[C@@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1 79104830 IIGVKBXENOVMRY-APWZRJJASA-N 413.474 2.716 5 40 HFBB CC(C)OC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 101176161 AQIDWBRXCNUVNG-DCXXXQMHSA-N 421.446 2.538 5 40 HFBB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])cc(OCC)c2O)C1=O 409014367 PAMQMUOMNRIOSI-MRACZJACSA-N 410.404 2.687 5 40 HFBB CC1=C(C(N)=O)[C@H](c2cccc([N+](=O)[O-])c2)N2NC(c3ccccc3Cl)=NC2=N1 940682 QAKWKRDJZDSCMU-INIZCTEOSA-N 410.821 2.685 5 40 HFBB C[C@H](OC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)Nc1cc(F)ccc1F 7820132 YQCQYDPKSDGAPZ-VIFPVBQESA-N 408.313 2.828 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])NC(=S)Nc1ccc(Cl)cc1C(=O)O 16450526 PKSSKJQMXJKJIQ-UHFFFAOYSA-N 409.807 2.838 5 40 HFBB Cc1nc(CN2CCN(c3ccc(C(=O)NC(C)C)cc3[N+](=O)[O-])CC2)cs1 22102220 XNBQNJKXRPTIPS-UHFFFAOYSA-N 403.508 2.820 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NC[C@@H](C)c3ccccc3)cc2[N+](=O)[O-])CC1 22644847 QAANCNISOCMSAO-MRXNPFEDSA-N 410.474 2.797 5 40 HFBB O=C(Cn1c(=O)oc2cc(Cl)ccc21)N1CCN(c2ccccc2[N+](=O)[O-])CC1 40023463 HYDSAAGLTSHQIY-UHFFFAOYSA-N 416.821 2.505 5 40 HFBB CC(C)CNC(=O)c1cc2c(=O)n3ccccc3nc2n(CCc2ccccc2)c1=N 101148044 OSBMMYFENCVMND-UHFFFAOYSA-N 415.497 2.757 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)NCCCc1ccccc1)S(C)(=O)=O 220393405 PKSNQRGCCDOVBZ-MRXNPFEDSA-N 419.503 2.807 5 40 HFBB COc1cc(OC)cc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 3397720 UZOMGHHEPPHLQO-LLVKDONJSA-N 404.375 2.805 5 40 HFBB O=C(Cn1nnc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(Br)cc1 4973957 LAXRBEQSNBNSPF-UHFFFAOYSA-N 403.196 2.650 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 20451600 OHQJCBXPGFIRPU-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB CC(C)C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 5294199 ZKDDEGCQUZDFBD-OAHLLOKOSA-N 408.455 2.589 5 40 HFBB Cc1csc(Sc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])n1 8883252 FVQIPANGAUINCC-UHFFFAOYSA-N 401.491 2.532 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 8979580 GLILLWYJXXFLPK-KRWDZBQOSA-N 419.459 2.704 5 40 HFBB COc1cccc(CN(C)C(=O)c2ccc(Sc3nnnn3C)c([N+](=O)[O-])c2)c1 9441818 MVCPQQITUSFUSH-UHFFFAOYSA-N 414.447 2.550 5 40 HFBB O=C(Cn1c(=O)c(N2CCCC2)nc2ccc([N+](=O)[O-])cc21)NCC1CCCCC1 12922449 BMFUTEWSWMRFNA-UHFFFAOYSA-N 413.478 2.601 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1nc(-c2cccs2)no1 12929821 TWQCWSWYJWCDQE-UHFFFAOYSA-N 402.388 2.570 5 40 HFBB O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 45317814 AHCKJTGDFMJPLK-JTQLQIEISA-N 403.778 2.969 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1cccc(C(F)(F)F)c1 103622050 GXOVXWRMIRKGNK-ZFWWWQNUSA-N 405.288 2.906 5 40 HFBB CCOc1ccccc1N(CC(=O)OC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225074519 ASVSWNDFEZBKDH-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB C[C@H](C(=O)NC(C)(C)Cc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 225264862 ZUVNSCNGIISKPO-OAHLLOKOSA-N 419.503 2.887 5 40 HFBB COc1ccc([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408565075 HOXYDFPYJNRIGW-SZFLOTBDSA-N 409.442 2.758 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1Oc1ccc2c(c1)CCC2 7652830 JUEQIQIREIOULR-UHFFFAOYSA-N 404.444 2.897 5 40 HFBB O=C(CSc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)Nc1cccc([N+](=O)[O-])c1 10612707 LBGOXCFWWZHPJB-UHFFFAOYSA-N 422.426 2.748 5 40 HFBB COc1ccc([C@@H](C)NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 20035914 NEPWCIGWGVCHGI-CQSZACIVSA-N 421.475 2.555 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(CC(=O)N2C[C@@H](C)C[C@@H](C)C2)CC1 43149610 APAAZJGSFAGIAD-IYBDPMFKSA-N 417.510 2.557 5 40 HFBB CNS(=O)(=O)c1ccc(NC[C@H]2CCCN2CC2CCCCC2)c([N+](=O)[O-])c1 72273519 FPBMTYIIUCTFCY-MRXNPFEDSA-N 410.540 2.960 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H]1C[C@@H]2CC[C@@H]1C2 103005848 FWBOHCNVWBDEKI-ANQUJSFKSA-N 409.508 2.852 5 40 HFBB CCOC(=O)c1nnn2c1sc1c(C(=O)OCC)nnn1c1cc(Cl)ccc12 1404445 MEXHOEXDYJTCBM-UHFFFAOYSA-N 420.838 2.556 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCC3)cc1[N+](=O)[O-] 6846514 KFFGAUUUFYJBGJ-UHFFFAOYSA-N 404.473 2.679 5 40 HFBB O=[N+]([O-])c1cccc([C@@H]2c3c(/C=C/c4ccccc4)nnc(O)c3Nc3nnnn32)c1 10297882 JBUUWACJXLCHMW-QZEKMECESA-N 414.385 2.942 5 40 HFBB CN(C(=O)CN1CCC(C(=O)NCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 24762386 YMHPASDJPXULPO-UHFFFAOYSA-N 410.474 2.586 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 169413835 KCHCKPCXEDFKQB-ZQIUZPCESA-N 409.320 2.699 5 40 HFBB CCOC(=O)NN1C(=O)c2ccccc2N[C@@H]1c1cc(OC)c(OC)cc1[N+](=O)[O-] 1441620 VUOOUFLIWJMSLU-KRWDZBQOSA-N 416.390 2.840 5 40 HFBB O=[N+]([O-])c1ccccc1N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1 6831903 SNDBKXVIKWUCTO-UHFFFAOYSA-N 401.488 2.985 5 40 HFBB Cc1ccccc1N1C(=S)N(c2ccc([N+](=O)[O-])cc2)[C@H]2CS(=O)(=O)C[C@H]21 12421633 KILJAUPCAWJQHD-DLBZAZTESA-N 403.485 2.680 5 40 HFBB CCOC(=O)CN(c1ccccc1OCC)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113887185 WSDJLGKEFGPTJT-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB NC(=O)CSc1nc2ccc(N3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)cc2s1 13388153 JQWFAAHLQZLTKA-UHFFFAOYSA-N 414.424 2.583 5 40 HFBB Cc1cc(-n2c(C)cc(C(=O)CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)c2C)no1 3461091 JDMXBVJVUYEOAY-UHFFFAOYSA-N 408.370 2.778 5 40 HFBB O=C(CN1C(=O)c2ccc(Br)cc2C1=O)Nc1ccc([N+](=O)[O-])cc1 8434676 ZORSOACYAWURBX-UHFFFAOYSA-N 404.176 2.592 5 40 HFBB Cn1c(=O)c2c(nc3n(C4CCCCC4)c(-c4ccc([N+](=O)[O-])cc4)cn23)n(C)c1=O 13776195 BUGNAQBTRJTJDM-UHFFFAOYSA-N 422.445 2.767 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 39986133 YUKDJGSNBUNZBK-UHFFFAOYSA-N 407.448 2.643 5 40 HFBB COc1ccccc1[C@@H]1[C@@H]2SC(N)=NC2=NN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 136774467 QAFRUPKHGMKQQW-CABCVRRESA-N 414.403 2.817 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1N=C(c2ccccc2)C[C@]1(O)C(F)(F)F 408563245 KAAXWUPRRVHVTL-KRWDZBQOSA-N 409.320 2.861 5 40 HFBB O=C(NN1C(=O)S/C(=C\c2ccc([N+](=O)[O-])cc2)C1=O)c1ccc([N+](=O)[O-])cc1 408759942 OPJHQEUPACPSLX-ZROIWOOFSA-N 414.355 2.884 5 40 HFBB CC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 5557523 CFLGCXYDGLMNCD-NSHDSACASA-N 403.888 2.564 5 40 HFBB CN(C)CCN(C(=O)c1ccc([N+](=O)[O-])o1)c1nc2cc3c(cc2s1)OCO3 10065947 SPKPEIPYKYUSGK-UHFFFAOYSA-N 404.404 2.735 5 40 HFBB CC(C)OCCCn1c(=N)c(C(=O)NC2CCCC2)cc2c(=O)n3ccccc3nc21 101045913 PTEHXPIZGISWGE-UHFFFAOYSA-N 423.517 2.616 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1N=C(c2ccccc2)C[C@@]1(O)C(F)(F)F 408563248 KAAXWUPRRVHVTL-QGZVFWFLSA-N 409.320 2.861 5 40 HFBB O=C(NC(=S)Nc1ncccc1O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 408620474 JGQVBHQCHGEYFY-UHFFFAOYSA-N 401.448 2.813 5 40 HFBB COCCNc1cc(C(=O)c2cc(F)ccc2O)cn2c(=O)c3ccccc3nc12 9578692 ADBLXMSIYQJWQE-UHFFFAOYSA-N 407.401 2.982 5 40 HFBB Cc1cccc(C)c1N1C[C@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 138802158 VJCOCSMPSQYWMV-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=C(NCCc1ccccc1)[C@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 199411360 RSHMEGKYBQMPDL-FQEVSTJZSA-N 405.410 2.539 5 40 HFBB COc1ccc(C(=O)[C@@H](C)OC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 408651215 NHTDSPPLKOPFHH-HIFRSBDPSA-N 412.398 2.771 5 40 HFBB COC(=O)c1cc(OC)c(OC)cc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C 9539470 ZVNRRAVLZFKJSN-UHFFFAOYSA-N 410.404 2.508 5 40 HFBB O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3nc4ccccc4s3)CC2)c1 12977273 YYRYUIHHOGQKTA-UHFFFAOYSA-N 418.500 2.711 5 40 HFBB Cn1cnnc1Sc1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 3361057 MHGPEUYFEIJGTN-UHFFFAOYSA-N 413.415 2.898 5 40 HFBB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1cc([N+](=O)[O-])ccc1Cl 10251208 NQPSDKMFKIZJMU-UHFFFAOYSA-N 410.777 2.528 5 40 HFBB Cc1cccc(OCCN(C)C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c1 12762876 ZMEUEHKWFDHGHR-UHFFFAOYSA-N 422.441 2.909 5 40 HFBB O=[N+]([O-])c1ccc(CN2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)cc1 25945759 MPINSDYJJKTXMA-UHFFFAOYSA-N 401.488 2.590 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(C/C=C\c3ccccc3)CC2)cc1[N+](=O)[O-] 33394089 AZKKOEJJIZZRLN-YVMONPNESA-N 401.488 2.923 5 40 HFBB Cc1cccn2c(=O)c3cc(C(=O)NC4CCCC4)c(=N)n(Cc4ccco4)c3nc12 100861108 OTEORCIAYJEPSJ-UHFFFAOYSA-N 417.469 2.751 5 40 HFBB CCCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 408529489 IADASGRTIIPNSS-UHFFFAOYSA-N 421.475 2.999 5 40 HFBB COc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3OC)C2)c(OC)c1 408647814 XNNXLEYRZYJMJF-LBPRGKRZSA-N 415.402 2.612 5 40 HFBB O=C(CCc1c[nH]c2ccccc12)N1C[C@@H]2C[C@H](C1)Cn1c2ccc([N+](=O)[O-])c1=O 1547206015 CAWBSDRNMRHCFA-ZBFHGGJFSA-N 406.442 2.816 5 40 HFBB biogenic Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4ccc(Cl)c([N+](=O)[O-])c4)cnc32)cc1 10251513 AWOYFMSIMDYDKN-UHFFFAOYSA-N 424.804 2.836 5 40 HFBB Cc1cccc(Cn2nccc2NC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c1 30527016 MWZVDZKKPAUCKT-UHFFFAOYSA-N 421.413 2.512 5 40 HFBB CCOC(=O)c1nnn2c1sc1c(C(=O)OCC)nnn1c1cc(C)c(C)cc12 1409630 VWRUUNQNQLXYDD-UHFFFAOYSA-N 414.447 2.519 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1 5885521 JLFGOBDZZKDJGG-QGZVFWFLSA-N 419.459 2.613 5 40 HFBB O=C(N[C@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 2134454 IFJNBTSLUHNFGX-ROUUACIJSA-N 412.402 2.974 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 3191679 SEQWSTMNMXQRCD-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N1CCN(c2ccc(N3CCCCCC3)nn2)CC1 4583309 JZLMFQLRCMSSSB-UHFFFAOYSA-N 410.478 2.728 5 40 HFBB Cc1cccc(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1C 5934770 QUOVNAQIDHBAFT-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CC(C)c1cccc(N2C[C@H](C(=O)NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2=O)c1 23018499 XFANOAGEXOVLJB-YLJYHZDGSA-N 411.458 2.921 5 40 HFBB CC[C@@H](C)n1c(=N)c(C(=O)NCc2ccco2)cc2c(=O)n3cc(C)ccc3nc21 100811496 RRIIJPSQOUXHFG-CQSZACIVSA-N 405.458 2.931 5 40 HFBB Cc1c(C(=O)N2CCC(C(N)=O)CC2)sc2nc(-c3cccc([N+](=O)[O-])c3)cn12 4931132 MWGFDBDTKKDCMC-UHFFFAOYSA-N 413.459 2.617 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)[C@H](C(=O)N1CCCCC1)n1cc(Cl)ccc1=O 12467410 NZHVCMRHUXWWGW-QGZVFWFLSA-N 403.822 2.846 5 40 HFBB Cc1ccc(Cl)cc1NC(=O)[C@H](C)Oc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 24776424 AJRMJJKVVCRLGH-JTQLQIEISA-N 413.839 2.610 5 40 HFBB COCCCNc1c([N+](=O)[O-])cc2c3c(cccc13)C(=O)N(CCCOC)C2=O 95470827 PYBNQJQLNUQWAW-UHFFFAOYSA-N 401.419 2.829 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1=O 408638415 CDLYYXQNQSVOPK-GFCCVEGCSA-N 414.374 2.812 5 40 HFBB CC1=C(C(N)=O)[C@H](c2ccccc2[N+](=O)[O-])N2NC(c3ccccc3Cl)=NC2=N1 940684 DDYOFYWKVCEYKY-INIZCTEOSA-N 410.821 2.685 5 40 HFBB CCc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 4393631 BOQZMORDPYBFTJ-ROUUACIJSA-N 401.444 2.769 5 40 HFBB CC(=O)[C@@H](C(=O)OC(C)C)C(c1cccc([N+](=O)[O-])c1)[C@@H](C(C)=O)C(=O)OC(C)C 5381316 DPHUMJWVOASNEI-QZTJIDSGSA-N 421.446 2.992 5 40 HFBB O=C(CN(C(=O)c1cccc([N+](=O)[O-])c1)N1C(=O)CCCC1=O)c1ccc(F)cc1 8475274 TURJSRRRLWZJHH-UHFFFAOYSA-N 413.361 2.513 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 39986142 GNZXOKWBNQLHGA-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB Cc1nn(Cc2ccc(C(=O)NC3CCC(C(=O)O)CC3)cc2)c(C)c1[N+](=O)[O-] 95970513 GOXCXLGBHSVNMS-UHFFFAOYSA-N 400.435 2.830 5 40 HFBB O=C1[C@@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccc([N+](=O)[O-])cc3)N2C(=O)CN1C1CC1 1896930 BVZBHTXRLVLMED-SIKLNZKXSA-N 416.437 2.923 5 40 HFBB biogenic COC(=O)c1cc(N2CCN(Cc3ccc(OC)c(OC)c3)CC2)ccc1[N+](=O)[O-] 29376454 NOABXCISPPQEBX-UHFFFAOYSA-N 415.446 2.721 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(CC(C)C)/c1=N\C(=O)C(C)(C)C 101176591 FFZOCCQBRQYKPY-PLRJNAJWSA-N 424.501 2.955 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@@H]2[C@@H]2C=Cc3ccccc3N21 104158435 WPYHZQLSBWADGA-OYNPSCLESA-N 417.421 2.882 5 40 HFBB Cc1c(NC(=O)COc2ccc(S(=O)(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] 408552340 MBHDZHUUAOQIJV-UHFFFAOYSA-N 407.448 2.607 5 40 HFBB Cc1nc2c3ccccc3n3c(CCCC(=O)NCCc4ccccc4)nnc3n2n1 4906237 IEZWVVCKIXSUJK-UHFFFAOYSA-N 413.485 2.915 5 40 HFBB Cc1c(NCC(=O)N(c2ccccc2)[C@@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-] 11260133 JWNHJVQFUHLVTA-MRXNPFEDSA-N 403.460 2.535 5 40 HFBB Cc1ccc(S(=O)(=O)N(C)Cc2ccccc2N2CCOCC2)cc1[N+](=O)[O-] 12608590 NOIYTIJZYXROBY-UHFFFAOYSA-N 405.476 2.561 5 40 HFBB CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCc1ccc(C(N)=O)cc1 45745763 JZIPEAMGGJHJQT-UHFFFAOYSA-N 410.386 2.635 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)C(=O)c3cc(Br)ccc32)cc1[N+](=O)[O-] 408582978 QGXIJEMMIRONML-UHFFFAOYSA-N 418.203 2.834 5 40 HFBB Cc1c(NC(=O)CN(Cc2ccc(Cl)cc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 408585425 DJGWFIHCNLBGJN-UHFFFAOYSA-N 411.867 2.957 5 40 HFBB COC(=O)CCSc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1[N+](=O)[O-] 7735037 OEDSSOXGLZCING-UHFFFAOYSA-N 402.494 2.671 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@H](C)c1ccc(F)cc1)S(C)(=O)=O 20492935 QTSQGWVNIJOGSI-CYBMUJFWSA-N 409.439 2.686 5 40 HFBB C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1cccnc1OC1CCCC1 40091108 BOSJWABZCMHTPR-CQSZACIVSA-N 412.446 2.746 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1cccc(Cl)c1)S(C)(=O)=O 409382942 YQFOUOLGMBPXTK-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB COc1cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1OC 48305762 ZVCITLZCHMCHJG-UHFFFAOYSA-N 401.419 2.583 5 40 HFBB O=C(Nc1nnc(-c2cccc([N+](=O)[O-])c2)o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 215867771 IBRPHUUBWMLLLT-UHFFFAOYSA-N 400.263 2.714 5 40 HFBB C[C@@H](C(=O)N[C@H]1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220420219 WKNVPKVTVXLQFL-LIRRHRJNSA-N 417.487 2.943 5 40 HFBB CCOc1ccc(-c2noc(CN(C)S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1 223590770 FKEOXPBFIGLSSC-UHFFFAOYSA-N 418.431 2.864 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCC(=O)Nc2ccc(C)cc2)c1 8413580 SIOCVTGJWGMXEO-UHFFFAOYSA-N 415.402 2.812 5 40 HFBB COc1ccc(NC(=O)c2cc3c(=O)n4cccc(C)c4nc3n2C)cc1[N+](=O)[O-] 2433061 CJEKAKXUYNQODI-UHFFFAOYSA-N 407.386 2.664 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccccc1[N+](=O)[O-])N1C(=O)CCCC1=O 408688072 VQIAOVJPKMTXNU-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB COc1ccc(N(CC(=O)O)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1Cl 224752179 WYMOLHNQLLIGDD-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB O=c1/c(=C/c2cc(Br)c(O)c([N+](=O)[O-])c2)sc2nc3ccccc3n12 832392 FMCSDZQAPJKYQV-QPEQYQDCSA-N 418.228 2.833 5 40 HFBB CC(C)OC(=O)[C@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)OC(C)C)C(=O)C[C@]1(C)O 856667 AQIDWBRXCNUVNG-IIMDRIAPSA-N 421.446 2.538 5 40 HFBB Cc1cc(C(=O)NCC(=O)OCC(=O)N(c2ccccc2)C(C)C)ccc1[N+](=O)[O-] 3286355 PPIJJXSGGRILCG-UHFFFAOYSA-N 413.430 2.618 5 40 HFBB C[C@H]1CN(C(=O)COC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C[C@H](C)O1 5710965 QBKNIJQHWIXGQR-HOTGVXAUSA-N 419.478 2.768 5 40 HFBB Nn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cc(-c2ccccc2)n[nH]1 9488130 GPWMFAJZCJVZIN-UHFFFAOYSA-N 421.442 2.932 5 40 HFBB CC(=O)c1ccccc1OCCOC(=O)[C@@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 12851804 MLEARAOVTGBKQA-CQSZACIVSA-N 421.427 2.582 5 40 HFBB COCCCN1C(=O)[C@@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)n2c1nc1ccccc12 39963980 IAXLZCCSNMLOKG-GOSISDBHSA-N 423.429 2.898 5 40 HFBB O=C(CN1CCC(NC(=O)NC2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] 4908984 MHZOSFGZJHYWQN-UHFFFAOYSA-N 403.483 2.630 5 40 HFBB O=[N+]([O-])c1ccc([C@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)cc1 10232640 NIOFMJCJTRBENZ-INIZCTEOSA-N 406.337 2.578 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1cccc(F)c1)S(C)(=O)=O 220475474 YBOIBLWLLKFFRU-NSHDSACASA-N 411.411 2.536 5 40 HFBB COc1ccc(-c2noc(CN(C)S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 223762986 CKMOOQYVEJFWLH-UHFFFAOYSA-N 418.431 2.783 5 40 HFBB O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cc(Oc2ccc(F)cc2)cc([N+](=O)[O-])c1 4179839 JGORKPUVPZFESI-UHFFFAOYSA-N 402.298 2.665 5 40 HFBB COc1ccc(NC(=O)[C@H](C)N(C)CC(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])c1 8472366 RKUPFGSZTLNDMG-AWEZNQCLSA-N 400.435 2.809 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(CCCn1ccnc1)C2=O 13618471 VFOXPKNYVQFNAY-UHFFFAOYSA-N 404.382 2.709 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@@H](c1ccc(Cl)cc1)N1CCCN21 19169550 PSIPYZBNSNOTQZ-KURKYZTESA-N 412.833 2.784 5 40 HFBB O=C1C[C@H](c2ccccc2)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCN1 47229264 ZKINDVMGQKCJDH-LJQANCHMSA-N 408.458 2.898 5 40 HFBB O=C(COC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccccc1 4500226 VVRZCICLRJZALB-UHFFFAOYSA-N 411.336 2.885 5 40 HFBB CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)c1ccccc1[N+](=O)[O-] 5032329 JEDZOPFZXHKRPA-UHFFFAOYSA-N 405.794 2.502 5 40 HFBB O=C(COCc1cc(-c2ccco2)on1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 20479724 RLBAMFMOAPQKHH-UHFFFAOYSA-N 412.402 2.708 5 40 HFBB CS(=O)(=O)N1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 48367922 CMFJIZRRCVOLDU-AWEZNQCLSA-N 419.459 2.541 5 40 HFBB O=C(O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225010109 HTDYWZVGWNGKMU-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB COCc1cccc(NC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 224820785 YZRBRZVGYUHGJG-UHFFFAOYSA-N 421.475 2.926 5 40 HFBB Cc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1C 4393614 OGZOITFFPLASDZ-ROUUACIJSA-N 401.444 2.824 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1OCc1ccc(Cl)cc1 4579902 DXZNSLGXPKLDEF-UHFFFAOYSA-N 412.851 2.848 5 40 HFBB C[C@@H]1CCCN(S(=O)(=O)c2ccc(-n3nnc4ccccc43)c([N+](=O)[O-])c2)C1 8079469 BAMLOPJCEBPLTR-CYBMUJFWSA-N 401.448 2.749 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3Cl)C2=O)c([N+](=O)[O-])c1 8885270 FUSCLHWOCXOBFS-LJQANCHMSA-N 416.821 2.962 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 10337247 OSSBBBJDAFHVDF-UHFFFAOYSA-N 422.419 2.525 5 40 HFBB C[C@@H](Oc1ccc2c(c1)oc(=O)c1ccccc12)C(=O)NCCCN1CCOCC1 20548031 WBFKBRNMDATHIN-MRXNPFEDSA-N 410.470 2.552 5 40 HFBB COc1ccc(NC(=O)NCc2ccccc2CN2CCOCC2)c([N+](=O)[O-])c1 23394361 WJZJWAXSBMMOJI-UHFFFAOYSA-N 400.435 2.757 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](Cc1ccccc1)C(=O)O 6673285 PZZULHSTTMZVJE-IBGZPJMESA-N 400.434 2.967 5 40 HFBB O=C(CSc1ccc2nnc(-c3ccncc3)n2n1)Nc1cccc([N+](=O)[O-])c1 9599848 BUFYCVPSQAPKLX-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB C[C@H](OC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1 21129561 JUQUKISDDRHJLI-QWHCGFSZSA-N 415.377 2.657 5 40 HFBB CCc1ccccc1NC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 408668822 VQDCDSRPMOXRLV-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 5523454 MXADWNYWEUZBOY-GOSISDBHSA-N 412.402 2.879 5 40 HFBB COc1ccc(NC(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 8245849 FQOPJDUDJULTBI-AWEZNQCLSA-N 401.394 2.772 5 40 HFBB Cc1nc(Nc2ccc(S(N)(=O)=O)cc2)nc(N(C)c2ccccc2)c1[N+](=O)[O-] 16249514 KEPSQHMPUAVBLO-UHFFFAOYSA-N 414.447 2.852 5 40 HFBB COCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H]2CCCN2C[C@H]1C 1519068423 VETNXFHDSYWEPO-QAPCUYQASA-N 400.483 2.563 5 40 HFBB CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccc(OC)cc2)c1=N 100919717 DCBHUZHKELPIMD-UHFFFAOYSA-N 418.453 2.671 5 40 HFBB Cc1noc(C)c1[C@@H](C)C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 95939683 XBYDDEUEFVRDRB-GFCCVEGCSA-N 412.450 2.918 5 40 HFBB O=[N+]([O-])c1ccc(CSC2=NCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 2711551 MNRYFYLYSANFPB-UHFFFAOYSA-N 422.444 2.797 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@@H](c2cccc(F)c2)n2nnnc2N3)c1 10296558 FBOQLLNKHJHYMW-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB CN(Cc1nc2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 12544389 SYWNGJUJFXORPK-UHFFFAOYSA-N 415.475 2.892 5 40 HFBB COc1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)c([N+](=O)[O-])c(OC)c1OC 12998851 BSRDJRBINHFIMD-UHFFFAOYSA-N 415.402 3.000 5 40 HFBB COc1cc(CCNC(=O)c2cnc3nc(C)ccc3c2O)c([N+](=O)[O-])cc1OC 40122823 GZDLOPWURHOXQB-UHFFFAOYSA-N 412.402 2.542 5 40 HFBB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C 408555495 XGLFGJSBKBPABV-CYBMUJFWSA-N 407.448 2.526 5 40 HFBB C[C@H](Oc1ccc2c(c1)oc(=O)c1ccccc12)C(=O)NCCCN1CCOCC1 20548033 WBFKBRNMDATHIN-INIZCTEOSA-N 410.470 2.552 5 40 HFBB COc1ccc(NC(=O)Cn2c(=O)c(N3CCCC3)nc3ccc([N+](=O)[O-])cc32)cc1 32855931 JKQQECZZBYSMJM-UHFFFAOYSA-N 423.429 2.552 5 40 HFBB O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1 89782963 GNLPCGAOVVTCMM-CQSZACIVSA-N 416.327 2.851 5 40 HFBB Nc1c(C(=O)N[C@]2(c3ccccc3)C[C@H](O)C2)cc(Br)cc1[N+](=O)[O-] 1644173465 AHKXWTNEPMIBHD-LAUQKZGBSA-N 406.236 2.720 5 40 HFBB O=C(COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)NC1CCCCCCC1 5659648 WZAPKFDCLOFYIF-UHFFFAOYSA-N 419.478 2.817 5 40 HFBB NC(=O)[C@@H]1CCCN1Cc1ccccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 58343991 RVPGNXPDAMQBRN-SFHVURJKSA-N 407.430 2.778 5 40 HFBB O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN(Cc2cccc(OCc3ccccc3)c2)CC1 1631717215 ZMKVPONHIIHSLH-UHFFFAOYSA-N 421.457 2.855 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccccc1[N+](=O)[O-] 10326043 IYMXCASNMXEDJU-OAHLLOKOSA-N 407.382 2.694 5 40 HFBB CC[C@@H](C(=O)NCc1ccc(F)cc1)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 222542207 ZBQUGDUVIGNBNB-KRWDZBQOSA-N 423.466 2.903 5 40 HFBB COC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(SC)cc1 224989667 ZFHFHAGJDQBCON-UHFFFAOYSA-N 410.473 2.993 5 40 HFBB COc1ccc(C(=S)N2CCOCC2)cc1OC(=O)c1cccc([N+](=O)[O-])c1 866306 GUDNUZPBQABJLL-UHFFFAOYSA-N 402.428 2.830 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1CCCN1[C@H]2C(=O)c1ccccc1 2235998 QWNBLHFUXGLTON-BTHPGYMESA-N 419.437 2.738 5 40 HFBB Cc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 15357142 ICPNSURZCLNRLC-RWSFTLGLSA-N 403.464 2.912 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H]1C[C@@H]2CC[C@@H]1C2 103005846 FWBOHCNVWBDEKI-HWMZRRJGSA-N 409.508 2.852 5 40 HFBB COC(=O)c1ccc(CN2C(=O)S/C(=C/c3cc(O)ccc3[N+](=O)[O-])C2=O)o1 107606820 SXZIWYNSNLWLSW-VGOFMYFVSA-N 404.356 2.917 5 40 HFBB C[C@H]1CN(Cc2csc(NC(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)n2)C[C@@H](C)O1 12565005 JWWPIZJERLHMGC-BETUJISGSA-N 419.507 2.979 5 40 HFBB O=C(Oc1ccccc1C(=S)N1CCOCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 13590267 LBBMDXXYVMWJBD-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB Cc1nc2sc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)c(C)c2c(=O)[nH]1 13148554 XTZPWBIEFSWQDH-UHFFFAOYSA-N 417.399 2.733 5 40 HFBB CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C 16692267 MBAPLLVVZRPLNG-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB CC(C)c1[nH]nc(C(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)c1[N+](=O)[O-] 84622405 KSCDIKTZTLLPSE-OAHLLOKOSA-N 421.885 2.898 5 40 HFBB O=C(O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113885973 BECSGQYDDSHUCV-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)Nc1cccc([N+](=O)[O-])c1 408660973 NWUGJNMKRMYPTD-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB COc1ccc(OC)c([C@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1 12783360 RCSFXYRAJTWYPA-GOSISDBHSA-N 413.430 2.706 5 40 HFBB CCOC(=O)Cc1csc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)n1 21685970 VQAHZIRIMDWFNW-UHFFFAOYSA-N 411.461 2.896 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)NCCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 25124975 GQEMCJWSSUTNTH-UHFFFAOYSA-N 411.867 2.573 5 40 HFBB C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 58171525 CAWVCNZEEVFYNT-XJKSGUPXSA-N 406.483 2.961 5 40 HFBB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-] 9916837 BNYWICMEBOBIKN-UHFFFAOYSA-N 407.430 2.808 5 40 HFBB Cc1nnc2ccc(-c3cccc(NS(=O)(=O)c4ccccc4[N+](=O)[O-])c3)nn12 14057130 HHLQRNDCXBLOHF-UHFFFAOYSA-N 410.415 2.809 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(F)c(F)c1 408681219 QFTYZPSPYWGDNS-UHFFFAOYSA-N 419.793 2.931 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 2134023 BYWNWEWDNSAJFN-UHFFFAOYSA-N 422.419 2.786 5 40 HFBB COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ncn[nH]2)cc1OC 3362481 JENASLMTHWFUQC-UHFFFAOYSA-N 415.431 2.811 5 40 HFBB Cn1c2ccccc2c2nnc(SCC(=O)Nc3ncc([N+](=O)[O-])s3)nc21 8443255 QBGLNCGJXAWAAB-UHFFFAOYSA-N 401.433 2.612 5 40 HFBB CC(=O)Oc1ccc(C(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 409180336 QWJHHODZOMBWKO-UHFFFAOYSA-N 414.370 2.665 5 40 HFBB C[C@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2cccc([N+](=O)[O-])c2)C1=O 3593765 ZJVBTQLTIWYKOP-GOSISDBHSA-N 402.794 2.654 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(Sc2nnc3ccccn23)c([N+](=O)[O-])c1 9641632 PUDCHGGXWKVNMR-UHFFFAOYSA-N 407.477 2.819 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NCc3cccc(Cl)c3)cc2[N+](=O)[O-])CC1 22565950 GRYZNTQRVAJPRO-UHFFFAOYSA-N 416.865 2.847 5 40 HFBB CCn1ccnc1CN1CCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C[C@@H]1C 78806580 ZWBGBTIQRXKMBU-AWEZNQCLSA-N 403.508 2.880 5 40 HFBB CC[N+]1(C[C@H](O)COc2ccc(Br)cc2Br)CCOCC1 3180171 PUORYIGDPXUYRY-ZDUSSCGKSA-N 424.153 2.818 5 40 HFBB Cc1cccc(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1C 5934766 QUOVNAQIDHBAFT-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CN(C)CCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@@H]1c1ccc([N+](=O)[O-])cc1 8374056 YEWBOBUAZANWGS-SFHVURJKSA-N 411.389 2.947 5 40 HFBB Cc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 15357143 ICPNSURZCLNRLC-JRPNMDOOSA-N 403.464 2.912 5 40 HFBB CC1(C)CN(C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 95351030 ZHKMDQZVZPKPEC-UHFFFAOYSA-N 424.501 2.838 5 40 HFBB COC(=O)c1sc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)nc1C 2795354 NPYARNDLVAKUQU-UHFFFAOYSA-N 415.431 2.952 5 40 HFBB CNS(=O)(=O)c1ccc(Nc2cccc(Oc3cnccn3)c2)c([N+](=O)[O-])c1 24657927 JJGSLLYEGABILP-UHFFFAOYSA-N 401.404 2.829 5 40 HFBB COCCn1/c(=N/C(=O)c2ccc([N+](=O)[O-])cc2)sc2cc(NC(C)=O)ccc21 100873053 JLJSMUMUKRBQBK-VZCXRCSSSA-N 414.443 2.957 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2748698 OZQFYXSZJUBMRC-GFULKKFKSA-N 424.413 2.852 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 8902590 QUUFRWWEEDDIAI-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB COc1cccc(C(=O)NC(=S)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 20410926 ANKKBYVTCYWWGU-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB COc1ccc([C@@H](C)NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420366 NJQVCIYQPGDUTE-ZIAGYGMSSA-N 421.475 2.635 5 40 HFBB Cc1cccc(C(=O)Nc2nnc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3)s2)c1 223175176 MWGGJOIMCBZSEH-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB CCOC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225081298 LWQINMWEQWMHGN-UHFFFAOYSA-N 422.459 2.979 5 40 HFBB CC(=O)N1N=C(c2cccc(NS(C)(=O)=O)c2)C[C@H]1c1cccc([N+](=O)[O-])c1 4036111 DBOTWWGDUKBXBS-SFHVURJKSA-N 402.432 2.664 5 40 HFBB CC(=O)c1cccc(NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 10359293 LKWHSDNPPDJZFJ-UHFFFAOYSA-N 405.432 2.511 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCc1ccc(OCCO)cc1 58015290 RHJMIFAOQSLVBP-UHFFFAOYSA-N 420.365 2.872 5 40 HFBB O=C1Nc2ccc([N+](=O)[O-])cc2O[C@@H]1CCN1CCN(c2ccccc2F)CC1 63110730 AGBMABXDVFVTEF-GOSISDBHSA-N 400.410 2.646 5 40 HFBB CN1[C@H]2CC[C@H]1CC(NC(=O)c1ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)cc1)C2 102014976 YPXFTSYWWSEUIR-HOTGVXAUSA-N 403.870 2.848 5 40 HFBB CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 2248101 OPBYAXOIXCSMOC-UHFFFAOYSA-N 417.472 2.555 5 40 HFBB CCc1ccccc1N1C[C@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 5786584 VTMNETPIHYPECV-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB COc1ccc(OC)c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 6552039 URKDPRZBGGDNRX-NSHDSACASA-N 404.375 2.805 5 40 HFBB CCOC(=O)CC[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 95989289 UNYQACRPYSVLMI-MRXNPFEDSA-N 419.478 2.627 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)/c1=N\C(=O)c1ccco1 101176489 JJNKNLVOAKBURU-CLCOLTQESA-N 420.425 2.741 5 40 HFBB CCc1ccc(CN(C(=O)c2ccccc2[N+](=O)[O-])[C@@H]2CCS(=O)(=O)C2)cc1 4318709 CNKUWBKRDHKZDP-QGZVFWFLSA-N 402.472 2.987 5 40 HFBB Cc1ccc(NC(=O)C(=O)NCC2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 9236509 QAEQNZRENFKWAM-UHFFFAOYSA-N 424.457 2.510 5 40 HFBB COc1ccc(NC(=O)N2Cc3c(OC)ccc(OC)c3[C@H](O)C2)c([N+](=O)[O-])c1 23395778 HKJVTKFBYFVQLW-OAHLLOKOSA-N 403.391 2.702 5 40 HFBB COc1ccc(NC(=O)CN2CCC(C(=O)O)(c3ccccc3)CC2)c([N+](=O)[O-])c1 408547832 NOSHHLCKFREKKO-UHFFFAOYSA-N 413.430 2.660 5 40 HFBB CC(C)N(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)c1ccccc1 6533032 XWOKUWAQDOPXHA-UHFFFAOYSA-N 401.419 2.597 5 40 HFBB NC(=O)c1ccc(N2CCN(C(=O)c3cccc4ccccc34)CC2)c([N+](=O)[O-])c1 12528029 CSWVDVSQFPOXHR-UHFFFAOYSA-N 404.426 2.809 5 40 HFBB COc1ccccc1-n1nnnc1SCC(=O)Nc1cc([N+](=O)[O-])ccc1C 13400268 WGZPFBNJWSTRII-UHFFFAOYSA-N 400.420 2.618 5 40 HFBB COc1cc(C=O)cc(Br)c1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16092464 NNAPGKJIZPCZNG-UHFFFAOYSA-N 416.205 2.946 5 40 HFBB COc1ccc(C(=O)N2CCN(c3ccc(C(C)=O)cc3[N+](=O)[O-])CC2)cc1OC 24209415 YAYCPZDXLQKWDW-UHFFFAOYSA-N 413.430 2.777 5 40 HFBB COc1cc(OC)c(OC)cc1/C=C/C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1 7288488 KBWMKJKLMQUGAU-RUDMXATFSA-N 416.386 2.816 5 40 HFBB C[C@H](Sc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc([N+](=O)[O-])c1 24271088 HRMGBMXRBJNGPW-AWEZNQCLSA-N 422.532 2.779 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)c1ccc2c(c1)OCCO2 32740687 VPSMEOYEICHHAZ-CYBMUJFWSA-N 401.419 2.915 5 40 HFBB CCCn1c(=N)c(C(=O)NCc2ccc(F)cc2)cc2c(=O)n3cccc(C)c3nc21 101095609 OENXZTDIBAWCIB-UHFFFAOYSA-N 419.460 2.916 5 40 HFBB O=C(O)[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)cc1 547878604 USXBYGJUVAFPMT-CQSZACIVSA-N 412.851 2.611 5 40 HFBB O=C(Nc1c2c(nn1-c1ccc(F)cc1)C[S@@](=O)C2)c1ccccc1[N+](=O)[O-] 4106092 WWNOFPXJUBCKMA-MUUNZHRXSA-N 400.391 2.934 5 40 HFBB CNc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(NC(C)=O)cc2)cc1[N+](=O)[O-] 4508910 RHUPGJOBACBCRK-LLVKDONJSA-N 400.391 2.779 5 40 HFBB CC(C)CN(CC(C)C)C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 6537517 INULGPILLHFFCL-UHFFFAOYSA-N 421.494 2.729 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@H]2[C@@H]2C=Cc3ccccc3N21 16037556 WPYHZQLSBWADGA-MJUUVYJYSA-N 417.421 2.882 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@H](c1ccc(Cl)cc1)N1CCCN21 19169548 PSIPYZBNSNOTQZ-SQNIBIBYSA-N 412.833 2.784 5 40 HFBB O=C(OCCN1C(=O)c2ccccc2C1=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 24792819 JFEQLWQILVMDJY-UHFFFAOYSA-N 423.425 2.651 5 40 HFBB C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1cccnc1OC1CCCC1 40091107 BOSJWABZCMHTPR-AWEZNQCLSA-N 412.446 2.746 5 40 HFBB COC(=O)c1cc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)oc1C 69377047 YAZPIDARDGUCTI-UHFFFAOYSA-N 423.447 2.679 5 40 HFBB CCOc1ccc(-c2noc(CNS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)n2)cc1 223596502 YMFTXOMSPAGAAR-UHFFFAOYSA-N 418.431 2.830 5 40 HFBB C[C@@H]1CN(C(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 5447143 UAZBWNRZXRLKPE-ZIAGYGMSSA-N 419.459 2.645 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]2[C@@H]2C=Cc3ccccc3N21 248380759 RCHZZIMMUJUXMH-VNTMZGSJSA-N 403.394 2.574 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3cccc(F)c3)CC2)c([N+](=O)[O-])c1 408572527 JGJZSOXOXNCQKO-UHFFFAOYSA-N 401.394 2.873 5 40 HFBB Cc1ccc(Sc2nc([N+](=O)[O-])nn2CCN2C(=O)c3ccccc3C2=O)cc1 2370485 TYKBIOKPPIMWRR-UHFFFAOYSA-N 409.427 2.942 5 40 HFBB C[C@@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3593782 RMENPENOCDSHOW-SFHVURJKSA-N 420.784 2.793 5 40 HFBB CN(C)CCCNc1nc(N)c([N+](=O)[O-])c(N2CCC(Cc3ccccc3)CC2)n1 5488627 IDNOXOQTGGVJPD-UHFFFAOYSA-N 413.526 2.790 5 40 HFBB COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1S(=O)(=O)NC(C)C 8475950 QIILDPZOARNAGL-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB C[C@@H]1CCCN(c2ccc(C(=O)OCn3nnc4ccccc4c3=O)cc2[N+](=O)[O-])C1 8687970 QMASIKXTDLPMTQ-CQSZACIVSA-N 423.429 2.751 5 40 HFBB aggregator CCOc1cccc(NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 13669751 KOJAJWCVXRTHAY-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB COc1ccccc1C(=O)NCc1nnc(SCc2ccc([N+](=O)[O-])cc2)n1C 8389536 VPTKXTAQFLQLJE-UHFFFAOYSA-N 413.459 2.954 5 40 HFBB CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1OC)CC(=O)Nc1c(F)cccc1F 9316293 IYWMHBQRRCRPLQ-UHFFFAOYSA-N 422.388 2.781 5 40 HFBB COc1ccc(NC(=S)NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 17083365 FGHGFZRAFVXVQN-UHFFFAOYSA-N 406.376 2.647 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1c(C)cc(C)cc1C)S(C)(=O)=O 22391090 AMGKETCSEQIRGR-UHFFFAOYSA-N 421.475 2.933 5 40 HFBB COc1ccc([N+](=O)[O-])cc1CN1CCCN(S(=O)(=O)c2ccc(C)cc2)CC1 16427219 IENSTXGVAJSCPC-UHFFFAOYSA-N 419.503 2.808 5 40 HFBB C[C@@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2cccc([N+](=O)[O-])c2)C1=O 3593766 ZJVBTQLTIWYKOP-SFHVURJKSA-N 402.794 2.654 5 40 HFBB O=C(CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1)NCc1ccco1 4714204 MGNKUKDFZNKQQI-UHFFFAOYSA-N 415.427 2.700 5 40 HFBB Cc1nn(CC(=O)N(C)CC(=O)Nc2ccccc2C(F)(F)F)c(C)c1[N+](=O)[O-] 8986431 HGCVSZAYLNUYBW-UHFFFAOYSA-N 413.356 2.524 5 40 HFBB C[C@H](C(=O)N1CCCC1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 58161832 XOXPAACXJCEYJD-CYBMUJFWSA-N 400.401 2.747 5 40 HFBB CC(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc(-c2nc[nH]n2)no1 89821070 PBQSEJGAKCUOKW-LBPRGKRZSA-N 405.802 2.934 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(N(C)S(C)(=O)=O)ccc1Cl 222496034 SBAFOQMIHADFCK-UHFFFAOYSA-N 413.839 2.905 5 40 HFBB O=[N+]([O-])c1cccc(CS(=O)(=O)N2CCN(C/C=C/c3ccccc3)CC2)c1 38772404 FEVDTONNDHNWCT-WEVVVXLNSA-N 401.488 2.756 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)NCCSC(C)(C)C)S(C)(=O)=O 220386875 CKQIKTCVDNAXBY-CYBMUJFWSA-N 417.553 2.706 5 40 HFBB C[C@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc2c(c1)CCC2 223174480 NFRVYYJKQCGRRQ-AWEZNQCLSA-N 417.487 2.727 5 40 HFBB CCOc1cc(/C=C/c2onc(C)c2[N+](=O)[O-])ccc1OCC(=O)N1CCOCC1 408543269 OPUUNTUGUJBJIB-FNORWQNLSA-N 417.418 2.698 5 40 HFBB CC(C)N1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@@H]2c2ccccc2)C1=O 9009600 MZVZMHPMTUOEQK-XMSQKQJNSA-N 422.441 2.802 5 40 HFBB O=C1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)NC(Nc2cccc(C(F)(F)F)c2)=N1 9192457 MOHNBKOOYBJASI-CQSZACIVSA-N 421.335 2.909 5 40 HFBB biogenic O=C(Nc1ccccc1[N+](=O)[O-])C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 19159310 LKDJWOSFQKUXMA-UHFFFAOYSA-N 407.423 2.773 5 40 HFBB COC(=O)CN1C(=O)S/C(=C\c2ccc(Br)c([N+](=O)[O-])c2)C1=O 106751005 ZPTJVSZZRJYUEJ-YHYXMXQVSA-N 401.194 2.567 5 40 HFBB O=C(Cn1c(=O)cnc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Br 7718654 YBFYRNAJXZSGIB-UHFFFAOYSA-N 403.192 2.706 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@@H]([C@H]4C(c5cccc([N+](=O)[O-])c5)=NO[C@@H]34)[C@H]2C(=O)N1c1ccccc1 13693317 NZMQAHHANQBGMI-GZKCFLEVSA-N 403.394 2.769 5 40 HFBB O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@@H]2C(=O)N1c1cccc(Br)c1 101104251 FIEBQJVMPZGUTK-ZFWWWQNUSA-N 416.187 2.650 5 40 HFBB CNc1ccc(/C=c2/s/c(=C\C(=O)c3ccc(Cl)cc3)[nH]c2=O)cc1[N+](=O)[O-] 105631949 XSAJHYSZLHIERB-XXGRXQMWSA-N 415.858 2.532 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(NCc3ccccc3)nn2)CC1 4583169 IJBLWLPVIKEQJJ-UHFFFAOYSA-N 418.457 2.959 5 40 HFBB CC[C@H](C)N1C(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@@H]32)C(=O)NC1=S 8742858 LKTGDKWMAZNANQ-BXJCWQANSA-N 416.503 2.538 5 40 HFBB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1ccc(Cl)c([N+](=O)[O-])c1 10251210 PZBVQJLQMNRBLY-UHFFFAOYSA-N 410.777 2.528 5 40 HFBB Cc1ccc(S(=O)(=O)Oc2ccc(/C=C3/SC(=N)NC3=O)cc2)cc1[N+](=O)[O-] 33385704 XSWDWDLPTSDSBC-OVCLIPMQSA-N 419.440 2.810 5 40 HFBB CN1C(=O)S/C(=C\c2cc(I)c(O)c([N+](=O)[O-])c2)C1=O 408818081 OWRJJZQMFWKXRL-YWEYNIOJSA-N 406.157 2.571 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H](NC(=O)c2ccccc2)C(C)C)cc1[N+](=O)[O-] 3331710 OLSISUUHZSXRNZ-IBGZPJMESA-N 413.430 2.840 5 40 HFBB Cc1cc(Br)ccc1NC(=O)CNC(=O)CNc1cccc([N+](=O)[O-])c1 9465469 KMZNXEUMPHOCND-UHFFFAOYSA-N 421.251 2.833 5 40 HFBB Cc1c(NC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cccc1[N+](=O)[O-] 13955111 RMNAWKBHSPOVHJ-CQSZACIVSA-N 409.398 2.931 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 15271307 WLXKOQIMVHLSPQ-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)[C@@H]1CCCN(c2ccc(-n3cccn3)nn2)C1 62022798 CAYKVXJODAALCI-OAHLLOKOSA-N 407.434 2.734 5 40 HFBB C[C@@H](OC(=O)C[C@@H]1Sc2ccccc2NC1=O)C(=O)Nc1cccc([N+](=O)[O-])c1 3504544 XGUVKDOYLCKIAK-BZNIZROVSA-N 415.427 2.968 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc(=O)n(Cc2cccc([N+](=O)[O-])c2)c1 10187970 DKNVLRZYPHKGCG-UHFFFAOYSA-N 424.369 2.974 5 40 HFBB O=C(NC(=S)Nc1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17082830 XJTNQAINGZGQBD-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCCN1[C@@H]2c1ccccc1 19169671 VSDIHQASPCYNQC-KSZLIROESA-N 412.833 2.784 5 40 HFBB Cc1ccccc1CNC(=O)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 57516843 VQJATDSIAONFDX-UHFFFAOYSA-N 419.485 2.890 5 40 HFBB COc1ccc(NC(=O)CN2CCC(NC(=O)C3CCCCC3)CC2)c([N+](=O)[O-])c1 4909019 LQNUMPBEJMBQBC-UHFFFAOYSA-N 418.494 2.703 5 40 HFBB CCc1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCS(=O)(=O)C2)cc1 5046865 HDQUDSRSIYLPSC-LJQANCHMSA-N 402.472 2.987 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 6620095 ZUQBUIUTNNZWAX-UHFFFAOYSA-N 413.839 2.759 5 40 HFBB Cc1ccc(C(=O)[C@@H](C)OC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C 7000087 UTPHGZAYGATNIL-CYBMUJFWSA-N 410.382 2.622 5 40 HFBB Cc1ccc(C)c(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 8038734 AFPOUSMVZDDHBM-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1ccc(-c2cc(NC(=O)CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)on2)cc1 12979898 PZRMAUXCBHABMR-UHFFFAOYSA-N 406.354 2.793 5 40 HFBB COc1ccc(OCCN2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)cc1 40105749 QXXCYSPVTMAFKR-UHFFFAOYSA-N 401.463 2.679 5 40 HFBB Cc1ccc(CCCNC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220033768 NGRPGANTSGGMLV-UHFFFAOYSA-N 419.503 2.727 5 40 HFBB COC(=O)c1sc(NC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2)c(C(=O)OC)c1C 2763176 KJAYLIUYQQWTFM-JTQLQIEISA-N 422.415 2.944 5 40 HFBB CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc2c(c1=O)S[C@H](C)C2 4107914 AJBRTLYATZNCJM-SNVBAGLBSA-N 406.489 2.939 5 40 HFBB O=[N+]([O-])c1ccc(N2C(=S)N(c3ccc(F)cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 12421625 YHAQKJMTFXCZJQ-CVEARBPZSA-N 407.448 2.511 5 40 HFBB COC(=O)c1cc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc([N+](=O)[O-])c1 12872262 IPXKKUGKIPROPQ-GFCCVEGCSA-N 420.443 2.618 5 40 HFBB COc1ccc(S(=O)(=O)N(CCN2CCCC2)Cc2ccccc2)c([N+](=O)[O-])c1 83937251 CGYMODUMBAEFMO-UHFFFAOYSA-N 419.503 2.890 5 40 HFBB COc1ccc(/C=C2/SC(=O)N(CCNC(=O)c3ccc([N+](=O)[O-])o3)C2=O)cc1 96551207 SRTJQYPTAUIUGV-GXDHUFHOSA-N 417.399 2.663 5 40 HFBB Cc1cc(C(=O)N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-] 3557362 QJHQKLIGIZYADS-NTEUORMPSA-N 415.471 2.662 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@@H](c2ccccc2[N+](=O)[O-])n2nnnc2N3)cc1 10232587 BBRQUXOEQPSWKY-QGZVFWFLSA-N 402.374 2.747 5 40 HFBB CCOC(=O)CN1C(=O)S/C(=C/c2cccn2-c2ccc([N+](=O)[O-])cc2)C1=O 5610045 OXBQIVQAGZGXAD-XNTDXEJSSA-N 401.400 2.985 5 40 HFBB COc1ccc(N2C[C@H](C(=O)N(C)Cc3cccc([N+](=O)[O-])c3)CC2=O)cc1OC 40082713 OHDSQXKTQFHQOF-OAHLLOKOSA-N 413.430 2.624 5 40 HFBB CO[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1 96006530 QKVACYBTSDMMGR-LSDHHAIUSA-N 422.482 2.537 5 40 HFBB O=C(O)c1cccc(-c2c([N+](=O)[O-])cc3c4c(cccc24)C(=O)N(CCO)C3=O)c1 408991984 PNHBFVHIZKDLMP-UHFFFAOYSA-N 406.350 2.702 5 40 HFBB O=C(CSc1nnc2ccc(-c3cccc([N+](=O)[O-])c3)nn12)Nc1nccs1 9240869 OOWBICMBABJMFT-UHFFFAOYSA-N 413.444 2.887 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NCC(=O)N(c1ccccc1)[C@H]1CCS(=O)(=O)C1 11117794 JJMRCPXRMWGWED-KRWDZBQOSA-N 403.460 2.535 5 40 HFBB O=C(O)CN(c1ccc(Br)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225020914 UTABEHBRYMWHPK-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB CCOC(=O)c1cc(NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])n[nH]1 583119861 AVYOJUGOMJTLOM-UHFFFAOYSA-N 410.386 3.326 5 40 HFBB Cc1ccc(N2C[C@@H](NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1 4272595 OSSZYIIOUDINAJ-KRWDZBQOSA-N 423.473 2.540 5 40 HFBB COc1cccc(CNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 4893029 QZMNBRJBYYTPKP-UHFFFAOYSA-N 413.430 2.677 5 40 HFBB COc1ccccc1[C@H]1[C@@H]2SC(N)=NC2=NN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 136774518 QAFRUPKHGMKQQW-GJZGRUSLSA-N 414.403 2.817 5 40 HFBB CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)[nH]1 7420585 YLEKOZBPHYSEDY-JXMROGBWSA-N 408.418 2.777 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)c3ccc(F)cc3)CC2=O)cc1[N+](=O)[O-] 7881671 YYBULHNYLIQOAN-CQSZACIVSA-N 400.362 2.821 5 40 HFBB COc1ccc(N2C[C@@H](C(=O)N(C)Cc3cccc([N+](=O)[O-])c3)CC2=O)cc1OC 40082715 OHDSQXKTQFHQOF-HNNXBMFYSA-N 413.430 2.624 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 220452591 XWMGYSITYNZLFO-LLVKDONJSA-N 413.402 2.975 5 40 HFBB CC1CCN(c2ccc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc2[N+](=O)[O-])CC1 5659035 CZFOLPHXYRRWSA-UHFFFAOYSA-N 420.466 2.612 5 40 HFBB Cc1ccc(S(C)(=O)=O)cc1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 6003543 JEOIWGDHWLTIOM-UHFFFAOYSA-N 407.400 2.530 5 40 HFBB Cc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1C 8843969 TUSCQTTUPRKLSL-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB O=C(OCc1nnc(-c2ccccc2)o1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4839227 JCILRLGHVVPXIV-UHFFFAOYSA-N 410.386 2.838 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 9668681 XDONLHLXBGJBRJ-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB CCc1n[nH]c(-n2ccc3nc4ccn(-c5cc(C)ccc5C)c(=O)c4cc3c2=O)n1 40399140 ULDUMJHFPNOOGE-UHFFFAOYSA-N 412.453 2.987 5 40 HFBB O=C(O)CN(c1ccccc1Br)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113875857 BSLDKKXLXCGNCN-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB O=[N+]([O-])c1ccc2c(c1)OCCOCCOc1ccccc1OCCOCCO2 4069974 ILLUPZYAROEJNS-UHFFFAOYSA-N 405.403 2.857 5 40 HFBB COc1cc([C@H]2N[C@H](C(=O)O)CS2)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 4554632 OSIXKNMNHWPRQP-BBRMVZONSA-N 404.400 2.611 5 40 HFBB Cc1cccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 12421632 XUNJDXMAHMHPNL-SJORKVTESA-N 403.485 2.680 5 40 HFBB COc1ccc(Cn2ccc3nc4ccn(CCCN(C)C)c(=O)c4cc3c2=O)cc1 40398794 XPRWTSPIIUSZNA-UHFFFAOYSA-N 418.497 2.720 5 40 HFBB Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ncccc1[C@H]1CCCN1C 1102692 GYSBPRNPMCEKJM-GFCCVEGCSA-N 423.271 2.663 5 40 HFBB CN(C[C@@H]1CCCO1)S(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4348136 DQWZSBYKEBKQSK-KRWDZBQOSA-N 419.459 2.647 5 40 HFBB CC(C)C(=O)NC(=S)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 17082823 UFCAJLIDCYOWAK-UHFFFAOYSA-N 404.414 2.793 5 40 HFBB O=C1[C@H]2[C@H]3C[C@@H]([C@@H]2C(=O)N1c1ccccc1)[C@H]1ON=C(c2cccc([N+](=O)[O-])c2)[C@H]31 4744610 NZMQAHHANQBGMI-ARHBBURHSA-N 403.394 2.769 5 40 HFBB CN(C)[C@H](CNc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccco1 5688280 HJMDSBDAQOLIDB-QGZVFWFLSA-N 408.480 2.687 5 40 HFBB O=[N+]([O-])c1ccc(NC[C@H]2COc3ccccc3O2)c(S(=O)(=O)N2CCCC2)c1 5693669 QHFCNWBGMNBOQX-HNNXBMFYSA-N 419.459 2.631 5 40 HFBB C[C@@H](O)C[C@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1 79104842 IIGVKBXENOVMRY-VQIMIIECSA-N 413.474 2.716 5 40 HFBB CCOc1cc([N+](=O)[O-])c([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)cc1OC 96193434 LYUFVOIGDPLOKX-UHFFFAOYSA-N 403.395 2.657 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)N[C@@H](C)c1ccccc1)S(C)(=O)=O 220377835 KYRQYBQWYLORNL-GJZGRUSLSA-N 405.476 2.935 5 40 HFBB COC(=O)CN(c1ccc(OC)c(Cl)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225005845 MHQRJRSOTJMVFN-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB O=C(CN1C(=O)N/C(=C/C=C/c2ccccc2[N+](=O)[O-])C1=O)Nc1ccccc1F 409199753 DNSQLAVTUSUBQE-AAELAGCISA-N 410.361 2.822 5 40 HFBB CN1[C@H]2CC[C@@H]1CC(NC(=O)c1ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)cc1)C2 2809555 YPXFTSYWWSEUIR-MQVJKMGUSA-N 403.870 2.848 5 40 HFBB C[C@H](OC(=O)CNC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5781282 IOCDAHJXKKGJBH-NSHDSACASA-N 405.794 2.548 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@@H](c2cccc([N+](=O)[O-])c2)n2nnnc2N3)cc1 10232585 ABINQGZHFWNACF-QGZVFWFLSA-N 402.374 2.747 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NCc3ccccc3Cl)cc2[N+](=O)[O-])CC1 12555252 VJOZVSVPBODDNP-UHFFFAOYSA-N 416.865 2.847 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OCCSC)[C@@H]1c1cccc([N+](=O)[O-])c1 19923898 XDKYGHYOBFIPIG-QGZVFWFLSA-N 406.460 2.909 5 40 HFBB COc1cccc(N(CCCC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 222591280 VJSUZDQUCSOHSF-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1 408616936 BQQARANSAXNGGV-UHFFFAOYSA-N 407.448 2.609 5 40 HFBB C[C@H](C(=O)c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O 408658570 VBSIBGJTJKCSOT-CQSZACIVSA-N 409.398 2.763 5 40 HFBB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 6880444 JVXXPMDODZEAND-UHFFFAOYSA-N 407.448 2.609 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 8979578 GLILLWYJXXFLPK-QGZVFWFLSA-N 419.459 2.704 5 40 HFBB CS(=O)(=O)N(CC(=O)N[C@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 22348276 XZJCGYIVNIPIPL-SFHVURJKSA-N 403.460 2.555 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CCOC[C@H]1C1CC1 95446187 VWIUDEBBCOHTTG-IBGZPJMESA-N 409.508 2.775 5 40 HFBB Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 4507731 NVUSYENKFJUKEF-OAHLLOKOSA-N 413.430 2.924 5 40 HFBB COc1ccccc1NC(=O)COC(=O)CCC(=O)Nc1cccc([N+](=O)[O-])c1 8416550 LXGRYYBUJQRNMW-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB COc1ccc2c(=O)c3c(oc2c1)C(=O)N(CCN(C)C)[C@@H]3c1ccc([N+](=O)[O-])cc1 9041748 ZNWXXNPNQIJFOQ-LJQANCHMSA-N 423.425 2.817 5 40 HFBB Cc1ccc(C(=O)Nc2c3c(nn2-c2ccc([N+](=O)[O-])cc2)CS(=O)(=O)C3)cc1 3009110 OPGPSASZYLCXMK-UHFFFAOYSA-N 412.427 2.770 5 40 HFBB CCOC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=S)N[C@H]1c1cccc([N+](=O)[O-])c1 7061891 WCVPDZNCPUDXIK-WBVHZDCISA-N 405.476 2.842 5 40 HFBB C[C@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10415428 ZWAXXKSIAGVNNU-QFYYESIMSA-N 418.789 2.900 5 40 HFBB O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 89807682 ZFTQGGKLXSMWAI-UHFFFAOYSA-N 418.295 2.718 5 40 HFBB C[C@H]1CN(C(=O)COc2c([N+](=O)[O-])cnc3ccc(Br)cc23)C[C@H](C)O1 96003403 YXZZTKVIISIDSB-QWRGUYRKSA-N 424.251 2.920 5 40 HFBB Cn1c(Cn2cnc3ccccc32)nnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1 6444347 XWBOLKQSIWHVDU-UHFFFAOYSA-N 423.458 2.852 5 40 HFBB CCOc1ccccc1N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 7066125 RMXVMOAMYDEYIK-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB Cc1nc(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)sc1C 28425472 NPWGLMPYFUQHDT-HNNXBMFYSA-N 424.504 2.850 5 40 HFBB CCc1ccc(N([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)S(C)(=O)=O)cc1 220275138 VLBSECKWTDNCET-ZDUSSCGKSA-N 421.475 2.959 5 40 HFBB COC(=O)c1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1Cl 223829829 VJDFGCAESVFGDD-UHFFFAOYSA-N 400.796 2.844 5 40 HFBB C[C@H](NC(=O)c1ccccc1)C(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 71186327 OBAXJFMTIZOHCF-HNNXBMFYSA-N 412.446 2.568 5 40 HFBB COc1c2c(cc3c1[C@H](C[C@H](O)c1ccc4c(c1)OCO4)[N+](C)(C)CC3)OCO2 1824625 JDIXVBCUSZMZDF-HOTGVXAUSA-N 400.451 2.950 5 40 HFBB biogenic CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c1C 3447913 UAQKOAHQYDUSFL-UHFFFAOYSA-N 407.354 2.651 5 40 HFBB COc1ccc(S(=O)(=O)CCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 10218755 FZQYMOBHGVKQGN-UHFFFAOYSA-N 408.432 2.805 5 40 HFBB CCN(c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1)S(C)(=O)=O 19937800 JGDPPGHZKAEHRW-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB O=C1[C@H]2C(c3ccc([N+](=O)[O-])cc3)=NO[C@H]2C(=O)N1c1ccc(Br)cc1 101076358 XLSYZQQQEVRNQE-DZGCQCFKSA-N 416.187 2.650 5 40 HFBB COc1ccc(CNC(=O)COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 3504892 GZGOYWJFTMBOLD-UHFFFAOYSA-N 408.794 2.739 5 40 HFBB CCOc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c([N+](=O)[O-])c1 6517923 XGZNWODIHIJQGO-KGLIPLIRSA-N 414.487 2.971 5 40 HFBB biogenic O=C(CN1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21)Nc1cccc([N+](=O)[O-])c1 12554371 PBLWKMGQSFQGOT-FQEVSTJZSA-N 424.457 2.813 5 40 HFBB COc1ccc(NC(=O)CSc2nnc(-c3ccc(C)cc3)n2N)c([N+](=O)[O-])c1 12647828 BYWPZWAABKUFNO-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB Cn1cnnc1Sc1ccc(C(=O)Oc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 13135220 HWOOCBHVCVVRSS-UHFFFAOYSA-N 400.372 2.822 5 40 HFBB O=C(NC(=S)Nc1ccc(CN2CCOCC2)cc1)c1ccccc1[N+](=O)[O-] 19929084 WJYQVIVTYMSOHF-UHFFFAOYSA-N 400.460 2.554 5 40 HFBB COC(=O)c1cccc(COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 5708804 CNBVMPODENEISB-UHFFFAOYSA-N 400.387 2.575 5 40 HFBB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1ccccn1 33630739 ISXZDQWDPHCZCK-UHFFFAOYSA-N 412.427 2.824 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N[C@H](c1nccs1)C1CC1 78903352 ZTYCMDOKNBJLLA-INIZCTEOSA-N 424.504 2.635 5 40 HFBB CC(C)n1c(=N)c(C(=O)NCc2ccc(F)cc2)cc2c(=O)n3ccccc3nc21 101136691 FONHCTJAFYGPRD-UHFFFAOYSA-N 405.433 2.779 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccccc1[N+](=O)[O-] 940586 YTGLOHJLDZFSHN-KRWDZBQOSA-N 407.390 2.518 5 40 HFBB CNS(=O)(=O)c1ccc2nc(NC(=O)c3cccc([N+](=O)[O-])c3C)sc2c1 2694816 BYEVQSDKCLLCSC-UHFFFAOYSA-N 406.445 2.673 5 40 HFBB O=C(C1=NO[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12)c1cccc2ccccc12 3848896 PRJIOQNROJDCJD-FXAWDEMLSA-N 415.361 2.875 5 40 HFBB biogenic O=C(CN(C(=O)c1ccccc1[N+](=O)[O-])N1C(=O)CCCC1=O)c1ccc(F)cc1 8475277 GDSARLLMOPDILJ-UHFFFAOYSA-N 413.361 2.513 5 40 HFBB C[C@H](OC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)C(=O)c1ccc(Cl)cc1 21987332 BZYPSYNHJFJBIW-JTQLQIEISA-N 416.773 2.659 5 40 HFBB CS(=O)(=O)N(CCCC(=O)NCCCc1ccccc1)c1cccc([N+](=O)[O-])c1 222365985 JUABQWSSPDYPMF-UHFFFAOYSA-N 419.503 2.890 5 40 HFBB CCOc1cccc(N(CC(=O)OC)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 224788033 PYDQDMCJGKFEOX-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1ccc(Cl)cc1)S(C)(=O)=O 409382879 WXXIJXNUUXQEQS-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB CC[C@@H](c1nc2c3cnn(-c4ccccc4)c3ncn2n1)n1nc([N+](=O)[O-])cc1C 2809461 AANXOPFDKMDGRP-HNNXBMFYSA-N 403.406 2.876 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCC[C@@H](C)[C@H]2C)cc([N+](=O)[O-])c1 6642096 JXMNEBWNEWMBLJ-ZFRZLUBXSA-N 406.435 2.868 5 40 HFBB Cc1cc(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCC3)ccc1[N+](=O)[O-] 6826112 PZZIHESNGXBJPS-UHFFFAOYSA-N 404.473 2.679 5 40 HFBB O=[N+]([O-])c1cccc(-n2cccc2[C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1 223589104 QCYSYABARBKDJB-RTBURBONSA-N 409.471 2.745 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccccc1CN1CCCC1=O 223701844 NRZOWXHLZBYPNS-UHFFFAOYSA-N 403.460 2.504 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)Nc1cccc2ccccc12 5858926 OGWJOKHIRGFQKL-UHFFFAOYSA-N 409.398 2.948 5 40 HFBB CCCCn1c(N)c(N(CCC(C)C)C(=O)c2ccc([N+](=O)[O-])s2)c(=O)[nH]c1=O 14623672 GGHCXFGELRYYRK-UHFFFAOYSA-N 423.495 2.582 5 40 HFBB O=C(c1ccc([N+](=O)[O-])o1)N(CCN1CCOCC1)c1nc2c(F)cccc2s1 22998293 HDPXTNRBSHYZDS-UHFFFAOYSA-N 420.422 2.916 5 40 HFBB CCn1c(SCCOc2cccc([N+](=O)[O-])c2)nc2cc(S(N)(=O)=O)ccc21 40127532 WFYRJGKWGGADON-UHFFFAOYSA-N 422.488 2.783 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225342408 NOBCILUTPORZFG-UHFFFAOYSA-N 411.867 2.957 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)N(CCc1ccccc1)[C@@H]1CCS(=O)(=O)C1 2887106 YMBMSFFFHOUING-SQUSKLHYSA-N 414.483 2.866 5 40 HFBB CCOc1ccc(OCC)c(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 11437516 JMFVWIRJGZSCHM-UHFFFAOYSA-N 413.386 2.627 5 40 HFBB CC(C)N(Cc1ccccc1)C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1NCCO 20890011 ROKJTAYGXAGGGX-UHFFFAOYSA-N 415.446 2.593 5 40 HFBB COc1ccc(CNC(=O)c2cc3c(=O)n4ccccc4nc3n(C(C)C)c2=N)cc1 100756508 GIYOUEWDWQKDGC-UHFFFAOYSA-N 417.469 2.648 5 40 HFBB biogenic Cc1c(NC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C 199419228 PCZJDGYCXGICMX-UHFFFAOYSA-N 423.429 2.750 5 40 HFBB COc1cccc(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)c1 218253884 APUIVOBSPJHGQZ-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB CCOc1cccc(NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220417634 IFYYWRFUSYQLFN-ZDUSSCGKSA-N 407.448 2.787 5 40 HFBB COc1cccc(C(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 408642221 DSWBYRFLKMJYRK-OAHLLOKOSA-N 412.398 2.691 5 40 HFBB CC[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1=O 5834457 URIWWDFKWVNYDU-FQEVSTJZSA-N 415.377 2.958 5 40 HFBB CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 6120354 LBELCCWPAZIFLK-OAHLLOKOSA-N 414.462 2.639 5 40 HFBB COc1cc(-c2nnc(NC(=O)c3cccc([N+](=O)[O-])c3)o2)cc(OC)c1OC 15391370 MJTUAKALBFRDIA-UHFFFAOYSA-N 400.347 2.923 5 40 HFBB O=C1[C@H]2N=NN(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccc(Br)cc1 16428046 WJSXHOGEHAKEBW-UONOGXRCSA-N 416.191 2.855 5 40 HFBB CC(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc(-c2nc[nH]n2)no1 89821071 PBQSEJGAKCUOKW-GFCCVEGCSA-N 405.802 2.934 5 40 HFBB O=C1[C@H]2N=NN(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccc(Br)cc1 100928890 WJSXHOGEHAKEBW-KBPBESRZSA-N 416.191 2.855 5 40 HFBB COC(=O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225035286 IRFGERQSGZYHSH-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc(I)cc1 3227917 AQKOFQGAAMNHML-UHFFFAOYSA-N 416.127 2.588 5 40 HFBB CC[C@H](C)N1C(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@@H]32)C(=O)NC1=S 8742860 LKTGDKWMAZNANQ-KRYHZZBUSA-N 416.503 2.538 5 40 HFBB C[C@@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 9662545 RXHVZTPGLFWUHB-SFHVURJKSA-N 420.784 2.793 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)Nc1cc(F)ccc1F 12527164 YIKSNTHQCAVBBV-UHFFFAOYSA-N 421.356 2.505 5 40 HFBB COc1coc(CN2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1=O 79065567 NDBXJRGZIVSQHH-UHFFFAOYSA-N 413.352 2.898 5 40 HFBB CCn1/c(=N/C(=O)c2ccc(S(C)(=O)=O)cc2)sc2cc([N+](=O)[O-])ccc21 101042100 BXJYUZDBNJPZPJ-ZCXUNETKSA-N 405.457 2.776 5 40 HFBB Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)NCc1nc2ccccc2[nH]1 4625269 GFRZFWBAGDRZQN-SECBINFHSA-N 407.228 2.616 5 40 HFBB O=C(CNc1cc([N+](=O)[O-])ccc1NCCO)Nc1ccc(Br)cc1 7976874 RWLXRFMDRFDRDS-UHFFFAOYSA-N 409.240 2.812 5 40 HFBB CCn1c(COc2cc(F)ccc2[N+](=O)[O-])nc2cc(S(=O)(=O)N(C)C)ccc21 9468491 QDQDEVFQLZHQEM-UHFFFAOYSA-N 422.438 2.933 5 40 HFBB Cc1cc(NC(=O)COC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)on1 11410317 RQHKEBWJRPCHIC-UHFFFAOYSA-N 402.407 2.923 5 40 HFBB O=C(NCc1cccnc1)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 30655228 BVIKRSALUORAOX-UHFFFAOYSA-N 402.838 2.812 5 40 HFBB CSc1n[nH]c(-n2ccc3nc4ccn(-c5ccccc5C)c(=O)c4cc3c2=O)n1 40398890 FOCRQENCDVEJCV-UHFFFAOYSA-N 416.466 2.838 5 40 HFBB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 44899934 LKARRTARFQHWDS-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB CCCn1/c(=N\C(=O)C(C)(C)C)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 101176320 KNTCDUVWDBPFRH-MOHJPFBDSA-N 410.474 2.709 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NC[C@H](C)c1ccccc1)S(C)(=O)=O 260850865 SGVIPANZTBVEMN-HNNXBMFYSA-N 405.476 2.589 5 40 HFBB O=C(CSc1nnc(Cn2nnc3ccccc32)o1)Nc1ccc([N+](=O)[O-])cc1 8435623 GZUPJQXATUWFPO-UHFFFAOYSA-N 411.403 2.502 5 40 HFBB Cc1cc(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])ccc1F 12562391 GFKUQBMSPUKENV-UHFFFAOYSA-N 422.482 2.591 5 40 HFBB CCOC(=O)c1ccc(N2N=C(N)[C@@H](Sc3ccc([N+](=O)[O-])cc3)C2=O)cc1 16687850 HEHABBDFCRJDDA-OAHLLOKOSA-N 400.416 2.551 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1=O 408638416 CDLYYXQNQSVOPK-LBPRGKRZSA-N 414.374 2.812 5 40 HFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CC(=O)N(Cc2ccccc2)C1 2617628 SUHXJTJQSAQUQR-OAHLLOKOSA-N 412.398 2.553 5 40 HFBB Cc1n[nH]c(C)c1NC(=O)c1cccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 14404593 SCQGWVXSYCUGRQ-UHFFFAOYSA-N 415.431 2.988 5 40 HFBB COc1ccc([C@H](C)NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420431 NJQVCIYQPGDUTE-UONOGXRCSA-N 421.475 2.635 5 40 HFBB CCc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 224978967 XWUSHICKGAEBKO-CQSZACIVSA-N 405.476 2.801 5 40 HFBB COc1cc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc(OC)c1OC(C)=O 726901 UEZPRNWXKZQPOG-VIZOYTHASA-N 412.354 2.882 5 40 HFBB O=C(NCCc1ccccn1)C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 36398593 IXQLTWJAQZHAJO-UHFFFAOYSA-N 416.865 2.854 5 40 HFBB Cn1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Nc2ccccc2)cc1C(N)=O 40060223 YJDALDFKWKAZGA-UHFFFAOYSA-N 415.431 2.577 5 40 HFBB Cc1ccc(C(=O)CN(C(=O)c2ccc([N+](=O)[O-])cc2)N2C(=O)CCCC2=O)cc1C 408656953 SZDFCLSGPCCARM-UHFFFAOYSA-N 423.425 2.991 5 40 HFBB CCN1CCN(c2ccc(S(=O)(=O)N(CC)c3ccccc3)cc2[N+](=O)[O-])CC1 15173952 UAAURZNSNCLDNJ-UHFFFAOYSA-N 418.519 2.952 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1)Nc1cccc([N+](=O)[O-])c1 30953374 WVIAEKFAEXRBQT-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB COc1ccc(S(=O)(=O)N2CCN(c3cc(C)c(F)cc3[N+](=O)[O-])CC2)cc1 63121409 XMRPFYRZGJMFKO-UHFFFAOYSA-N 409.439 2.562 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC(=O)O)c1ccc(F)c(Cl)c1 225084975 WPQTXUPAPRMZPA-UHFFFAOYSA-N 402.787 2.976 5 40 HFBB O=C1N/C(=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)C(=O)N1c1cccc(Cl)c1 409067556 RHBJSVHHCVZNFR-LFYBBSHMSA-N 404.722 2.959 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 8038722 AYSFSQKKQBRSPO-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(=O)(=O)c1ccc(C)cc1 113889080 YOIHUGYEHUTFOX-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB CC[C@@H](C)OC(=O)CN1C(=O)S/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)C1=O 409363005 IEGBYUIQTKZLHG-YZJXFOOCSA-N 408.388 2.702 5 40 HFBB Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])s3)cc2)n1 1779622 VZMKKWZJRDHCBB-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB Cc1ccc(C(=O)N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)NCCCN(C)C)cc1 2065404 WLBIVKBTUYVWSQ-HMMYKYKNSA-N 410.474 2.742 5 40 HFBB CC(C)OC(=O)[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)OC(C)C)C(=O)C[C@]1(C)O 4142513 AQIDWBRXCNUVNG-UGNRZPKXSA-N 421.446 2.538 5 40 HFBB O=C(NCc1ccco1)c1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 6362290 GNMIFXIKCJBLPY-UHFFFAOYSA-N 401.400 2.919 5 40 HFBB O=C(CSc1nnnn1-c1ccccc1)Nc1nc2ccc([N+](=O)[O-])cc2s1 27572253 DYLTVHPPAIYJOU-UHFFFAOYSA-N 413.444 2.911 5 40 HFBB CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 30550118 XJOJEETUQQCIIH-UHFFFAOYSA-N 421.457 2.889 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 408611888 XKDAAXITFRSVLB-CYBMUJFWSA-N 407.448 2.607 5 40 HFBB CC[C@H](c1nc2c3cnn(-c4ccccc4)c3ncn2n1)n1nc([N+](=O)[O-])cc1C 2809462 AANXOPFDKMDGRP-OAHLLOKOSA-N 403.406 2.876 5 40 HFBB COc1ccc(C)cc1-n1nnnc1SCC(=O)Nc1ccc(F)cc1[N+](=O)[O-] 9912692 XKUPNNQREQFFIG-UHFFFAOYSA-N 418.410 2.757 5 40 HFBB O=[N+]([O-])c1cccnc1N1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1 15163133 HNACRKLOQXCMJG-UHFFFAOYSA-N 417.274 2.808 5 40 HFBB CC(C)(C)c1noc(COc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])n1 32759395 GWMDBUAUAFCQKS-UHFFFAOYSA-N 410.452 2.639 5 40 HFBB COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](CO)C[C@@H](O)c2ccccc2)cc1SC 89423818 PLTJKMNEJPRJCX-CZUORRHYSA-N 406.460 2.540 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)NC(C)(C)CC(C)(C)C)S(C)(=O)=O 223881401 SHRMDQHBGMEBST-UHFFFAOYSA-N 415.512 2.700 5 40 HFBB C[C@H](C(=O)NCCSC1CCCC1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 224074118 SLUZKZPEVFUGEO-CYBMUJFWSA-N 415.537 2.541 5 40 HFBB COC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225081175 ZGASNGCGLHRNEZ-UHFFFAOYSA-N 408.432 2.589 5 40 HFBB O=C(NC(=S)Nc1ccccc1F)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 408622245 OTKNQAMIKUEURZ-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB Cc1ccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2NCCO)cc1Cl 6533058 ZWXXNOPSXNMXRJ-UHFFFAOYSA-N 407.810 2.756 5 40 HFBB CCOc1cccc(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 22392862 LOIYAHOFSJGJKJ-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(C/C=C/c2ccccc2)CC1 38291594 UHLTVMKFZCXKFS-VMPITWQZSA-N 401.488 2.923 5 40 HFBB O=C(O)CCc1nc2cc(F)c(F)cc2c2nc(=O)c(-c3ccc(F)cc3)nn12 97105520 VGMZBZXCOARGNR-UHFFFAOYSA-N 400.316 2.739 5 40 HFBB O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(=O)N1CCOCC1 6495688 NMSXDYNSFLDUST-UHFFFAOYSA-N 415.471 2.939 5 40 HFBB Cc1cccc(CCCNC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 13669260 MZZQOOOMGLKSQF-UHFFFAOYSA-N 419.503 2.727 5 40 HFBB CN(Cc1ccc(C(=O)NC2CC2)cc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 40091157 FHQDSXUZSITRCZ-UHFFFAOYSA-N 406.446 2.835 5 40 HFBB O=[N+]([O-])c1ccc(NC[C@@H](O)CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(Cl)c1 100102048 HEPDOABKOHZIPP-LLVKDONJSA-N 411.758 2.950 5 40 HFBB CC(C)Cn1nnc(NC(=S)NC(=O)c2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 108097927 JHMFUSDUTJTLSP-UHFFFAOYSA-N 415.435 2.624 5 40 HFBB COc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c([N+](=O)[O-])c1 6537906 SXVNGKOXYYRXQR-UHFFFAOYSA-N 413.839 2.759 5 40 HFBB CCN(c1cc(OC)c(OC)cc1C(=O)OC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224762833 OZZZLRSXNMRMJJ-UHFFFAOYSA-N 424.431 2.614 5 40 HFBB Cc1c(CSc2ccc(S(=O)(=O)N3CCOCC3)cn2)cccc1[N+](=O)[O-] 40127717 ZONXVZZHIDYXLP-UHFFFAOYSA-N 409.489 2.611 5 40 HFBB Cc1nn(CC(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)c(C)c1[N+](=O)[O-] 4127021 CXSZQZVEAQEGAC-UHFFFAOYSA-N 401.511 2.521 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@H]([C@H]4C(c5ccc([N+](=O)[O-])cc5)=NO[C@H]34)[C@H]2C(=O)N1c1ccccc1 100204822 LOGYSZUFTVYLIL-HHVJRXKPSA-N 403.394 2.769 5 40 HFBB CC(C)CCNC(=O)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 6944956 NHPFZVPHXKUTBG-UHFFFAOYSA-N 417.915 2.811 5 40 HFBB COc1ccc(Cl)cc1S(=O)(=O)N(C)CC(=O)Nc1cccc([N+](=O)[O-])c1 16188386 SLUFQOOMQAUXMH-UHFFFAOYSA-N 413.839 2.516 5 40 HFBB CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCCOC)[C@@H]1c1cccc([N+](=O)[O-])c1 33850027 CKRWUIUJFBSMBV-GOSISDBHSA-N 404.419 2.582 5 40 HFBB COc1ccc(Cl)cc1S(=O)(=O)N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 408610942 VFBQQTDRWPLGGD-SNVBAGLBSA-N 413.839 2.562 5 40 HFBB COC(=O)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 5559935 XMHQWIDQUOFITH-KRWDZBQOSA-N 410.386 2.648 5 40 HFBB COc1ccc2c(c1)C=C([N+](=O)[O-])[C@@H]([C@@H]1OC(C)(C)O[C@H]1[C@@H]1COC(C)(C)O1)O2 5741908 XCSPWLQVNNIZQE-XSLAGTTESA-N 407.419 2.745 5 40 HFBB COC(=O)COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1Cl 6362246 FUGACWUTIWAXPR-UHFFFAOYSA-N 414.823 2.909 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@H]1CCCc2ccccc21)S(C)(=O)=O 22375244 XANAYMBPTAQLJK-SFHVURJKSA-N 417.487 2.863 5 40 HFBB CC[C@H](C(=O)N1CCc2ccccc2C1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222517411 JTGAJULDPXBGPK-LJQANCHMSA-N 417.487 2.724 5 40 HFBB COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1C 408552272 KYDMMIGINLQWPF-ZDUSSCGKSA-N 407.448 2.526 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 409229740 ULENKJQYRQDQQH-UHFFFAOYSA-N 407.448 2.607 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCC(=O)Nc2cccc(C)c2)c1 8413283 KLWHVMOXVARNSB-UHFFFAOYSA-N 415.402 2.812 5 40 HFBB CC(C)(C)NS(=O)(=O)c1ccc(Sc2nnc3ccccn23)c([N+](=O)[O-])c1 9767064 VMQWOLFSFFGWFG-UHFFFAOYSA-N 407.477 2.866 5 40 HFBB Cc1ccc(CCCNC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 10110558 KGIAEBPKMBGZSD-UHFFFAOYSA-N 419.503 2.727 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@@H](c2ccc([N+](=O)[O-])cc2)n2nnnc2N3)cc1 10232583 FKOVFBWYZFRLAA-QGZVFWFLSA-N 402.374 2.747 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)/c1=N/C(=O)c1ccco1 12731955 JJNKNLVOAKBURU-LYBHJNIJSA-N 420.425 2.741 5 40 HFBB CCOC(=O)C1=C(O)C(=O)N(c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(O)c(OC)c1 20064908 OQYQIRGGWJQMFF-KRWDZBQOSA-N 414.370 2.772 5 40 HFBB Cc1ccc(Sc2ccc(C(=O)O[C@@H](C)C(=O)NC(N)=O)cc2[N+](=O)[O-])cc1 8229940 HTFOAANAAZTBFA-NSHDSACASA-N 403.416 2.795 5 40 HFBB NC(=O)[C@H]1CCCN1Cc1ccccc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 58343990 RVPGNXPDAMQBRN-GOSISDBHSA-N 407.430 2.778 5 40 HFBB COc1ccccc1[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 89909829 UNPJBFNZHLZRSF-CQSZACIVSA-N 421.475 2.797 5 40 HFBB Cc1c(N(CC(=O)NC(C)(C)Cc2ccccc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 224005803 HXKGWSZYERPROJ-UHFFFAOYSA-N 419.503 2.807 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(OC)cc1 224865296 KBDILAQXXFQRJT-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB CCc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 408661113 OEWWOPAGNQFEDE-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 9136817 SMHYQHVBKBAWOO-UHFFFAOYSA-N 420.447 2.568 5 40 HFBB O=C(OCc1nnc(-c2cccs2)o1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 9207700 XNAMXILBBCWDQV-UHFFFAOYSA-N 416.415 2.900 5 40 HFBB O=C(COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)Nc1ccc(F)cc1F 25357356 LVCSHJHQOBUZTG-UHFFFAOYSA-N 421.356 2.505 5 40 HFBB CC[C@@H](C)n1c(=N)c(C(=O)NCc2cccnc2)cc2c(=O)n3cc(C)ccc3nc21 100628120 PJURUOBAKUUNTA-OAHLLOKOSA-N 416.485 2.733 5 40 HFBB Cc1ccc(/C=c2/s/c(=C\C(=O)c3ccc(Cl)cc3)[nH]c2=O)cc1[N+](=O)[O-] 105631969 CFPFQCLSKCNQOM-XXGRXQMWSA-N 400.843 2.799 5 40 HFBB COc1ccc(OC)c([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])c1 408564924 GLHWNMJRVGJKMP-UFGBVDADSA-N 409.442 2.758 5 40 HFBB O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1cccc(I)c1 3295969 YAURJEROXMRVHF-UHFFFAOYSA-N 416.127 2.588 5 40 HFBB COc1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c(OC)c1OC 3529886 SFIJOXBWOHWKAL-UHFFFAOYSA-N 405.359 2.844 5 40 HFBB CCOc1cc2c(cc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)O[C@H](C)C2 12975536 AQOWKWMQCWCZNI-LLVKDONJSA-N 420.443 2.973 5 40 HFBB COCCCn1ccc(Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2[N+](=O)[O-])n1 72302114 SPOKOWHQLDHWQP-UHFFFAOYSA-N 411.484 2.648 5 40 HFBB COc1cc(C(=O)NC(=S)Nc2ccc(F)c([N+](=O)[O-])c2)cc(OC)c1OC 881661 SSEITULGTMNLJR-UHFFFAOYSA-N 409.395 2.887 5 40 HFBB Cc1ccc(OCC(=O)NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4663053 KGNYRIVTTNKCCK-UHFFFAOYSA-N 414.487 2.505 5 40 HFBB COCC(=O)Nc1cccc(C(=O)Nc2nnc(-c3ccc([N+](=O)[O-])cc3)s2)c1 9062471 FYEFLIAQEZEGTR-UHFFFAOYSA-N 413.415 2.951 5 40 HFBB COc1ccc(/C=C/C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2O)cc1OC 36092507 CCNCWUDUWLWPSO-XBXARRHUSA-N 403.416 2.844 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3ccccc3F)CC2)c([N+](=O)[O-])c1 408573031 LEZBOGJLVVGVBT-UHFFFAOYSA-N 401.394 2.873 5 40 HFBB Cc1n[nH]c(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)c1[N+](=O)[O-] 4148586 VSUOQONPLVMPEN-SSDOTTSWSA-N 409.493 2.642 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C)c(S(=O)(=O)N2CCCC2)c1 9227553 GMTULJXOZKOUDJ-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB COc1ccccc1NC(=S)NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 17090587 PHMYOMCWPIEUDY-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB NC(=O)Cn1c(SCCOc2cccc([N+](=O)[O-])c2)nnc1-c1cccs1 40127866 QTWGVXYLGCAMCQ-UHFFFAOYSA-N 405.461 2.571 5 40 HFBB O=[N+]([O-])c1ccc(N2CCC[C@H](c3ccncn3)C2)c(S(=O)(=O)N2CCCC2)c1 69388253 SCVVHNKUPQXNLS-HNNXBMFYSA-N 417.491 2.553 5 40 HFBB COc1cc(OC)c([N+](=O)[O-])cc1/C=C1/NC(=O)N(Cc2ccccc2F)C1=O 409095712 IHEQEGVQSIZYQH-VGOFMYFVSA-N 401.350 2.844 5 40 HFBB COC(=O)c1sc2ncn3nc([C@@H](C)Cn4nc([N+](=O)[O-])cc4C)nc3c2c1C 2804185 ATQOHEDKNPNBTA-QMMMGPOBSA-N 415.435 2.651 5 40 HFBB Cc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1C 4393616 OGZOITFFPLASDZ-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB O=C1Nc2ccccc2S[C@H]1CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 12593081 ZSBJFIZTTWQGQZ-SFHVURJKSA-N 412.471 2.747 5 40 HFBB O=C(OCC(=O)N1CCNC1=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 24915703 ZRAFTXSMIFVQNR-UHFFFAOYSA-N 419.777 2.749 5 40 HFBB NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 97229467 GBVVVVOMRDAITG-INIZCTEOSA-N 410.808 2.875 5 40 HFBB CCNS(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OCC 408701486 YSHWAQYZECTOEP-UHFFFAOYSA-N 407.448 2.852 5 40 HFBB C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2=O 3336260 XNPSWGZYKSTYKE-WYRIXSBYSA-N 406.414 2.809 5 40 HFBB CSCC[C@H](NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C)c1nc2ccccc2[nH]1 8216851 WZZDTKAADNFBMA-HNNXBMFYSA-N 402.480 2.895 5 40 HFBB CN(C)CCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@H]1c1cccc([N+](=O)[O-])c1 8374011 PLBBENKTWOWIDZ-GOSISDBHSA-N 411.389 2.947 5 40 HFBB O=C(CSc1ccc2nnc(-c3ccccn3)n2n1)Nc1ccc([N+](=O)[O-])cc1 9599806 GUMTUHCUOYZRNV-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 12864628 WKOPWWIYXVGEQY-CYBMUJFWSA-N 403.460 2.750 5 40 HFBB CCOc1cc(C(=O)N2CCC[C@H](C(=O)N3CCCCC3)C2)c([N+](=O)[O-])cc1OC 50655727 JWEDUHRJISOGFA-HNNXBMFYSA-N 419.478 2.867 5 40 HFBB O=[N+]([O-])c1cccc(N2CCN(S(=O)(=O)c3ccc(F)c(F)c3F)CC2)c1 51226379 RKXSJGUZYMJQQZ-UHFFFAOYSA-N 401.366 2.523 5 40 HFBB CCOC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113885125 OSDROELZXTYYFD-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB CCOc1ccccc1NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220401197 PNHWBFVKXCVGAS-CYBMUJFWSA-N 407.448 2.787 5 40 HFBB CCOc1ccc(-c2noc(CNS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 223581889 OFJVZDBFPMGACV-UHFFFAOYSA-N 418.431 2.830 5 40 HFBB CC1=C(C(N)=O)[C@H](c2ccccc2[N+](=O)[O-])N2NC(c3cccc(Cl)c3)=NC2=N1 4279811 LHOAVKQVKSPCSL-INIZCTEOSA-N 410.821 2.685 5 40 HFBB O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H](c1cccs1)N1CCOCC1 12594983 YFMSMTDMSRLILV-QGZVFWFLSA-N 404.492 2.648 5 40 HFBB O=C(c1ccc2c(c1)OCO2)N1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 24865772 JFWHINDPGAULHH-UHFFFAOYSA-N 406.398 2.834 5 40 HFBB CCCCCOC1CN(S(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 79012789 ZJDKGETYSNDXKD-UHFFFAOYSA-N 407.286 2.937 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1CN(c2ccc(F)cc2)C1=O 95469337 ASUIQPWNFFXLTG-IBGZPJMESA-N 415.424 2.825 5 40 HFBB COc1ccccc1NC(=O)[C@@H](C)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 220382049 QLLWSTQGEDGASP-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COC(=O)CN(c1ccc(OC(C)C)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224761787 NQIWWYJRVUUPOK-UHFFFAOYSA-N 408.432 2.750 5 40 HFBB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c1C 4508542 IITDLCVYSGFRCH-GFCCVEGCSA-N 417.418 2.821 5 40 HFBB O=C(O)c1cc(Br)ccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 6316376 LXKWXGKBZYKOCC-UHFFFAOYSA-N 401.194 2.856 5 40 HFBB CC1(C)Cc2cccc(OCC(=O)OCC(=O)Nc3ccccc3[N+](=O)[O-])c2O1 8194254 PSUIOELJVPWTIG-UHFFFAOYSA-N 400.387 2.869 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(CC(=O)Nc4cccc([N+](=O)[O-])c4)cnc32)cc1C 11758435 FSCSOYGSXQNITE-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)N(C)c1ccccc1 40127941 JFCMPRXLMAWAAU-UHFFFAOYSA-N 424.413 2.999 5 40 HFBB C[C@@H](C(=O)N1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220414928 PVMHPZLEULRNHC-AWEZNQCLSA-N 403.460 2.729 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c4cnccc34)CC2)cc1 12514774 GAXRPARKGWRJAP-UHFFFAOYSA-N 412.471 2.962 5 40 HFBB O=C(CSc1nc2cc([N+](=O)[O-])ccc2o1)NC[C@@H]1COc2ccccc2O1 32777392 BAXQPTDKHJAZHM-GFCCVEGCSA-N 401.400 2.784 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1OCc1cccc(Cl)c1 5207090 IKRSBSVAEKFAPK-UHFFFAOYSA-N 412.851 2.848 5 40 HFBB Cc1c(C(=O)NC(=S)Nc2sc3c(c2C(N)=O)CCC3)cccc1[N+](=O)[O-] 6825176 XLRSJGGGHWAABO-UHFFFAOYSA-N 404.473 2.679 5 40 HFBB C[C@@H](OC(=O)c1ccc(CN2CCCC2=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 12797905 OEMNOXDQRMKUAW-CQSZACIVSA-N 411.414 2.901 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 408588939 DFBFHIWJUSFRQK-ZDUSSCGKSA-N 407.448 2.607 5 40 HFBB CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1C 3426762 TVRAZZRHLUVVNM-UHFFFAOYSA-N 419.390 2.521 5 40 HFBB Cn1c(CCN2CCOCC2)nc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3)ccc21 13206257 KVMXBPAGKWMGBP-UHFFFAOYSA-N 409.446 2.609 5 40 HFBB Cc1n[nH]c(C)c1NC(=O)c1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 14404735 ZJUDXKNYJGMNSJ-UHFFFAOYSA-N 415.431 2.988 5 40 HFBB CCCn1c(=N)c(S(=O)(=O)c2ccc(C)cc2)cc2c(=O)n3ccccc3nc21 100826523 XHHSTVLOIAQSOM-UHFFFAOYSA-N 408.483 2.680 5 40 HFBB CCOC(=O)CN(c1ccccc1OCC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225021925 SJFNOAIOAUNQRV-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB CC1=C(C(N)=O)[C@H](c2ccc([N+](=O)[O-])cc2)N2NC(SCc3ccccc3)=NC2=N1 4176686 AMKAFAVFUWAOLI-KRWDZBQOSA-N 422.470 2.874 5 40 HFBB C[C@H](CC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 6787903 YODCZGJRYRMRJT-MRXNPFEDSA-N 417.487 2.622 5 40 HFBB CC(=O)N[C@@H](CC(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 4219846 NATZQDGHXLBJGY-SFHVURJKSA-N 400.387 2.772 5 40 HFBB COc1ccc(C(=O)CN2C(=O)c3ccccc3O[C@H](C(C)C)C2=O)cc1[N+](=O)[O-] 6757087 LMYPNZPABJMDJB-LJQANCHMSA-N 412.398 2.872 5 40 HFBB CC(C)N1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@@H]2c2ccccc2)C1=O 9009601 MZVZMHPMTUOEQK-GCJKJVERSA-N 422.441 2.802 5 40 HFBB COc1ccc(Cn2c(=O)c3cccnc3n(Cc3cccc([N+](=O)[O-])c3)c2=O)cc1 20356841 AVRKCIVYCOZJEK-UHFFFAOYSA-N 418.409 2.572 5 40 HFBB CCN(Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1)c1nc2ccccn2c1[N+](=O)[O-] 24969863 RKNLEJHLERUTCO-UHFFFAOYSA-N 424.417 2.523 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1cccc(C)c1)S(C)(=O)=O 220132146 NCAMFNCIWFHLNU-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)CSCc1ccc([N+](=O)[O-])cc1 225184250 CVVNCZZQUXBXBV-OAHLLOKOSA-N 401.488 2.991 5 40 HFBB O=C(COc1ccccc1/C=C/c1nc(O)c([N+](=O)[O-])c(=O)[nH]1)Nc1ccccc1 9186407 OKNUCUOVJMPZDI-ZHACJKMWSA-N 408.370 2.572 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NCC(=O)N(c1ccccc1)[C@@H]1CCS(=O)(=O)C1 11117791 JJMRCPXRMWGWED-QGZVFWFLSA-N 403.460 2.535 5 40 HFBB COc1ccc(-n2nnnc2SCC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cc1 12273867 MPOBKABDNISQCX-UHFFFAOYSA-N 420.838 2.963 5 40 HFBB CCOc1cc2c(cc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)O[C@@H](C)C2 12975538 AQOWKWMQCWCZNI-NSHDSACASA-N 420.443 2.973 5 40 HFBB Cc1ccc(NC(=O)CS[C@H](C)C(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 22061541 SVLFGNFBPUFFQD-RDTXWAMCSA-N 417.487 2.813 5 40 HFBB COc1ccc(/C=C/c2nc3s/c(=C\c4ccc([N+](=O)[O-])cc4)c(=O)n3n2)cc1 27022516 AZGBKKPMAMRJMG-PWFSRHFBSA-N 406.423 2.786 5 40 HFBB O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)Nc1ccc([N+](=O)[O-])cc1Cl 31634607 VTSFGZUEXAWFLP-IBGZPJMESA-N 414.805 2.580 5 40 HFBB Cc1nc2c(-c3ccco3)nc(=O)n(CC(=O)Nc3cccc([N+](=O)[O-])c3)c2s1 41105070 KTQVMDDGQLIMDS-UHFFFAOYSA-N 411.399 2.968 5 40 HFBB Cc1cc(S(=O)(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c([N+](=O)[O-])s1 1561425980 PPTYLQDHSDOIJB-MNOVXSKESA-N 419.525 2.983 5 40 HFBB CCN(C(=O)COC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 12886986 KRAWWKFXPVLWGH-UHFFFAOYSA-N 423.491 2.510 5 40 HFBB Cc1ccccc1C(=O)NC(=S)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 20410889 KAMJDVKHTBQLAB-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB CCOc1ccccc1N1CCN(S(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1 603777613 FDPGJZPYLMOGJB-UHFFFAOYSA-N 421.475 2.513 5 40 HFBB CN1CCN(CCc2nc3cc(NC(=O)c4cccc([N+](=O)[O-])c4)ccc3n2C)CC1 2331685 CEIJRMKCOXPVKP-UHFFFAOYSA-N 422.489 2.524 5 40 HFBB C[C@H](Oc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13)C(=O)NCCCO 6624585 SJSQNRRZYCKUBC-AWEZNQCLSA-N 415.449 2.858 5 40 HFBB biogenic COc1ccc(NC(=O)N2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)c([N+](=O)[O-])c1 23395780 HKJVTKFBYFVQLW-HNNXBMFYSA-N 403.391 2.702 5 40 HFBB C[C@@H](OC(=O)Cc1ccc(N2CCCC2=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 25112998 DXCMTBIJRZSOKJ-CQSZACIVSA-N 411.414 2.835 5 40 HFBB O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1CCc2cc([N+](=O)[O-])ccc21 32809352 FAFBFXNKSQKCSY-UHFFFAOYSA-N 419.434 2.721 5 40 HFBB Cc1nn(C)c(N2CCCN(Cc3cn4cc(Cl)ccc4n3)CC2)c1[N+](=O)[O-] 72312228 BKMUHTPIQMCPFJ-UHFFFAOYSA-N 403.874 2.650 5 40 HFBB O=C(O)CN1C(=O)N/C(=C/c2cn(Cc3cccc([N+](=O)[O-])c3)c3ccccc23)C1=O 408587887 ALEXKMXNPOOFEW-RQZCQDPDSA-N 420.381 2.575 5 40 HFBB Cc1cccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@H]32)c1C 7718544 YHYACIYGZHMSTF-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB Cc1ccc(NC(=O)COC(=O)CNC(=O)c2ccc3ccccc3c2)c([N+](=O)[O-])c1 8691999 GBFXHEDVRPGPMD-UHFFFAOYSA-N 421.409 2.968 5 40 HFBB aggregator Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1cnn(Cc2ccccc2)c1 12949913 LBIJCYQMXAXAMV-UHFFFAOYSA-N 400.460 2.969 5 40 HFBB CC(C)C[C@H](NC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1)C(=O)O 2949189 ZAAHMCZTFYZBSA-QZFKAFNDSA-N 415.402 2.574 5 40 HFBB COc1cccc(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])c1 3170553 QDJUMGKHORJPAK-KRWDZBQOSA-N 419.459 2.785 5 40 HFBB O=C1N(c2ccc(Cl)cc2)[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc([N+](=O)[O-])cc1 7718576 WCZLWBMQHGBKHG-HZPDHXFCSA-N 407.835 2.860 5 40 HFBB CCCNS(=O)(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2)cc1 8562397 JQCWTZHVLYGVJF-ZDUSSCGKSA-N 407.448 2.689 5 40 HFBB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1cc([N+](=O)[O-])ccc1Cl 15379356 JWFAOMLUXLQWAI-UHFFFAOYSA-N 401.762 2.885 5 40 HFBB COc1ccc(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 17090597 RIMJWYNPQVFFGM-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB CNS(=O)(=O)c1ccc(Nc2ccc(OC[C@H]3CCCO3)cc2)c([N+](=O)[O-])c1 40153790 DSBAFBBVSKMHIC-OAHLLOKOSA-N 407.448 2.804 5 40 HFBB N=c1c(C(=O)NCc2cccnc2)cc2c(=O)n3ccccc3nc2n1C1CCCC1 100560171 PXRYIQIOPUQBLS-UHFFFAOYSA-N 414.469 2.569 5 40 HFBB Cc1cc(C)cc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)c1 12421639 BZNXDXZWQSANHX-QZTJIDSGSA-N 417.512 2.989 5 40 HFBB CC[C@@H](C(=O)Nc1cccc(C(C)=O)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222523270 FSCCVPXYIOVMGQ-SFHVURJKSA-N 419.459 2.981 5 40 HFBB CCOc1ccccc1N(CC(=O)OC)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224770253 YOPWEMYWQORIPF-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1cc(Cl)c(C)cc1NC(=O)Cn1cnc2cc([N+](=O)[O-])ccc2c1=O 2652890 DASBKAYIHANLLE-UHFFFAOYSA-N 402.794 2.914 5 40 HFBB CCN(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1 7977199 UOWFJKYALXEBQQ-UHFFFAOYSA-N 413.430 2.641 5 40 HFBB O=[N+]([O-])c1ccccc1[C@@H]1c2c(/C=C/c3ccccc3)nnc(O)c2Nc2nnnn21 10297888 ZEKDLMZBJGWKQT-DOJUMQAQSA-N 414.385 2.942 5 40 HFBB O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc([N+](=O)[O-])cc1 12915705 BOROIGMKNZPPFC-UHFFFAOYSA-N 403.460 2.699 5 40 HFBB Cc1c(NC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cccc1[N+](=O)[O-] 19930726 UVGMCWLJTIMFRD-UHFFFAOYSA-N 403.460 2.915 5 40 HFBB Cc1sc2nc(CN3CCN(Cc4ccc([N+](=O)[O-])cc4)CC3)[nH]c(=O)c2c1C 21841985 AFGNEMJGABSUEP-UHFFFAOYSA-N 413.503 2.827 5 40 HFBB Cc1noc(C(C)C)c1C(=O)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 23032783 HZBPKVDHZAIFQQ-UHFFFAOYSA-N 416.434 2.520 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O 24068373 UPRGVKRJQPWFEH-YUNKPMOVSA-N 402.451 2.979 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(Cc3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 10272619 KZDKFWHEEZXGDZ-MOPGFXCFSA-N 415.471 2.819 5 40 HFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 12792397 OQNGNHUYFKPEMA-UHFFFAOYSA-N 420.356 2.979 5 40 HFBB CCCNS(=O)(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1OC 14291970 AXGCHSYYVGMHBI-UHFFFAOYSA-N 407.448 2.852 5 40 HFBB O=C(N[C@@H]1C=Nc2ccc([N+](=O)[O-])cc2NC1=O)c1cc(Cl)cc([N+](=O)[O-])c1 16957654 ZGHYXQZXLUYDJA-CQSZACIVSA-N 403.738 2.609 5 40 HFBB COC(=O)c1cc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc([N+](=O)[O-])c1 24596542 DPAGSOCHIGLMKD-UHFFFAOYSA-N 408.370 2.598 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1C 8040067 UGJCHVYMWXRRIM-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB COc1cc(NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])c(C)cc1[N+](=O)[O-] 9715998 GTBNVLLSKLHPLF-UHFFFAOYSA-N 403.347 2.544 5 40 HFBB O=C(COc1ccccc1C(=O)N1CCOCC1)Nc1cc([N+](=O)[O-])ccc1Cl 24984949 NSFRHPMJDRQQEL-UHFFFAOYSA-N 419.821 2.738 5 40 HFBB O=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] 58226923 RNFQQVYZPKDHQJ-UHFFFAOYSA-N 411.386 2.910 5 40 HFBB O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1cccc(C(F)(F)F)c1 103622061 GXOVXWRMIRKGNK-UKRRQHHQSA-N 405.288 2.906 5 40 HFBB Cc1ccc(CCCNC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220417317 SNYGCNKELYYOOU-INIZCTEOSA-N 419.503 2.807 5 40 HFBB Cc1cccn2c(=O)c3cc(C(=O)NCC(C)C)c(=N)n(Cc4ccccc4)c3nc12 101149025 PEDTWPYSNNPFJF-UHFFFAOYSA-N 415.497 2.871 5 40 HFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CC(=O)N(Cc2ccccc2)C1 2617627 SUHXJTJQSAQUQR-HNNXBMFYSA-N 412.398 2.553 5 40 HFBB Cc1ccc[n+](C2=NC(=O)S/C2=C/NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 38191522 QJZAVPHRUAAORY-UHFFFAOYSA-O 401.384 2.670 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420637 VLHOLQUJUQIJKP-HUUCEWRRSA-N 405.476 2.935 5 40 HFBB COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 408569989 RIRNPNFJYMEMSO-UHFFFAOYSA-N 412.446 2.694 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 408649038 ZERHEZNTJXOWTM-NSHDSACASA-N 400.347 2.503 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1C 7323157 TVSFAVJUNBZRHU-UHFFFAOYSA-N 416.459 2.810 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 7982418 XBPFHDISNOEMIA-LJQANCHMSA-N 416.821 2.962 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1cc(=O)n2ccsc2n1 10722734 TYGIAAIFOKWQIJ-UHFFFAOYSA-N 417.446 2.968 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2ccccc2N2CCOCC2)c1C 12608646 WHSPLTHXPSCCDJ-UHFFFAOYSA-N 419.503 2.869 5 40 HFBB N=C1NC(=O)/C(=C/c2ccccc2OS(=O)(=O)c2cccc([N+](=O)[O-])c2)S1 408753441 MTAMENQKEJPULU-ZSOIEALJSA-N 405.413 2.501 5 40 HFBB Cc1cc([N+](=O)[O-])nn1CCCC(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 2601675 OFMVFPYIPLXWTQ-SNVBAGLBSA-N 405.480 2.804 5 40 HFBB CS(=O)(=O)Nc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1F 32001965 LVKZJDKLINPKOE-UHFFFAOYSA-N 408.411 2.932 5 40 HFBB CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCCOC)[C@H]1c1cccc([N+](=O)[O-])c1 33850028 CKRWUIUJFBSMBV-SFHVURJKSA-N 404.419 2.582 5 40 HFBB CC[C@H](C(=O)Nc1cccc(OC)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222514883 ZXXBLLYWWVHSOX-QGZVFWFLSA-N 407.448 2.787 5 40 HFBB O=C(NCC(=O)N1CCC[C@@H](c2c[nH]c3ncccc23)C1)Nc1cccc([N+](=O)[O-])c1 1648294631 YCBHHNBODONOLE-CQSZACIVSA-N 422.445 2.999 5 40 HFBB O=C(CSc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1)Nc1nccs1 9369115 FVFPMNKBYFZANV-UHFFFAOYSA-N 422.473 2.886 5 40 HFBB CC[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)N(c1ccccc1)S(C)(=O)=O 13711441 VCPOBLFBUCVKOO-INIZCTEOSA-N 407.448 2.787 5 40 HFBB CCOc1cccc(NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220417558 IFYYWRFUSYQLFN-CYBMUJFWSA-N 407.448 2.787 5 40 HFBB O=[N+]([O-])c1ccc(-n2cccc2[C@H]2[C@H](c3ccccn3)NC(=S)N2CCO)cc1 223589478 YHPFMXHILZVEKZ-OALUTQOASA-N 409.471 2.745 5 40 HFBB COc1c2c(cc3c1[C@@H](C[C@@H](O)c1ccc4c(c1)OCO4)[N+](C)(C)CC3)OCO2 1824626 JDIXVBCUSZMZDF-HZPDHXFCSA-N 400.451 2.950 5 40 HFBB biogenic CCNc1cc(N2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)ccc1[N+](=O)[O-] 4703733 RVAFZINOPCNNKU-UHFFFAOYSA-N 404.492 2.846 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(Cc3nc4ccccc4s3)CC2)cc1 12974179 CLRGVUBTYUTLBY-UHFFFAOYSA-N 418.500 2.711 5 40 HFBB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc(Cl)cc([N+](=O)[O-])c2O)C1=O 409012295 QEDNXXHNTPTQOU-IGCGCMMHSA-N 400.796 2.942 5 40 HFBB COc1ccc(N2C[C@H](NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2=O)cc1OC 4497697 VULWDBMHDRFXED-WSVPDTOYSA-N 411.414 2.547 5 40 HFBB COC(=O)c1n[nH]c2ccc(NS(=O)(=O)c3cc(C)c(F)c([N+](=O)[O-])c3)cc12 89587235 BGCWZSRCRWCPSF-UHFFFAOYSA-N 408.367 2.506 5 40 HFBB Cc1noc(C)c1[C@H](C)C(=O)N1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 95939684 XBYDDEUEFVRDRB-LBPRGKRZSA-N 412.450 2.918 5 40 HFBB CC(C)[C@@H](NC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1)C(=O)O 4611179 ONJOBRKDTHKTFV-XCMFGDQWSA-N 411.414 2.591 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(CC(=O)Nc4cccc([N+](=O)[O-])c4)cnc32)c(C)c1 15391361 LWECONLYNSIZSW-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225009814 HPDGZUCKUGFENS-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB COc1ccc(OC)c([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])c1 408564923 GLHWNMJRVGJKMP-RYTRXMBJSA-N 409.442 2.758 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 3359987 SESKFPCOAOIXCW-UHFFFAOYSA-N 413.839 2.759 5 40 HFBB CCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Sc1ncnc2[nH]cnc12 17059237 VGYWXCIIKAKPHR-UHFFFAOYSA-N 404.364 2.887 5 40 HFBB CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1cc(C)ccc1OC 39985532 TZUUMVGQNARKET-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB O=C(c1ccc([N+](=O)[O-])o1)N1CCN(CCCc2nc(-c3cccs3)no2)CC1 53195597 BIDKYDTYCALUPW-UHFFFAOYSA-N 417.447 2.690 5 40 HFBB O=C1CSc2ccc(C(=O)N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)cc2N1 58011083 AENBWVOAATWTTC-UHFFFAOYSA-N 412.471 2.597 5 40 HFBB CCNc1nnc(-c2nn(-c3ccc([N+](=O)[O-])cc3)c(=O)c3c(N)scc23)s1 18996140 WCUIHBINGPTNCH-UHFFFAOYSA-N 415.460 2.888 5 40 HFBB O=C(COC(=O)C12C[C@H]3C[C@@H](CC(Cl)(C3)C1)C2)NC(=O)c1cccc([N+](=O)[O-])c1 102253781 RGAKDCFIZJDWCV-CJKMCJCZSA-N 420.849 2.972 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CC(=O)O)c1ccc(OC(C)C)cc1 225092468 YKYLDCXFTWJCCK-UHFFFAOYSA-N 408.432 2.970 5 40 HFBB NC(=O)c1ccc(SCC(=O)N[C@@H](c2nccs2)C(F)(F)F)c([N+](=O)[O-])c1 507590747 WXJPJWIRMFRPBH-NSHDSACASA-N 420.394 2.662 5 40 HFBB O=C(COC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(F)cc1 9705596 UAAJNNFCGQZXDE-UHFFFAOYSA-N 417.349 2.604 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)N(C)Cc3cccc(F)c3)cc2[N+](=O)[O-])CC1 12555141 LITHLGYWQLOTAI-UHFFFAOYSA-N 414.437 2.675 5 40 HFBB O=c1[nH]c(/C=C/c2ccc(OCc3ccccc3[N+](=O)[O-])cc2)c([N+](=O)[O-])c(=O)[nH]1 108245167 XRBGLTURODJWNL-JXMROGBWSA-N 410.342 2.629 5 40 HFBB COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 225789447 HWNMCIMRMFGYMK-UHFFFAOYSA-N 413.839 2.516 5 40 HFBB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl 408555955 YCSSYVSBNWVSPT-JTQLQIEISA-N 413.839 2.562 5 40 HFBB O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 6393259 IWEMQJMYRMHAML-UHFFFAOYSA-N 409.398 2.648 5 40 HFBB O=C(CSc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1)NC1CCCC1 8821960 RLGWPHLGJWFUGV-UHFFFAOYSA-N 407.477 2.850 5 40 HFBB Cc1ccc(-c2nc3n(n2)[C@@H](C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC(=O)N3)cc1 10153418 GHJMAVAQDORWJV-MRXNPFEDSA-N 406.402 2.992 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 12517299 GXQWIOVHCAEEBR-UHFFFAOYSA-N 424.910 2.796 5 40 HFBB CCOC(=O)CSc1nc2ccccc2c2nc(=O)c(-c3ccc(OC)cc3)nn12 40153149 URRWUTPADINULK-UHFFFAOYSA-N 422.466 2.969 5 40 HFBB C[C@H]1CCC[C@H](C(=O)NS(=O)(=O)c2cc([N+](=O)[O-])c(N)cc2Br)C1 72310843 DJCOUONVKQPQFP-IUCAKERBSA-N 420.285 2.571 5 40 HFBB O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@H]2C(=O)N1c1ccc(Br)cc1 101042234 DWXNCTJRXPRHGS-HIFRSBDPSA-N 416.187 2.650 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccccc1[N+](=O)[O-] 940585 YTGLOHJLDZFSHN-QGZVFWFLSA-N 407.390 2.518 5 40 HFBB CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C 16692323 XHZRVXCLBOFVFC-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB Cc1cc(NCC2(CS(C)(=O)=O)CCOCC2)nc(-c2cccc([N+](=O)[O-])c2)n1 89600681 PUMHZIKZVGLSBK-UHFFFAOYSA-N 420.491 2.614 5 40 HFBB Cc1ccc2nc3c(cc(C(=O)NCc4ccccc4)c(=N)n3C(C)C)c(=O)n2c1 100630625 DGXUIQXGISGTGF-UHFFFAOYSA-N 401.470 2.948 5 40 HFBB CC(C)OC(=O)[C@@H]1C[C@](C)(O)C(=O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 4546809 DFQLPYSPKQLGGU-LHUKNYEISA-N 421.446 2.538 5 40 HFBB O=C(Nc1ccc2c(c1)OCCO2)c1cccn(Cc2cccc([N+](=O)[O-])c2)c1=O 5270756 OUCDXNYGPFWTQH-UHFFFAOYSA-N 407.382 2.828 5 40 HFBB CCCN1CCN(c2ccc(S(=O)(=O)NC3CCC(C)CC3)cc2[N+](=O)[O-])CC1 8051175 HHRUAJDMQZYHNQ-UHFFFAOYSA-N 424.567 2.984 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)N(C)Cc1ccccc1)S(C)(=O)=O 220378067 AXBFHGKROXLBLG-OAHLLOKOSA-N 405.476 2.716 5 40 HFBB NC1=Nc2nc3cc4c(cc3n2[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)N1)OCCCO4 12549543 SQDNSRTURGLERA-INIZCTEOSA-N 414.809 2.856 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8626364 XJCSWNXGBBLROA-CQSZACIVSA-N 420.443 2.637 5 40 HFBB CCCNC(=O)[C@H]1CN(CC(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2O1 18935867 ZVVGBHZYSTWMCB-LJQANCHMSA-N 412.446 2.636 5 40 HFBB Cc1ccc(C(=O)N2CCN([C@@H]3CCCN(c4ccccc4)C3=O)CC2)cc1[N+](=O)[O-] 95998381 UKCLJGPLEZHEDM-HXUWFJFHSA-N 422.485 2.857 5 40 HFBB Cc1ccccc1CNC(=O)CCCN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222360952 NDPMPVZQTVQOAV-UHFFFAOYSA-N 405.476 2.766 5 40 HFBB COc1ccc(C(=S)N2CCOCC2)cc1OC(=O)c1ccc([N+](=O)[O-])cc1 866308 YMBOIIARBNPBDJ-UHFFFAOYSA-N 402.428 2.830 5 40 HFBB CCN1CCN(c2ccc(Nc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)CC1 7273165 SSBGMCQKSUQOLR-UHFFFAOYSA-N 404.492 2.884 5 40 HFBB CCc1c(C)nc(-n2nc(C)cc2NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)[nH]c1=O 7421965 SGOCHHUYZQSMKM-UHFFFAOYSA-N 416.825 2.949 5 40 HFBB O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nn(-c2ccc(F)cc2)c2c1CCC2 11240991 BLWXNNRBHSWHIN-IBGZPJMESA-N 410.405 2.872 5 40 HFBB COC(=O)c1ccc(CN2C(=O)S/C(=C/c3cccc([N+](=O)[O-])c3O)C2=O)o1 108283191 MHNXQUJJMUSWDE-NTUHNPAUSA-N 404.356 2.917 5 40 HFBB O=C(CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1)Nc1ccccc1[N+](=O)[O-] 4908990 IXWJZZPUOMRNRV-UHFFFAOYSA-N 415.425 2.959 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)N[C@H](C)c3ccc(F)cc3)cc2[N+](=O)[O-])CC1 12556458 ZTMQAZWESVPCDD-CQSZACIVSA-N 414.437 2.893 5 40 HFBB CCCCn1nc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O 15554585 LQLZDLZOSFBZSY-UHFFFAOYSA-N 409.446 2.947 5 40 HFBB COc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 17090589 UPKXRMWXHOGHMP-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB COc1ccccc1[C@H](CNc1nc(N)c([N+](=O)[O-])c(N2CCCCC2)n1)N(C)C 35681941 VEKJVHAQJYRCPK-HNNXBMFYSA-N 415.498 2.681 5 40 HFBB CC(C)(C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 409196478 ZJYXNIMKWFIPDN-UHFFFAOYSA-N 407.448 2.689 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 7872064 YQFUVQPLSNHYLS-LLVKDONJSA-N 411.411 2.536 5 40 HFBB COc1ccc(C2=N/C(=C/c3cc(OC)c(OC)c(OC)c3)C(=O)O2)cc1[N+](=O)[O-] 8209979 SWAHCQNPWPBWDA-NTUHNPAUSA-N 414.370 2.974 5 40 HFBB C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)Nc2ccccc2O)CC1 12749932 HNGAYTLLHNORPC-CQSZACIVSA-N 412.446 2.978 5 40 HFBB NC(=O)c1ccccc1Nc1nc2nc3ccccc3c(=O)n2cc1Br 100737570 SRBBCBKHZBAZNF-UHFFFAOYSA-N 410.231 2.848 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1cccc(Cl)c1 408669827 OXSNDYPHQHVZLV-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB Cc1cccc(NC(=O)CN2C(=O)N/C(=C/C=C/c3ccccc3[N+](=O)[O-])C2=O)c1 409105053 IEMIYJVOQUGTTH-JZJJTTEJSA-N 406.398 2.991 5 40 HFBB CCOc1ccc(NC(=O)CN(C)c2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OCC 8051863 XDVXOIMNVKIARF-UHFFFAOYSA-N 416.434 2.566 5 40 HFBB COc1ccc(-c2nonc2NC(=O)COc2ccccc2[N+](=O)[O-])cc1OC 8767053 OZIBEFJGDKFIJC-UHFFFAOYSA-N 400.347 2.680 5 40 HFBB Cc1ccc(CNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])cc1F 12556443 OMMFUTJDYLTULN-UHFFFAOYSA-N 422.482 2.591 5 40 HFBB Cc1cc(=O)c(C(=O)N(C)CCOc2ccccc2)nn1-c1ccccc1[N+](=O)[O-] 18072980 DUIDYJVABCWWAU-UHFFFAOYSA-N 408.414 2.600 5 40 HFBB COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1 57314151 IGAPDHPMFSTLGJ-RMKNXTFCSA-N 424.457 2.785 5 40 HFBB CCOC(=O)CN(c1cccc(OC)c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225073963 XNDURIVAALXRCJ-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1cccnc1 833463 UDANJYPTOMQPEG-UHFFFAOYSA-N 412.427 2.824 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C(=O)NC(C)C 13678825 HNDHKRKCCJOZMB-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB Cc1c(NC(=O)COc2ccc(S(=O)(=O)N3CCCC3)cc2)cccc1[N+](=O)[O-] 16250194 UDJGVVBHHILAAO-UHFFFAOYSA-N 419.459 2.705 5 40 HFBB O=C(Nc1cccc([N+](=O)[O-])c1)C1CCN(S(=O)(=O)Cc2ccccc2F)CC1 19868492 GPPJBOZEDAQJPZ-UHFFFAOYSA-N 421.450 2.914 5 40 HFBB Cc1nn(CCC(=O)N2CCC[C@@H](n3nccc3C(F)(F)F)C2)c(C)c1[N+](=O)[O-] 95466138 JTWWXLYLEDZJLU-CYBMUJFWSA-N 414.388 2.877 5 40 HFBB CC(C)(C)OC(=O)N1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 11375680 PNHXOSIUADFUBU-UHFFFAOYSA-N 418.494 2.891 5 40 HFBB Cc1cnc(NC(=O)[C@@H]2CSCN2C(=O)/C=C/c2cccc([N+](=O)[O-])c2)s1 69453679 CWRSXAUGGPOSBY-GJBLVYBDSA-N 404.473 2.913 5 40 HFBB COC(=O)c1cc(C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc([N+](=O)[O-])c1 3219551 PGAYLTJYDJOOIH-UHFFFAOYSA-N 422.777 2.839 5 40 HFBB O=C(NCCSc1nc(-c2ccccc2)c[nH]1)C(=O)Nc1ccccc1[N+](=O)[O-] 4315947 DHNGATMHQOTILQ-UHFFFAOYSA-N 411.443 2.832 5 40 HFBB COc1ccc(NC(=O)[C@@H](C)N2CCN(Cc3csc(C)n3)CC2)c([N+](=O)[O-])c1 12883677 YUDVXRRZCPDVFD-CYBMUJFWSA-N 419.507 2.513 5 40 HFBB O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1nc(-c2ccsc2)no1 32831851 NGKJUOJKPCXZEL-UHFFFAOYSA-N 421.398 2.650 5 40 HFBB Cn1/c(=N/C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)sc2cc(S(C)(=O)=O)ccc21 100859775 WASXAHBJSHGXPM-QNAKUDHHSA-N 417.468 2.692 5 40 HFBB CC[C@H](C(=O)NCCCc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222527070 BYZSIPOEMPXNKK-LJQANCHMSA-N 419.503 2.888 5 40 HFBB COc1ccc(N(CC(=O)O)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1Cl 225083373 LNBVVSCYFHXFPM-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB O=C1[C@@H]2Cc3c([nH]c4ccccc34)[C@H](c3ccc([N+](=O)[O-])cc3)N2C(=O)CN1C1CC1 1896932 BVZBHTXRLVLMED-UGKGYDQZSA-N 416.437 2.923 5 40 HFBB biogenic Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1 14022794 OMVYKLHHRXCEMH-OAHLLOKOSA-N 403.460 2.943 5 40 HFBB Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 40122016 YAYGAYDQKGZZNP-UHFFFAOYSA-N 422.363 2.915 5 40 HFBB Cc1nnc(N2C(=O)c3ccc(C(=O)OCc4ccccc4[N+](=O)[O-])cc3C2=O)s1 408685891 MEWPDSBPXKNKDO-UHFFFAOYSA-N 424.394 2.912 5 40 HFBB CCOCCn1ccc2c(OCC(=O)Nc3cccc([N+](=O)[O-])c3)cccc2c1=O 4584370 NJJMFYMUTLIVNB-UHFFFAOYSA-N 411.414 2.964 5 40 HFBB O=C(N[C@H]1CCCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 18069187 WZNGSCLDBFLJEE-HDICACEKSA-N 412.402 2.974 5 40 HFBB O=C(C1=NO[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12)c1cccc2ccccc12 100355328 PRJIOQNROJDCJD-PXNSSMCTSA-N 415.361 2.875 5 40 HFBB Cc1c(N(CC(=O)N[C@H](C)c2ccc(F)cc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220036078 KXJCRZRVTAFTSK-CYBMUJFWSA-N 409.439 2.686 5 40 HFBB COCCn1c(-c2ccc(OC)cc2)nc2oc3cc(OC)ccc3c(=O)c2c1=O 2204641 DFNJPHGOUOMMLP-UHFFFAOYSA-N 408.410 2.834 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1Nc1ccc2c(c1)CCC2 6045362 MEEGZQXEQZYKGL-UHFFFAOYSA-N 403.460 2.848 5 40 HFBB COc1cccc(NC(=O)[C@H](C)OC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 6587763 DBWVXTTWCCAROX-NSHDSACASA-N 402.359 2.559 5 40 HFBB CNS(=O)(=O)c1ccc(N[C@@H](c2ccc(F)cc2)c2nccn2C)c([N+](=O)[O-])c1 12559681 FJNXMQLXDWKCJJ-KRWDZBQOSA-N 419.438 2.577 5 40 HFBB CCOC(=O)c1c(NC(=O)CCCn2cnc([N+](=O)[O-])n2)sc2c1CC[C@@H](C)C2 12845974 XAGLPXBDARMYCT-LLVKDONJSA-N 421.479 2.968 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)N(C)Cc1ccccc1)S(C)(=O)=O 220377995 AXBFHGKROXLBLG-HNNXBMFYSA-N 405.476 2.716 5 40 HFBB O=C(Nc1ccc(N2CCN(C(=O)C(F)(F)F)CC2)cc1)c1ccc([N+](=O)[O-])o1 7496730 HUUSEHOPVDOANV-UHFFFAOYSA-N 412.324 2.651 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccccc1N1CCOCC1 12738535 PIHQYUUIESHXGI-UHFFFAOYSA-N 405.476 2.561 5 40 HFBB O=c1/c(=C/c2cc([N+](=O)[O-])cc(Br)c2O)sc2nc3ccccc3n12 139588131 CPDAQESOERRXQH-MLPAPPSSSA-N 418.228 2.833 5 40 HFBB O=C(Oc1cccc(C(=S)N2CCOCC2)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 8989850 MHPRNEDHNPDLCS-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@H](c2cccc(F)c2)n2nnnc2N3)cc1 10296251 MADLLPATANQMHU-INIZCTEOSA-N 406.337 2.578 5 40 HFBB Cc1ccc(OCCNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)c(C)c1 12764219 UARCRPOITTUOIZ-UHFFFAOYSA-N 422.441 2.875 5 40 HFBB COC(=O)c1ccc(OCC(=O)Nc2ccccc2C(=O)NC(C)C)c([N+](=O)[O-])c1 29739864 KHBMKELSDZQVJE-UHFFFAOYSA-N 415.402 2.537 5 40 HFBB CCS(=O)(=O)[C@](Cl)(I)C(=O)c1ccc([N+](=O)[O-])cc1 96518270 LBANISGBDKDKSI-SNVBAGLBSA-N 417.608 2.540 5 40 HFBB Cc1csc(Sc2ccc(C(=O)N3CCC(C(N)=O)CC3)cc2[N+](=O)[O-])n1 6543014 IDMXLIBKQBNQDZ-UHFFFAOYSA-N 406.489 2.848 5 40 HFBB CCOc1cc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1OC 23181862 VZCOZVGQCRJLJL-ZIAGYGMSSA-N 409.483 2.620 5 40 HFBB Cc1cc(C)cc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 408671370 XYKXSVAHDACZDU-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCOc1ccccc1N1C[C@H](C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)CC1=O 7881535 PNOKMMPRVPYLKH-OAHLLOKOSA-N 412.398 2.773 5 40 HFBB CC(=O)c1cccc(NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220411287 LFQUTOMGUFNGMH-GFCCVEGCSA-N 405.432 2.591 5 40 HFBB COc1ccc(OC)c([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])c1 408564925 GLHWNMJRVGJKMP-ZJDLJICXSA-N 409.442 2.758 5 40 HFBB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@@H](c1ccc([N+](=O)[O-])cc1)N=2 408731489 LBKSXMSUSCWRSY-IJZIWBRISA-N 415.471 2.567 5 40 HFBB O=C(O)CCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1Cl 2983006 RCNLZZWASPKDTJ-LFIBNONCSA-N 417.805 2.610 5 40 HFBB CNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(NC(C)=O)cc2)cc1[N+](=O)[O-] 4508907 RHUPGJOBACBCRK-NSHDSACASA-N 400.391 2.779 5 40 HFBB CCN1CCN(c2ccc(C(=O)OC)cc2NC(=O)c2cccc([N+](=O)[O-])c2)CC1 4711714 HMOSLQLBFCWWOX-UHFFFAOYSA-N 412.446 2.776 5 40 HFBB COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c1 8861492 IPXFCBRKBUQBLK-UHFFFAOYSA-N 417.330 2.637 5 40 HFBB Cc1nn(Cc2ccc(C(=O)Oc3ccc(-n4cnnn4)cc3)cc2)c(C)c1[N+](=O)[O-] 20008457 XMIGGXCHOQDOAR-UHFFFAOYSA-N 419.401 2.651 5 40 HFBB O=C1[C@H]2[C@@H](c3ccccc3)N3CCCN3[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 102694537 VSDIHQASPCYNQC-RCCFBDPRSA-N 412.833 2.784 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)NCCCc1ccccc1)S(C)(=O)=O 220393345 PKSNQRGCCDOVBZ-INIZCTEOSA-N 419.503 2.807 5 40 HFBB COC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(OC)c(C)c1 224653012 QHOKVGAOJKROGA-UHFFFAOYSA-N 408.432 2.589 5 40 HFBB O=C(Nc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 408710507 XRVDIWPPAUPTHF-UHFFFAOYSA-N 400.263 2.714 5 40 HFBB Cc1c(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C 3885254 SQOCEQAEAFBPDI-UHFFFAOYSA-N 422.850 2.847 5 40 HFBB O=C(NCc1ccccn1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 8289939 LQVAUQVVJZSHCB-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1C 8433800 CLVRQXFSSIPTSW-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OC[C@@H]2CCCO2)[C@H]1c1cccc([N+](=O)[O-])c1 629105 FVDUPZNDOAARRO-LPHOPBHVSA-N 416.430 2.725 5 40 HFBB CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)N2CCCCCC2)CC1 6987471 GAAFXAMQGBKETP-UHFFFAOYSA-N 402.495 2.916 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1ccc(Cl)cc1 408670543 RBQZFHUNVIWCDB-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB COCCCn1c2nc3ccccc3nc2c2c(=O)n(C[C@@H]3CCCO3)c(C)nc21 2249824 NGRXCAJWAWSPDQ-HNNXBMFYSA-N 407.474 2.818 5 40 HFBB COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)CNc1ccc([N+](=O)[O-])cc1 8386376 VNCQBXVISIGWED-LBPRGKRZSA-N 417.422 2.808 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnnn1-c1ccc(Cl)cc1 28384223 OSYGTTMJUAUEDH-UHFFFAOYSA-N 420.838 2.963 5 40 HFBB O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OCC(=O)c1c[nH]c2ccccc12 9284291 UBNKQHJOLWHHAM-UHFFFAOYSA-N 415.789 2.885 5 40 HFBB COc1ccc(Cl)cc1N(CC(=O)O)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225080906 ONTFQNQMHWSNIC-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB COc1ccc(OCC(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 3530320 JINDGUNHUXKTSE-GFCCVEGCSA-N 404.375 2.561 5 40 HFBB Cc1c(C(=O)C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c2ccccc2n1C 4232391 BITYLCOWFSQGLB-UHFFFAOYSA-N 406.442 2.926 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)Nc1ccc(Cl)cc1F 5851033 XXBLIPGUPIVBKF-UHFFFAOYSA-N 411.773 2.587 5 40 HFBB COc1cc(NC(=O)CSc2nnc(C(F)(F)F)n2C)c(C)cc1[N+](=O)[O-] 5977545 YJBVRDCGUOMIMJ-UHFFFAOYSA-N 405.358 2.790 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] 8036855 RLXJMUCHCCDGTC-CYBMUJFWSA-N 415.377 2.577 5 40 HFBB CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 16691893 AYLMMZVPJNZFPA-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB Cc1occc1C(=O)N1CCC(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 40153765 VQSJYYKSUCBLQH-UHFFFAOYSA-N 407.448 2.616 5 40 HFBB CS(=O)(=O)N1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 48367924 CMFJIZRRCVOLDU-CQSZACIVSA-N 419.459 2.541 5 40 HFBB Cc1cn(C[C@@H](O)COCc2ccccc2F)c(=O)n1-c1cccc([N+](=O)[O-])c1 58130033 VTDKMOZFKROUMZ-GOSISDBHSA-N 401.394 2.572 5 40 HFBB CC1=C(NC(=O)CSc2[nH]nc(C)c2[N+](=O)[O-])[C@@H](C)NN1Cc1ccccc1C 20418466 FZEILRPCUILUFX-GFCCVEGCSA-N 416.507 2.783 5 40 HFBB COc1ccc(CNC(=O)[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)n2ccccc2=O)cc1 199423214 GEWLYCSSQATBIS-HXUWFJFHSA-N 421.409 2.506 5 40 HFBB Cc1c(NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cccc1[N+](=O)[O-] 220030504 GBTIHDKQSUUHMP-UHFFFAOYSA-N 422.419 2.525 5 40 HFBB CC(C)CN1c2ccc([N+](=O)[O-])cc2CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]1C(C)C 5426740 UBBXOUXRXMMPQF-QGZVFWFLSA-N 416.478 2.675 5 40 HFBB NC1=NC(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)=N[C@@H](c2c[nH]c3ccccc23)N1 13579219 CFPCJXBTYKAATJ-KRWDZBQOSA-N 423.458 2.721 5 40 HFBB COc1cccc(NC(=O)Cn2c(=O)c(N3CCCC3)nc3ccc([N+](=O)[O-])cc32)c1 32855930 QMUWNRAHQFYBTO-UHFFFAOYSA-N 423.429 2.552 5 40 HFBB COc1cc(C(=O)OCc2cc(=O)oc3cc(O)ccc23)c([N+](=O)[O-])cc1OC 5246031 RKMHLYFEOXLFFD-UHFFFAOYSA-N 401.327 2.781 5 40 HFBB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 8644141 GWTLALCARCENAF-IBGZPJMESA-N 400.366 2.530 5 40 HFBB COc1ccc(CN(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(OC)c1OC 13056781 XOQAWZHFOPUWBU-UHFFFAOYSA-N 403.435 3.000 5 40 HFBB CS(=O)(=O)c1ccc(N2CCN(CCSc3ccccc3)CC2)c([N+](=O)[O-])c1 32937615 DHTKYMGWIBSSRV-UHFFFAOYSA-N 421.544 2.913 5 40 HFBB COc1ccccc1N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)S(C)(=O)=O 218311219 LENSZWIOVMBKNG-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1cccc(F)c1 218322655 FWIOEAYJCAXWBX-UHFFFAOYSA-N 401.803 2.792 5 40 HFBB CC[C@H](C)OC(=O)CN1C(=O)S/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)C1=O 409363003 IEGBYUIQTKZLHG-HXNQLNRQSA-N 408.388 2.702 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](Cc1ccc(Cl)cc1)C(=O)O 548528316 ANLNFSGOWBRPKN-CYBMUJFWSA-N 412.851 2.778 5 40 HFBB CCN(Cc1nc(-c2ccc(OC)cc2)no1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 9667391 VWCPAVJHCVOQHG-UHFFFAOYSA-N 418.431 2.864 5 40 HFBB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] 15409529 WFGUFXSCVAXKNY-INIZCTEOSA-N 419.459 2.613 5 40 HFBB Nc1nc(N2CCN(Cc3ccccc3)CC2)nc(NCc2ccccc2)c1[N+](=O)[O-] 20441366 HNTRQZZBIZSRRP-UHFFFAOYSA-N 419.489 2.901 5 40 HFBB Cn1cccc1C(=O)NCCNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 32829509 SSMCZNIIYQWFHE-UHFFFAOYSA-N 401.301 2.702 5 40 HFBB COc1cc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc(OC)c1OC(C)=O 726902 UEZPRNWXKZQPOG-CHHVJCJISA-N 412.354 2.882 5 40 HFBB CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O 3254992 DICOLFICVQMELX-JOCHJYFZSA-N 424.457 2.799 5 40 HFBB Cc1cc(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c(C)n1C[C@H]1CCCO1 3602189 DOQUKEPMZSVZHC-OAHLLOKOSA-N 411.414 2.671 5 40 HFBB O=C(COC(=O)c1cccc(NC(=O)C(F)(F)F)c1)Nc1cccc([N+](=O)[O-])c1 8412331 VVUYMNODACQWPH-UHFFFAOYSA-N 411.292 2.891 5 40 HFBB Cc1c(O[C@@H](C)C(=O)NCCCN2CCOCC2)ccc2c1oc(=O)c1ccccc12 20547635 FOVGOPFABUOGJL-KRWDZBQOSA-N 424.497 2.860 5 40 HFBB C[C@@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10412020 RYWQUIGZYVYWBO-QLJPJBMISA-N 418.789 2.900 5 40 HFBB CC[C@@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(OC)cc1 22348304 CSNGUMDSCXWUTL-GOSISDBHSA-N 421.475 2.637 5 40 HFBB CCCn1/c(=N\C(=O)c2ccco2)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 101176402 SOPJQJLWSNJZCY-CLCOLTQESA-N 420.425 2.570 5 40 HFBB Cc1cc(C)nc(N/C=C(/[N+](=O)[O-])S(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1 107624771 IDWCMTZTIUMHPE-JYRVWZFOSA-N 418.353 2.953 5 40 HFBB CCOC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225010691 QFECFPWCFWIGRF-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB Cc1c(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 3326002 VLIUYJKCJPXVQM-UHFFFAOYSA-N 400.366 2.549 5 40 HFBB O=C(C[C@]1(O)C(=O)N(CN2CCCCC2)c2ccccc21)c1cccc([N+](=O)[O-])c1 4784442 SUBZYTKBROJBEU-JOCHJYFZSA-N 409.442 2.845 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2ccccc2N2CCOCC2)cc1[N+](=O)[O-] 32115154 GLJDUVBLEGMATO-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccc(F)cc1 36446972 XYGBJTSAQCCUKY-CQSZACIVSA-N 422.482 2.843 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)OCC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 6479845 YBOSCXGXVRNSRI-UHFFFAOYSA-N 405.428 2.802 5 40 HFBB C[C@@H]1CCc2c(sc3ncn(C[C@H](O)COc4cccc([N+](=O)[O-])c4)c(=O)c23)C1 24834127 QBMNIJQMUARYLB-OCCSQVGLSA-N 415.471 2.931 5 40 HFBB Cn1cc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2-c2cccs2)c([N+](=O)[O-])n1 84314134 BYCYOLLEMAHTBN-UHFFFAOYSA-N 410.389 2.733 5 40 HFBB Cc1nn(CC(=O)Nc2ccc(I)cc2)c(C)c1[N+](=O)[O-] 5637550 AATFWHRXQKCDBD-UHFFFAOYSA-N 400.176 2.651 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1 8246072 ULOQKVAEWGDGLR-AWEZNQCLSA-N 401.394 2.772 5 40 HFBB CCC(=O)N1CCN(c2ccc(NC(=O)COc3ccc([N+](=O)[O-])cc3)cc2)CC1 9427038 PITCTJSVBRCNDF-UHFFFAOYSA-N 412.446 2.671 5 40 HFBB CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 33000647 BDRCEHZMOSJCMJ-BJMVGYQFSA-N 411.414 2.866 5 40 HFBB Cc1cc(S(=O)(=O)Nc2n[nH]cc2-c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] 79108604 KWNGDLMGITVAEF-UHFFFAOYSA-N 402.388 2.823 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3C)C(=O)[C@@H]2[C@@H]2C=Cc3ccccc3N21 103913534 DXVZRCABYVDXEY-DOIPELPJSA-N 417.421 2.882 5 40 HFBB COc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220035746 ANIYNKFSZCEKNA-AWEZNQCLSA-N 421.475 2.555 5 40 HFBB CC(C)OP(=O)(OC(C)C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O 1828091 ZSUUSHAIDMEULO-HNNXBMFYSA-N 421.774 2.833 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)NCCC1=CCCCC1 7985496 FAUACDLBBAOIIJ-UHFFFAOYSA-N 417.462 2.595 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 102415278 JRPSUKYENLATSN-OYUDYFSCSA-N 419.393 2.864 5 40 HFBB O=C(NCCc1ccccc1)[C@@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 199411344 RSHMEGKYBQMPDL-HXUWFJFHSA-N 405.410 2.539 5 40 HFBB O=C(O)CCCCCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1 4844186 GCVUFYXILCKPQJ-DTQAZKPQSA-N 415.402 2.720 5 40 HFBB Cc1ccccc1N1C[C@@H](C(=O)OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1=O 8039626 KTRYFXGBUPYEFM-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1C 8433801 CLVRQXFSSIPTSW-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1cccc(NC(=O)COc2ccc(/C=C/c3nc(O)c([N+](=O)[O-])c(=O)[nH]3)cc2)c1 9295550 UFHAGHZYSFTKAQ-JXMROGBWSA-N 422.397 2.880 5 40 HFBB Cc1ccc(-c2nc3n(n2)[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(=O)N3)cc1 20744451 UYOXWXGWNAXPOC-INIZCTEOSA-N 406.402 2.992 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3ccccc3OC)CC2)c([N+](=O)[O-])c1 408573867 PHCFEDHIHOCBRW-UHFFFAOYSA-N 413.430 2.743 5 40 HFBB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 6237503 OIZZHBMTFVLMTA-UHFFFAOYSA-N 413.839 2.759 5 40 HFBB COCCNC(=O)c1ccccc1NC(=O)CSCc1ccc([N+](=O)[O-])cc1 6441124 OEHPJWRMOVXEBU-UHFFFAOYSA-N 403.460 2.843 5 40 HFBB COc1ccc(/C=C/C(=O)OCC(=O)Nc2ccc(F)cc2[N+](=O)[O-])cc1OC 6582672 GZJNCSRGNHHWDJ-XBXARRHUSA-N 404.350 2.946 5 40 HFBB CCOc1ccc(Oc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])cc1 6617391 YVNGXEOKQMELGK-UHFFFAOYSA-N 408.432 2.807 5 40 HFBB O=C(NC(=S)Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 19859196 VWBJHPWFMTUEJJ-UHFFFAOYSA-N 400.460 2.554 5 40 HFBB CCCS(=O)(=O)N1CCC[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 40134234 AFYTXPLJPRNZLS-NSHDSACASA-N 421.422 2.587 5 40 HFBB O=[N+]([O-])c1cccc(-n2cccc2[C@@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c1 223589208 QCYSYABARBKDJB-RBUKOAKNSA-N 409.471 2.745 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3Cl)C2=O)c([N+](=O)[O-])c1 8885272 FUSCLHWOCXOBFS-IBGZPJMESA-N 416.821 2.962 5 40 HFBB CC(=O)Nc1cccc(-n2c(C)nnc2Sc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 12539560 KRTTWSOXFXMNSD-UHFFFAOYSA-N 412.431 2.692 5 40 HFBB CC(C)OC(=O)c1cc([N+](=O)[O-])c(Sc2ncnc3[nH]cnc23)c([N+](=O)[O-])c1 17059229 PBLBPDWSYSXUAQ-UHFFFAOYSA-N 404.364 2.886 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)O)S(=O)(=O)c1ccc(Cl)cc1 20061351 XRIJRQBSBAYSBN-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB Cc1nc2sccc2c(=O)n1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 57635506 XAOLHAAUTXSBGK-UHFFFAOYSA-N 409.221 2.821 5 40 HFBB Cn1ccnc1C(=O)c1ccc(N2CC[C@H](OCc3ccccn3)C2)c([N+](=O)[O-])c1 84321897 MUEKLXGCIWAYPA-KRWDZBQOSA-N 407.430 2.750 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)NCc2cccnc2)cc1 897893 QARLWIPZKUPOPJ-UHFFFAOYSA-N 406.398 2.937 5 40 HFBB COC(=O)N[C@@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl 3168256 HZTBLEIGWZGJJA-MRVPVSSYSA-N 401.659 2.934 5 40 HFBB Cc1ccc(OCCNC(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 7961827 PPCGOKGDOUZLJQ-UHFFFAOYSA-N 408.414 2.566 5 40 HFBB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 8480821 VPUQAKOQTGYTQV-IBGZPJMESA-N 400.366 2.530 5 40 HFBB Cc1ccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c(O)c1 17090588 GGQRIBUFOPIFOC-UHFFFAOYSA-N 416.459 2.572 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)OC(=O)c1cccc(OC)c1OC 7181694 YDJMKMNPQFRSOK-NSHDSACASA-N 404.375 2.805 5 40 HFBB Cc1ccc(NC(=O)COC(=O)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(C)c1 12618722 LHDPFFBIJANULU-UHFFFAOYSA-N 419.821 2.777 5 40 HFBB C[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 5109252 ZCOYTFAOAQUNRE-AWEZNQCLSA-N 419.459 2.785 5 40 HFBB CCOc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)cc1 7737573 KNJCHIGWVDWHSA-UHFFFAOYSA-N 407.448 2.758 5 40 HFBB COc1cccc([C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c2nccn2C)c1 12551338 NQMHMDYXZVSRMB-SFHVURJKSA-N 416.459 2.942 5 40 HFBB O=[N+]([O-])c1ccc(-c2noc(CN3CCN(CCOc4ccccc4)CC3)n2)cc1 47406652 NRHYDDMBPLDILJ-UHFFFAOYSA-N 409.446 2.841 5 40 HFBB CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 72289311 NNHJJRZLYXDTND-RHSMWYFYSA-N 418.473 2.609 5 40 HFBB CCNC(=O)[C@H](C)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 8349062 TZTZBFJVTQVPRH-HNNXBMFYSA-N 421.457 2.631 5 40 HFBB CC[C@@H](C)N1C(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCC[C@@H]32)C(=O)NC1=S 8742859 LKTGDKWMAZNANQ-RRBXVBTKSA-N 416.503 2.538 5 40 HFBB C[C@@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10415442 ZWAXXKSIAGVNNU-QLJPJBMISA-N 418.789 2.900 5 40 HFBB COC(=O)c1cc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1OC 12526800 UDIKYKIDLPPERQ-UHFFFAOYSA-N 413.430 2.920 5 40 HFBB CCCCOCCNC(=O)c1cc(C(=O)NCCOCCCC)cc([N+](=O)[O-])c1 59520293 DXDXRZYVWTZOAM-UHFFFAOYSA-N 409.483 2.688 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)N[C@@H](C)c1ccccc1)S(C)(=O)=O 220377904 KYRQYBQWYLORNL-LSDHHAIUSA-N 405.476 2.935 5 40 HFBB COc1ccc(S(=O)(=O)N(C)C)cc1CCC(=O)Nc1cccc([N+](=O)[O-])c1C 225042514 GQYOKUDVBIRLHW-UHFFFAOYSA-N 421.475 2.733 5 40 HFBB CSCC[C@H](NC(=O)COc1ccc2c(oc(=O)c3ccccc32)c1C)C(=O)O 2118305 WMFMKGCLHZWUHW-INIZCTEOSA-N 415.467 2.956 5 40 HFBB biogenic Cn1nc(-c2ccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)ccc1=O 10324906 WKGLBBCZRPWSOQ-UHFFFAOYSA-N 420.834 2.810 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1nnc(-c2ccc3c(c2)OCO3)s1 12474954 MRWVHAXRPLFMAX-UHFFFAOYSA-N 400.372 2.860 5 40 HFBB Cc1c(Nc2cc(N(C)C)c3nonc3c2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 13143410 JDPWYVKIRNVAMT-UHFFFAOYSA-N 409.406 2.738 5 40 HFBB O=C(CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1)Nc1cccnc1 20239110 KVRQLXGDHLECRR-UHFFFAOYSA-N 412.427 2.824 5 40 HFBB Cn1nnnc1Sc1ccc(C(=O)NC2C3CC4CC(C3)CC2C4)cc1[N+](=O)[O-] 32721505 LHNJPSUSOBESJG-UHFFFAOYSA-N 414.491 2.824 5 40 HFBB CC(C)OC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 101176165 LTAJSQLTORSAHL-DCXXXQMHSA-N 421.446 2.538 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1F 218262314 VQQKUNOQLYLSED-UHFFFAOYSA-N 401.803 2.792 5 40 HFBB Cc1ccc(NC(=O)c2ccn(Cn3cc([N+](=O)[O-])cn3)n2)c(Br)c1 2797060 YBRSKUIIJDWVIA-UHFFFAOYSA-N 405.212 2.817 5 40 HFBB O=C(NN1C(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2C1=O)c1cccnc1 3150563 NWLMRIDHXFGFIA-UHFFFAOYSA-N 404.338 2.723 5 40 HFBB COC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(CN2C(=O)c3ccccc3C2=O)CC1 40149366 BWHSASIUQKFXND-UHFFFAOYSA-N 423.425 2.894 5 40 HFBB Cc1cn(C[C@H](O)COCc2ccccc2F)c(=O)n1-c1cccc([N+](=O)[O-])c1 58130028 VTDKMOZFKROUMZ-SFHVURJKSA-N 401.394 2.572 5 40 HFBB Cc1ccc(S(=O)(=O)NNc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc23)cc1 12955001 MEPOJOOVOZXYQZ-UHFFFAOYSA-N 403.376 2.665 5 40 HFBB O=C(Cn1nnc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1Br 4973958 CETCCNLFPPISDQ-UHFFFAOYSA-N 403.196 2.650 5 40 HFBB Cc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@H]32)cc1C 8843966 TUSCQTTUPRKLSL-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB O=C(CSC1=NS(=O)(=O)c2cc(F)ccc2N1)Nc1ccc([N+](=O)[O-])cc1 9762005 FUOOMQFQPRCOQX-UHFFFAOYSA-N 410.408 2.576 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)NCc3ccc(F)c(C)c3)cc2[N+](=O)[O-])CC1 10551963 XKGGSFQESQVJOE-UHFFFAOYSA-N 414.437 2.641 5 40 HFBB Cn1ccc(P(=Nc2ccc([N+](=O)[O-])cc2)(N2CCOCC2)N2CCOCC2)c1 5577997 FWWAQWMVIDMSDI-UHFFFAOYSA-N 419.422 2.586 5 40 HFBB CCOC(=O)c1[nH]c(COC(=O)Cc2ccccc2[N+](=O)[O-])c(C(=O)OCC)c1C 8075503 VPPVNFZCUHTHNX-UHFFFAOYSA-N 418.402 2.871 5 40 HFBB CC(C)n1cc2c(c1-c1cc([N+](=O)[O-])ccc1Br)c(=O)n(C)c(=O)n2C 9138095 NECQZMIRCLOPSU-UHFFFAOYSA-N 421.251 2.957 5 40 HFBB O=C(Nc1cccc(N2CCCCC2=O)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 58166732 GWFMISOFQIGUOK-UHFFFAOYSA-N 424.461 2.861 5 40 HFBB Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 4507728 NVUSYENKFJUKEF-HNNXBMFYSA-N 413.430 2.924 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC(=S)Nc1ccc(N2CCOCC2)cc1 4688537 BBWGDDCTFUEAMA-RUDMXATFSA-N 412.471 2.958 5 40 HFBB COc1ccc([C@@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1 11337074 DDDAWIAWOGBMHT-SFHVURJKSA-N 413.430 2.706 5 40 HFBB CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 72289310 NNHJJRZLYXDTND-PBHICJAKSA-N 418.473 2.609 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(CC(C)C)/c1=N\C(=O)CC(C)C 103628340 KPYHUTVYJPGRRA-DAFNUICNSA-N 424.501 2.955 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224756499 NCGRIHLFWXNQEN-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB COCCN1C(=O)S/C(=C/c2cc([N+](=O)[O-])cc(Br)c2O)C1=O 409128317 FEGQUXVMCPMLTG-BJMVGYQFSA-N 403.210 2.746 5 40 HFBB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1 5523478 OFTFTNBLYYCTGU-GOSISDBHSA-N 412.402 2.879 5 40 HFBB Cn1c2ccccc2c(=O)c2c(=O)n(CCc3ccccc3)c(Cn3ccnc3)nc21 11691999 WAHXDIWMSSOQTM-UHFFFAOYSA-N 411.465 2.736 5 40 HFBB COc1cc(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c([N+](=O)[O-])cc1OC 12999776 HZIVNUPSBNXTLD-UHFFFAOYSA-N 423.447 2.551 5 40 HFBB CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccc(F)cc2)c1=N 101141751 HSHOCYRLUUYGDQ-UHFFFAOYSA-N 406.417 2.801 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 7363429 GUYCFMKXQKXKAA-UHFFFAOYSA-N 402.432 2.502 5 40 HFBB CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccc(OC)cc2)cc1OC 7996663 XHZFANIQMHKQAI-UHFFFAOYSA-N 404.375 2.806 5 40 HFBB Cc1cc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)ccc1[N+](=O)[O-] 8075052 UMTCDTWJPIEHBE-UHFFFAOYSA-N 417.443 2.738 5 40 HFBB CCN(CC(=O)Nc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OC)c(C)c1 19929793 PURBVFGVSHZBJF-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB C[C@H]1C[C@@H](C)CN(CCNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1 36397886 SOKHEIFVUHIISD-IYBDPMFKSA-N 410.540 2.769 5 40 HFBB COCCCn1c(=N)c(C(=O)NC2CCCCC2)cc2c(=O)n3cc(C)ccc3nc21 100628029 KBQVYLXDPVJFNM-UHFFFAOYSA-N 423.517 2.536 5 40 HFBB CCOc1ccc(N(CC(=O)OC)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 224770590 GOVXLSVHSRQYPG-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCCc1cnn(-c2ccccc2)c1 12980433 OMXREMLSWIQUAU-UHFFFAOYSA-N 406.851 2.955 5 40 HFBB O=C(COc1ccc(S(=O)(=O)NC2CCCC2)cc1)Nc1cccc([N+](=O)[O-])c1 16399921 DBSPDMVTJLUCCC-UHFFFAOYSA-N 419.459 2.833 5 40 HFBB CCOC(=O)c1ccccc1NC(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1 58143496 SWPNCHDENSUFET-UHFFFAOYSA-N 412.446 2.532 5 40 HFBB O=C(CN1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1)NCc1ccccc1 12751325 IXLPUFYBAAJCNL-UHFFFAOYSA-N 405.458 2.581 5 40 HFBB COC(=O)c1cccc2c3c([nH]c12)CCN(c1ncc([N+](=O)[O-])c(NC2CC2)n1)C3 25577698 SXDIZSBNZRPYLL-UHFFFAOYSA-N 408.418 2.790 5 40 HFBB COc1ccc(CN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(OC)c1OC 32718848 KJUKYCJZDWYNTI-UHFFFAOYSA-N 418.402 2.664 5 40 HFBB CCOc1ccc(C(=O)Oc2ccc(OCCN3CCOCC3)cc2)cc1[N+](=O)[O-] 40146333 ZHCRGUQDFILYIF-UHFFFAOYSA-N 416.430 2.924 5 40 HFBB C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 58171527 CAWVCNZEEVFYNT-CZUORRHYSA-N 406.483 2.961 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)OCC(=O)c2ccc(F)cc2)CC1=O 408642154 DPJKRLNLBRBWLN-CYBMUJFWSA-N 416.361 2.522 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 46346793 PMDDYVWTQKWPCG-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])n1N 9579855 TXRSLQNXMWMQIA-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB Nc1ccc(C(=O)OCC(=O)NCCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] 10531782 RIXYRLQQXVLXDW-UHFFFAOYSA-N 412.229 3.000 5 40 HFBB CCN(Cc1ccc(Cl)s1)C(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 18956369 VULGTQHMABIUOK-UHFFFAOYSA-N 407.835 2.954 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 32760487 YVGGAFCSBJINBI-ZDUSSCGKSA-N 412.489 2.688 5 40 HFBB O=C1N[C@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 1295763 KCHCKPCXEDFKQB-CPUCHLNUSA-N 409.320 2.699 5 40 HFBB O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc(Br)cn1 14195292 UYRWEALWUMJSSY-UHFFFAOYSA-N 420.267 2.513 5 40 HFBB COc1ccc(NC(=O)CNc2ccc(OC)c(N3CCOC3=O)c2)c([N+](=O)[O-])c1 78932081 JGJAKIVNKLTOQA-UHFFFAOYSA-N 416.390 2.619 5 40 HFBB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 8030606 KGNMZONLJHWONJ-GOSISDBHSA-N 412.471 2.747 5 40 HFBB COc1ccc([C@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1 11337076 DDDAWIAWOGBMHT-GOSISDBHSA-N 413.430 2.706 5 40 HFBB O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(Cn2nc(O)ccc2=O)c1 40152462 DPOSLMDYYUQGJK-UHFFFAOYSA-N 412.427 2.636 5 40 HFBB CC(=O)[C@@H]1[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N12 103631123 RCHZZIMMUJUXMH-YSTOQKLRSA-N 403.394 2.574 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220388072 ZICIXVVBFPVZJM-GFCCVEGCSA-N 422.419 2.605 5 40 HFBB Cc1cc(=O)oc2cc(OCC(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)ccc12 3248213 ZYHFBCSRBIENCG-UHFFFAOYSA-N 412.354 2.570 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3F)CC2=O)cc1 7007611 FEFGYTBPXSDOQF-CYBMUJFWSA-N 415.377 2.577 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cccc([N+](=O)[O-])c1 9667266 KIWFKUGDJPKNEV-QGZVFWFLSA-N 407.390 2.518 5 40 HFBB O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)s1)c1ccccc1[N+](=O)[O-] 9987430 MNYKIIULTWGUCC-UHFFFAOYSA-N 409.489 2.761 5 40 HFBB Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)cc1[N+](=O)[O-] 14870521 FYPOCTVIVJXFLI-CQSZACIVSA-N 419.459 2.613 5 40 HFBB CC[C@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3ccccc3[N+](=O)[O-])N2C1=O 2702875 OEMDJHNEOJSFJP-GDBMZVCRSA-N 419.459 2.823 5 40 HFBB O=C(COCCOc1ccccc1)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 57992366 ULRIVMSHGOPFTI-UHFFFAOYSA-N 419.865 2.992 5 40 HFBB COc1cccc(NC(=O)CN(C)CC(=O)Nc2cc(C)c(C)cc2[N+](=O)[O-])c1 8066032 VDGJZBUMDWLQPG-UHFFFAOYSA-N 400.435 2.729 5 40 HFBB CC(=O)n1nc(-c2ccncc2)nc1SCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 12483823 SWTXQKJOQFNBED-UHFFFAOYSA-N 412.431 2.948 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]2C)cc1 13632964 PNTBTKZCYNOBSJ-CQSZACIVSA-N 420.447 2.711 5 40 HFBB Cc1sc(C(=O)Nc2cc(C3CC3)nn2[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-] 78870188 BARDQELHIBRYBP-NSHDSACASA-N 410.477 2.651 5 40 HFBB C[C@@H](OC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)C(=O)Nc1ccccc1[N+](=O)[O-] 8760524 JLKPTUHKOONACC-ZBFHGGJFSA-N 411.414 2.514 5 40 HFBB COCc1n[nH]c(-n2ccc3nc4ccn([C@@H]5CCCC[C@H]5C)c(=O)c4cc3c2=O)n1 40398994 FMCXJQKQHDBTOP-FZKQIMNGSA-N 420.473 2.716 5 40 HFBB CCOc1cc(C(=O)N2CCC[C@@H](C(=O)N3CCCCC3)C2)c([N+](=O)[O-])cc1OC 50655730 JWEDUHRJISOGFA-OAHLLOKOSA-N 419.478 2.867 5 40 HFBB CN(Cc1ccccc1)C(=O)CCCN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222683366 WGCSNFYZJUBLJQ-UHFFFAOYSA-N 405.476 2.800 5 40 HFBB Cc1ccc(S(=O)(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1[N+](=O)[O-] 223697383 XHGAKAXSJRKVLI-UHFFFAOYSA-N 403.460 2.504 5 40 HFBB O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCOCC2)c(Cl)c1 408599929 OVSHWPWJTDZARC-UHFFFAOYSA-N 419.821 2.880 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN=C2SCc2cccc([N+](=O)[O-])c2)cc1 2711843 VIEDCSHWNPGKAK-UHFFFAOYSA-N 422.444 2.797 5 40 HFBB COCCCN1C(=O)[C@H](CC(=O)Nc2ccccc2[N+](=O)[O-])n2c1nc1ccccc12 23411190 XACIHMIOOMUQQL-SFHVURJKSA-N 423.429 2.898 5 40 HFBB CC1=C(C(N)=O)[C@@H](c2ccc([N+](=O)[O-])cc2)N2NC(SCc3ccccc3)=NC2=N1 4176687 AMKAFAVFUWAOLI-QGZVFWFLSA-N 422.470 2.874 5 40 HFBB CCCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 6778453 CDZHZQRAKLOQKM-UHFFFAOYSA-N 421.475 2.999 5 40 HFBB CCN(CC(=O)Nc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(C)ccc1OC 39985523 JXBRKVSJMXNGNL-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB CC(C)NC(=O)CN1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 40120738 DRMLSKUONQEJRH-UHFFFAOYSA-N 402.520 2.966 5 40 HFBB COc1ccc(S[C@@H](C)C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 48340920 QGQHCKAJQZZGBH-AWEZNQCLSA-N 402.476 2.828 5 40 HFBB COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1 95116758 BFEASCNGRQZANS-QGZVFWFLSA-N 401.375 2.672 5 40 HFBB O=C(O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225023988 DRDNNRSQEIMLNB-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB COc1c2c(cc3c1[C@H](c1nnnn1-c1c(C)cccc1C)[N+](C)(C)CC3)OCO2 4028910 VJJNOKPDUVUYNE-LJQANCHMSA-N 408.482 2.738 5 40 HFBB biogenic Cc1nn(CC(=O)N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c(C)c1[N+](=O)[O-] 8517442 JIAFPTMSMHVYTH-UHFFFAOYSA-N 414.249 2.812 5 40 HFBB COc1ccccc1NC(=O)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1 8987835 GPNQBCJMOOOWLA-UHFFFAOYSA-N 422.397 2.656 5 40 HFBB CCOc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 12521560 UOTPJUHVENRIFZ-UHFFFAOYSA-N 414.414 2.870 5 40 HFBB O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)OCc1ccc([N+](=O)[O-])cc1 16401649 GGXHAMBRZBRLSG-UHFFFAOYSA-N 419.242 2.923 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(Nc3cccc(Cl)c3)c([N+](=O)[O-])c2)CC1 35708970 CWFZAMJQCORPTE-UHFFFAOYSA-N 410.883 2.928 5 40 HFBB COc1ccc(N2C[C@@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)c(OC)c1 5535448 JSNVDBVJMVHOQL-AWEZNQCLSA-N 400.387 2.708 5 40 HFBB CCOc1ccccc1N1C[C@@H](C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)CC1=O 7881536 PNOKMMPRVPYLKH-HNNXBMFYSA-N 412.398 2.773 5 40 HFBB CC(=O)c1ccc(NC(=O)CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8416802 CUBLUFZADOACAW-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB COC(=O)Cn1/c(=N/C(=O)c2ccc([N+](=O)[O-])cc2)sc2cc(OC)ccc21 16960203 SVGIUKBKNOATOE-HNENSFHCSA-N 401.400 2.534 5 40 HFBB CC(C)Oc1cccc(NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 408610496 RKOPTERNPOGMJO-UHFFFAOYSA-N 407.448 2.787 5 40 HFBB CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(OC)c(C)c1 19929896 YXYPFFVUMDZRSP-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB Cc1ccc([C@H](C)NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 20106229 DIGUKCQFLKOAMK-HNNXBMFYSA-N 405.476 2.855 5 40 HFBB CN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C(=O)NCC(F)(F)F)cc1 27296263 UECKTYAQOHAAAF-UHFFFAOYSA-N 424.379 2.957 5 40 HFBB O=C1[C@H]2C(c3cccc([N+](=O)[O-])c3)=NO[C@H]2C(=O)N1c1cccc(Br)c1 101104249 FIEBQJVMPZGUTK-DZGCQCFKSA-N 416.187 2.650 5 40 HFBB CC1=C(C(N)=O)[C@@H](c2ccccc2[N+](=O)[O-])N2NC(SCc3ccccc3)=NC2=N1 8763311 IMIXPSPRJLYPBV-QGZVFWFLSA-N 422.470 2.874 5 40 HFBB COc1ccc(C(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)cc1[N+](=O)[O-] 12783321 CCFAAYZFRVMMDS-RYUDHWBXSA-N 406.464 2.921 5 40 HFBB Cc1cc(NC(=O)CN2CCN(C(=O)c3cccs3)CC2)c([N+](=O)[O-])cc1C 12924191 CTQYTNIWJDRKPC-UHFFFAOYSA-N 402.476 2.670 5 40 HFBB O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 13151973 SBRXPLBCEZMBKQ-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB COC(=O)c1cc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc([N+](=O)[O-])c1 25330223 ZTPZKVAIVODGCF-VMPITWQZSA-N 409.442 2.853 5 40 HFBB Cc1ccc(C(=O)OCCN2CCOCC2)c([N+](=O)[O-])c1OCc1ccccc1 31720267 AZLWYSPSJKDOCJ-UHFFFAOYSA-N 400.431 2.971 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2ccc(N3CCCCCC3)nn2)CC1 4583308 CESBGQKBCNEDBW-UHFFFAOYSA-N 410.478 2.728 5 40 HFBB C[C@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 17328231 FCSRCIBGGROFED-OKILXGFUSA-N 419.459 2.645 5 40 HFBB CS(=O)(=O)c1cccc2c1CCCN2Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 58171430 IYYMGLBNBDAFJD-UHFFFAOYSA-N 413.459 2.667 5 40 HFBB O=C(c1ccc(Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2-n2cnnc2)CC1 70461844 OIXXOOYJIJKHHS-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB CO[C@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1 96006533 QKVACYBTSDMMGR-CABCVRRESA-N 422.482 2.537 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)c([N+](=O)[O-])c1 100170794 YTPUJBMNHPTPEY-UHFFFAOYSA-N 418.322 2.646 5 40 HFBB COc1ccccc1[C@H](C)NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 225453215 SZKNTDZTVYASPS-AWEZNQCLSA-N 421.475 2.555 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1 5885506 JLFGOBDZZKDJGG-KRWDZBQOSA-N 419.459 2.613 5 40 HFBB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 8009578 WULZTHTYTIKJAV-UHFFFAOYSA-N 421.457 2.786 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(Cc3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@H]32)c1 10272614 KZDKFWHEEZXGDZ-RBUKOAKNSA-N 415.471 2.819 5 40 HFBB Cc1nc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1I 17089443 YLJMJLAPLWHZIA-UHFFFAOYSA-N 413.171 2.920 5 40 HFBB CC(=O)Oc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1 409177951 HQWJJKXCAGFZSY-UHFFFAOYSA-N 402.315 2.776 5 40 HFBB CCCn1c(=N)c(S(=O)(=O)c2ccc(F)cc2)cc2c(=O)n3ccccc3nc21 2398063 HUEAAFDXTIGEDZ-UHFFFAOYSA-N 412.446 2.511 5 40 HFBB O=C(C[C@H]1SC(=O)N(CC(=O)c2ccccc2)C1=O)Nc1ccc([N+](=O)[O-])cc1 4785185 IQFMOTUOULVWGL-MRXNPFEDSA-N 413.411 2.870 5 40 HFBB C/C(Cl)=C/Cn1c(SCc2ccc([N+](=O)[O-])cc2)nc2c1c(=O)[nH]c(=O)n2C 10386080 PFCMJZVCOXFUDO-YFHOEESVSA-N 421.866 2.766 5 40 HFBB COc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2N2CCOCC2)cc(OC)c1OC 12856503 XCUFGMZZFNUHOA-UHFFFAOYSA-N 417.418 2.710 5 40 HFBB CN(Cc1ccccc1Br)C(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 28005287 IVBABHBRBKMDOS-UHFFFAOYSA-N 420.219 2.924 5 40 HFBB NC(=O)COc1ccc(/C=C2\SC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)cc1 106745181 DOVRDPVAQREOJX-SXGWCWSVSA-N 413.411 2.695 5 40 HFBB O=C(NCc1ccco1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 5533992 XSQMCTJGWUSXJZ-UHFFFAOYSA-N 401.400 2.919 5 40 HFBB C[C@@H](OC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 10214174 AYSXHUYNBIREAK-SNVBAGLBSA-N 423.784 2.688 5 40 HFBB C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)NCC(F)(F)F 10723020 DJZNMVKFIHLUOT-GFCCVEGCSA-N 406.360 2.765 5 40 HFBB Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccncc1I 95413661 QVWORWDDRQMVHX-UHFFFAOYSA-N 419.200 2.704 5 40 HFBB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc(Cl)cc([N+](=O)[O-])c2O)C1=O 409012294 QEDNXXHNTPTQOU-AUEGDVLESA-N 400.796 2.942 5 40 HFBB CCOc1ccc2nc(COC(=O)c3ccc([N+](=O)[O-])cc3)c(C(C)=O)[n+]([O-])c2c1 5529699 BUHJLPONOYSFLW-UHFFFAOYSA-N 411.370 2.735 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N[C@@H](CC(=O)Nc1cccc(C(C)=O)c1)C(=O)O 6590286 PBOHNULHPMPGTK-INIZCTEOSA-N 401.375 2.700 5 40 HFBB O=C1CN(c2ccc(Nc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])cn2)CCN1 29621553 ALEBISOKJPEKDC-UHFFFAOYSA-N 417.425 2.901 5 40 HFBB CC(=O)Oc1ccc(C(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 409181833 FZQGDJKGLVBBBE-UHFFFAOYSA-N 414.370 2.665 5 40 HFBB COC(=O)C(C(=O)OC)[C@H](c1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)[N+](=O)[O-] 1722456 BGUMLHXQINGZKB-DOTOQJQBSA-N 402.359 2.659 5 40 HFBB CN(C[C@H]1CCCO1)S(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4348138 DQWZSBYKEBKQSK-QGZVFWFLSA-N 419.459 2.647 5 40 HFBB CCn1c(=N)c(C(=O)N[C@H](C)c2ccccc2)cc2c(=O)n3cc(C)ccc3nc21 16742601 LWBZNMGHJKYTEN-OAHLLOKOSA-N 401.470 2.948 5 40 HFBB Cc1cn(Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(=O)n1-c1cccc([N+](=O)[O-])c1 58132590 DCYUDAZUUGUMFB-UHFFFAOYSA-N 412.358 2.679 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(OC2CCN(C)CC2)cc1 216947107 QFYFEQLXGNRDKF-UHFFFAOYSA-N 419.503 2.855 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)NCCSC(C)(C)C)S(C)(=O)=O 220386803 CKQIKTCVDNAXBY-ZDUSSCGKSA-N 417.553 2.706 5 40 HFBB COc1ccc(N(CC(=O)O)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl 224780123 GBHUEQLHSRMMBD-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB CC[C@@H](C(=O)c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCC1=O 408643590 GGLIFEHUSIMPQF-KRWDZBQOSA-N 409.398 2.763 5 40 HFBB Cc1ccc(CN2C(=O)N/C(=C\c3cc([N+](=O)[O-])ccc3N3CCOCC3)C2=O)cc1 409233332 VAAQAZIAYARZHX-UYRXBGFRSA-N 422.441 2.833 5 40 HFBB CC1(C)N=C(N)N=C(N)N1c1cccc(OCCCOc2cccc([N+](=O)[O-])c2)c1 1703366 RWKJNXZSLJHMOW-UHFFFAOYSA-N 412.450 2.628 5 40 HFBB COC(=O)c1cc(C(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cc([N+](=O)[O-])c1 40080128 QVRKFZYTUZXGNU-MRXNPFEDSA-N 413.434 2.677 5 40 HFBB O=C(Cc1ccc(OC(F)(F)F)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 48365502 WKVADZYOZSBQEQ-UHFFFAOYSA-N 410.352 2.780 5 40 HFBB CC[C@@H](C(=O)NC)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 222959460 ODNUIIMCUSYHDT-KRWDZBQOSA-N 415.446 2.536 5 40 HFBB CCc1nnc(S/C(=C/c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)C(=O)O)o1 408632841 UDBSSASHHCOBTB-RVDMUPIBSA-N 419.463 2.510 5 40 HFBB CC[C@@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@H](c3cccc([N+](=O)[O-])c3)N2C1=O 2256767 JETDMZPPGFJUQQ-HOCLYGCPSA-N 419.459 2.823 5 40 HFBB CSc1ccccc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1NCCO 5843940 QNDXJMDCLLRQLT-UHFFFAOYSA-N 405.432 2.516 5 40 HFBB O=C([C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)N1CCCCCCC1 40060219 ZQWQJTARGYQNCX-SFHVURJKSA-N 409.508 2.931 5 40 HFBB Cc1ccc(CNC(=O)CN2CCN(c3ccc([N+](=O)[O-])c4cnccc34)CC2)cc1 57456092 RUAJGVPYFKRNAO-UHFFFAOYSA-N 419.485 2.890 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC(=O)OC)c2cccc([N+](=O)[O-])c2C)cc1 224601036 QFOMIOQMZWFIQB-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB CCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)[nH]1 7419612 WOCZRMDHINXHQF-UHFFFAOYSA-N 402.798 2.640 5 40 HFBB CCCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 40134235 AFYTXPLJPRNZLS-LLVKDONJSA-N 421.422 2.587 5 40 HFBB CCCCN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1c(N)n(CCC)c(=O)[nH]c1=O 3433616 UYMBCRAHVHFJCL-UHFFFAOYSA-N 423.857 2.537 5 40 HFBB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)c3ccc(C)c([N+](=O)[O-])c3)cc12 4032810 BHFBBUWFFUSXFS-UHFFFAOYSA-N 411.414 2.734 5 40 HFBB C[C@H]1CN(Cc2csc(NC(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)n2)C[C@H](C)O1 12565007 JWWPIZJERLHMGC-STQMWFEESA-N 419.507 2.979 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cc([N+](=O)[O-])c1 14086036 JXMNEBWNEWMBLJ-IPJQOSJUSA-N 406.435 2.868 5 40 HFBB CC[C@@H](NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O)c1ccccc1 20494123 XMJNGMHEQVEVBE-QGZVFWFLSA-N 405.476 2.937 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 408611889 XKDAAXITFRSVLB-ZDUSSCGKSA-N 407.448 2.607 5 40 HFBB CCc1ccc(N2C[C@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1 7452378 LREUGFQLDFPRKR-GOSISDBHSA-N 422.485 2.859 5 40 HFBB Cc1c(C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2)cccc1[N+](=O)[O-] 22438213 NSZXOOZIFYNOIA-UHFFFAOYSA-N 414.487 2.862 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 30864654 VZSNDMDBRPXXAJ-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB Cc1cccc(CNC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 222366396 FKVISDHRBVOOIM-UHFFFAOYSA-N 405.476 2.766 5 40 HFBB COc1ccc([C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c2nccn2C)cc1 12551228 ULWYHBKXISCCNF-GOSISDBHSA-N 416.459 2.942 5 40 HFBB C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCOc2ccccc21 42616026 VMCWJKCFCYKMHD-HOCLYGCPSA-N 413.430 2.969 5 40 HFBB COC(=O)Cn1/c(=N/C(=O)c2cccc([N+](=O)[O-])c2)sc2cc(OC)ccc21 100876945 FAGCSBMZCSPFPL-HNENSFHCSA-N 401.400 2.534 5 40 HFBB CCOC(=O)c1c(CC[N+](=O)[O-])n(C)c2cc(Br)c(OC(C)=O)cc12 514265580 LWKUNWARFPQXFF-UHFFFAOYSA-N 413.224 2.862 5 40 HFBB CC1CCN(c2ccc(C(=O)OCC(=O)N3C[C@@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])CC1 4835453 YVYRCUMFOXIISJ-HZPDHXFCSA-N 419.478 2.624 5 40 HFBB O=C(COC(=O)Cn1nnc2ccccc21)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9439047 PJIPZNQAWPARSA-UHFFFAOYSA-N 423.307 2.540 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1Sc1nnc2ccccn12 12533302 KKCILYDMFYMODN-UHFFFAOYSA-N 419.488 2.963 5 40 HFBB NC1=NC(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)=N[C@H](c2c[nH]c3ccccc23)N1 13579220 CFPCJXBTYKAATJ-QGZVFWFLSA-N 423.458 2.721 5 40 HFBB Cc1ccc(CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]2CCS(=O)(=O)C2)o1 15952810 ROXSGUFADWIMKC-CYBMUJFWSA-N 412.851 2.979 5 40 HFBB CCOc1cc(/C=C2/NC(=S)NC2=O)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 105668626 UDVDRDMVZMWGLJ-NTEUORMPSA-N 413.411 2.558 5 40 HFBB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] 6315966 UEYWOXLCFHNOKM-UHFFFAOYSA-N 401.762 2.885 5 40 HFBB COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1S(=O)(=O)N1CCCC1 8476165 XFHLYLQFCSDLJQ-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB O=C(CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)Nc1ccc(F)c(F)c1F 9130969 PVGJFBULGTVICT-UHFFFAOYSA-N 422.363 2.981 5 40 HFBB CCOc1cccc(N(CC(=O)Nc2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)c1 22393048 WVZPESDZZGGIDO-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB COc1cc(CCC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 4806483 FVAOAQVOQBVBGU-UHFFFAOYSA-N 418.402 2.735 5 40 HFBB COc1ccccc1NC(=O)CCC(=O)OCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 8416724 HEHLAFYGRONTJU-UHFFFAOYSA-N 415.402 2.812 5 40 HFBB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 8481998 VPUQAKOQTGYTQV-LJQANCHMSA-N 400.366 2.530 5 40 HFBB C[C@@H](NC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 12938732 PBFVBUHHPCTHTK-LLVKDONJSA-N 419.821 2.627 5 40 HFBB O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCc1nc2ccccc2s1 2659102 UNQZDHMYJXSPBO-UHFFFAOYSA-N 411.395 2.934 5 40 HFBB Cc1nn(CC(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 6070543 VTQWNKTUFLATRZ-UHFFFAOYSA-N 400.313 2.609 5 40 HFBB Cc1cc(C)cc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)c1 12421637 BZNXDXZWQSANHX-ZWKOTPCHSA-N 417.512 2.989 5 40 HFBB O=C(NCc1ccc(CN2CCCC2)cc1)c1cc(N2CCOCC2)ccc1[N+](=O)[O-] 16102220 JIAQSHVKLYXBLO-UHFFFAOYSA-N 424.501 2.957 5 40 HFBB O=C1COc2ccc(C(=O)C3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)cc2N1 58263839 WBUGLDSGTPHSEI-UHFFFAOYSA-N 409.398 2.661 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O 138886005 APYISNVZMDJNAM-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)OCCCC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] 3503414 ZPSWGXMZPNILOO-UHFFFAOYSA-N 409.391 2.957 5 40 HFBB COc1ccc(CCNC(=O)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC 712516 RPWWOUQNNOYCBE-UHFFFAOYSA-N 404.419 2.531 5 40 HFBB COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 6552969 GRYHASUWPSQGEO-LLVKDONJSA-N 404.375 2.805 5 40 HFBB C[C@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@H](C)O1 17328233 FCSRCIBGGROFED-KBPBESRZSA-N 419.459 2.645 5 40 HFBB O=C(Nc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1)[C@@H]1CCCO1 32909273 JLNHPUHCFNDQPZ-FQEVSTJZSA-N 424.457 2.675 5 40 HFBB Cc1cccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1C 4393629 PPNGIYAGNYOUGD-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC(C(=O)N2CCCCCC2)CC1 12972872 PCMRSEPCDUUXAL-UHFFFAOYSA-N 402.495 2.956 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 14019438 BCZFTCLRXOTBDQ-AWEZNQCLSA-N 419.459 2.643 5 40 HFBB NS(=O)(=O)c1ccc(OCc2noc(-c3ccc(Cl)cc3)n2)c([N+](=O)[O-])c1 32789401 SHGMJRRWKZOIEQ-UHFFFAOYSA-N 410.795 2.525 5 40 HFBB O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 70010289 JEBJDYBMCDHCQY-UHFFFAOYSA-N 424.457 2.920 5 40 HFBB Cc1cc(C)nc(NC(=S)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1 408628421 SUCCMFVRQQQYCY-UHFFFAOYSA-N 400.464 2.729 5 40 HFBB C[C@@H](OC(=O)C1CCN(C(=O)C(C)(C)C)CC1)C(=O)Nc1cccc([N+](=O)[O-])c1 14246770 LTKIEBILAQDBSB-CYBMUJFWSA-N 405.451 2.750 5 40 HFBB COc1ccc(C(=O)NCC(=O)NCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 15976961 XSWVTCJTNKKVNB-UHFFFAOYSA-N 411.336 2.668 5 40 HFBB CC(C)Oc1cccc(N(CC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220105870 RYNFMDQJWUPCTG-UHFFFAOYSA-N 407.448 2.787 5 40 HFBB NS(=O)(=O)c1ccc2nc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)sc2c1 9367610 WMROHHGBQQZOTI-FPYGCLRLSA-N 404.429 2.504 5 40 HFBB COc1cc(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)c([N+](=O)[O-])c(OC)c1OC 12772073 DBFATNGWVVKIBW-OAHLLOKOSA-N 421.425 2.792 5 40 HFBB O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCCC12CC3CC(CC(C3)C1)C2 12978719 ZTDFCAKENAOSFR-UHFFFAOYSA-N 411.458 2.914 5 40 HFBB Cc1ccc(CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)[C@H]2CCS(=O)(=O)C2)o1 15952811 ROXSGUFADWIMKC-ZDUSSCGKSA-N 412.851 2.979 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 22258649 QTNQDEIYIQSYTM-HNNXBMFYSA-N 403.460 2.943 5 40 HFBB COCCn1ccc2nc3ccn(-c4nc(C5CCCCC5)n[nH]4)c(=O)c3cc2c1=O 40399020 ACJZUFMOYWZBSK-UHFFFAOYSA-N 420.473 2.513 5 40 HFBB CN(Cc1nc(C(F)(F)F)no1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 95448366 QHJQAJBVLGCXAI-UHFFFAOYSA-N 413.356 2.872 5 40 HFBB CC[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222522053 HMWISUWTQUAQPG-INIZCTEOSA-N 422.419 2.686 5 40 HFBB COCCCN1C(=O)c2ccc(-c3nc(-c4ccc([N+](=O)[O-])cc4)no3)cc2C1=O 2222861 UKASTDRZCLEQJQ-UHFFFAOYSA-N 408.370 2.944 5 40 HFBB O=C(NN1C(=O)c2cc([N+](=O)[O-])cc3cc([N+](=O)[O-])cc(c23)C1=O)c1ccccc1 3044981 WSMOLRMZUGIWPF-UHFFFAOYSA-N 406.310 2.597 5 40 HFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1cccc(N2CCCS2(=O)=O)c1 12777922 DNAQENGWEBKUOZ-AWEZNQCLSA-N 403.460 2.968 5 40 HFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCC(=O)NCCSCc1ccsc1 16172799 XLTVVMXJQJQILM-ZZXKWVIFSA-N 405.501 2.835 5 40 HFBB Cc1c(NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220411945 IVOHEKHJPYVPCQ-GFCCVEGCSA-N 422.419 2.605 5 40 HFBB COc1ccc2c(c1)C=C([N+](=O)[O-])[C@@H]([C@@H]1OC(C)(C)O[C@@H]1[C@@H]1COC(C)(C)O1)O2 5741882 XCSPWLQVNNIZQE-FJIDUMEYSA-N 407.419 2.745 5 40 HFBB COc1ccccc1COC[C@H](O)Cn1cnc2cc(Cl)c([N+](=O)[O-])cc2c1=O 24830212 NCOVLZJLWILJJC-CYBMUJFWSA-N 419.821 2.544 5 40 HFBB O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCc1csc(-c2ccco2)n1 25431648 VGYZDHSADRSCHI-UHFFFAOYSA-N 413.367 2.651 5 40 HFBB COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 3411976 WBUDBFFWKWNHJD-GFCCVEGCSA-N 417.418 2.862 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4144328 DXBNEPDFCBIQJD-JKIFEVAISA-N 409.320 2.699 5 40 HFBB O=C(CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1)NCc1ccccc1F 57508480 ISGZSNXSQPXWBJ-UHFFFAOYSA-N 423.448 2.721 5 40 HFBB COc1ccc(NC(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8416434 BAJOFCUXCIJYBQ-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB CCOC(=O)C[C@H](NS(=O)(=O)c1ccc(OCC)cc1)c1cccc([N+](=O)[O-])c1 12411945 ORTVKFTYTXTLRH-SFHVURJKSA-N 422.459 2.966 5 40 HFBB COc1ccc(-c2nn3c(C)nnc3s2)cc1NC(=O)c1ccc([N+](=O)[O-])o1 14291281 DUGZLKVRFIWKQC-UHFFFAOYSA-N 400.376 2.923 5 40 HFBB C[C@@H]1CN(C(=O)COC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C[C@@H](C)O1 5710970 QBKNIJQHWIXGQR-HZPDHXFCSA-N 419.478 2.768 5 40 HFBB C[C@@H](OC(=O)CNC(=O)c1ccccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20753445 UQURIENXZHEEKO-SNVBAGLBSA-N 423.784 2.688 5 40 HFBB Cc1ccc(C(=O)N2CCN([C@H]3CCCN(c4ccccc4)C3=O)CC2)cc1[N+](=O)[O-] 95998382 UKCLJGPLEZHEDM-FQEVSTJZSA-N 422.485 2.857 5 40 HFBB Cc1ccc([C@@H](CN2CCOCC2)NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 12783628 FFSWQXNNTDIALQ-LJQANCHMSA-N 419.503 2.563 5 40 HFBB O=[N+]([O-])c1cc2c(cc1S(=O)(=O)N1CCC[C@H](C(F)(F)F)C1)OCCCO2 32895536 OAFGCDABVWTVGD-JTQLQIEISA-N 410.370 2.719 5 40 HFBB O=[N+]([O-])c1ccc2[nH]c(N3CCCN(S(=O)(=O)c4ccc(F)cc4)CC3)nc2c1 97097528 VSJJUFYYJUFUSS-UHFFFAOYSA-N 419.438 2.511 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224783138 UAGNTRWRLYRFOW-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB COC(=O)[C@@H](C)Oc1cc(O[C@H](C)C(=O)OC)c2c(=O)c3ccccc3oc2c1 4083853 RETDYBOPJHDCOD-VXGBXAGGSA-N 400.383 2.827 5 40 HFBB biogenic COCCCNC(=S)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 5701034 PUZXSQTXCGRFFQ-UHFFFAOYSA-N 406.430 2.647 5 40 HFBB COc1ccc(NC2=N[C@H](c3ccc([N+](=O)[O-])cc3)n3c(nc(C)cc3=O)N2)cc1 7496343 GJGJTAKBESGSDY-SFHVURJKSA-N 406.402 2.909 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@H](c2ccc([N+](=O)[O-])cc2)n2nnnc2N3)cc1 10232584 FKOVFBWYZFRLAA-KRWDZBQOSA-N 402.374 2.747 5 40 HFBB Cn1c2c(c(=O)n(C)c1=O)[C@H](c1cc([N+](=O)[O-])ccc1Cl)Nc1ccccc1O2 2322978 AWNNIEDOKBWDMF-INIZCTEOSA-N 414.805 2.953 5 40 HFBB CCCc1cnc2c(c1SCc1ccc([N+](=O)[O-])cc1)c(=O)n(C)c(=O)n2C 10216797 ZZEUFYCXPFENAR-UHFFFAOYSA-N 400.460 2.785 5 40 HFBB Cc1ccc(CN2C[C@H](C(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2=O)cc1 6579690 CZEWYGJSUBIROF-LJQANCHMSA-N 422.485 2.601 5 40 HFBB Cc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1C 8843967 TUSCQTTUPRKLSL-ROUUACIJSA-N 401.444 2.824 5 40 HFBB O=C(NCc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1Cl 13723139 PFLJVGNMUGOGIN-UHFFFAOYSA-N 424.804 2.600 5 40 HFBB Cc1c(NC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cccc1[N+](=O)[O-] 13955109 RMNAWKBHSPOVHJ-AWEZNQCLSA-N 409.398 2.931 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N[C@H]1CCN(C2CC2)C1 48345070 FPUDHOJMTCQBRF-HNNXBMFYSA-N 408.524 2.808 5 40 HFBB COc1cc([N+](=O)[O-])c(C(=O)NCC(=O)Nc2ccc3cn[nH]c3c2)cc1SC 79016124 PKVJMRKRSYEVPT-UHFFFAOYSA-N 415.431 2.570 5 40 HFBB CSc1ccc(COc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])cc1 89493879 IVZFOSWIMRPHHZ-UHFFFAOYSA-N 424.500 2.917 5 40 HFBB O=C(NCc1ccco1)[C@@H](C(=O)c1cccc([N+](=O)[O-])c1)n1cc(Cl)ccc1=O 199408132 BPMCRRXMLSDDEV-QGZVFWFLSA-N 415.789 2.743 5 40 HFBB COc1ccc2[nH]c(C(=O)N3C[C@@H]4C[C@H](C3)Cn3c4ccc([N+](=O)[O-])c3=O)cc2c1 524729326 OKNJHHSJXCMFDA-OCCSQVGLSA-N 408.414 2.506 5 40 HFBB biogenic CC(C)CN1c2ccc([N+](=O)[O-])cc2CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]1C(C)C 5426732 UBBXOUXRXMMPQF-KRWDZBQOSA-N 416.478 2.675 5 40 HFBB O=C(CN1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21)Nc1cccc([N+](=O)[O-])c1 12554373 PBLWKMGQSFQGOT-HXUWFJFHSA-N 424.457 2.813 5 40 HFBB Cc1cc(NC(=O)CN(C)C(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)no1 32841893 LGZDPOSIYSFMAV-UHFFFAOYSA-N 415.450 2.982 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(Cc3cccs3)CC2)c(Cl)c1 40119652 KZRMJIMPGUVSET-UHFFFAOYSA-N 401.897 2.816 5 40 HFBB COc1c([N+](=O)[O-])cc(Cc2cc([N+](=O)[O-])c(OC)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 104058964 DAVNDXJONFIXRT-UHFFFAOYSA-N 408.279 2.927 5 40 HFBB CCOc1ccc(NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220024148 GAZSBBMCPIZCTG-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB Cc1c(C(=O)N2C[C@]3(F)CN(Cc4ccccc4)C(=O)[C@]3(F)C2)cccc1[N+](=O)[O-] 306129664 IJEFERXPHAPYIO-NHCUHLMSSA-N 415.396 2.818 5 40 HFBB CC(C)CNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 409197873 QQTJYOGSKCRLSF-UHFFFAOYSA-N 407.448 2.547 5 40 HFBB CC1(C)N=C(N)N=C(N)N1c1cccc(OCCCOc2ccc([N+](=O)[O-])cc2)c1 1704131 RIENOKZCFDAIQG-UHFFFAOYSA-N 412.450 2.628 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 408643775 RVJPLSFYKDLTHI-NSHDSACASA-N 400.347 2.503 5 40 HFBB CCOCN1C(C)=C(C(=O)OC)C(c2ccccc2[N+](=O)[O-])C(C(=O)OC)=C1C 4671220 CYAPGGHKLJOHOI-UHFFFAOYSA-N 404.419 2.882 5 40 HFBB CSc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 223978159 MMALQPQANZUOMU-UHFFFAOYSA-N 409.489 2.884 5 40 HFBB COC(=O)[C@H](C)Oc1cc(O[C@H](C)C(=O)OC)cc2oc3ccccc3c(=O)c12 4083849 RETDYBOPJHDCOD-NEPJUHHUSA-N 400.383 2.827 5 40 HFBB biogenic CCCn1c(-c2cccc([N+](=O)[O-])c2)nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1 6313760 JRKQRLXSUQDZGC-UHFFFAOYSA-N 405.414 2.920 5 40 HFBB Cn1/c(=N/C(=O)/C=C/c2ccc([N+](=O)[O-])s2)sc2cc(S(C)(=O)=O)ccc21 100859777 FPXGALIDKDUHIT-IIBVWTGSSA-N 423.497 2.754 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c(C)c1 8433869 CQVREWYQGOMVED-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(S(=O)(=O)NC(C)(C)C)cc1 409236352 FDWZVZJUTPYWAH-UHFFFAOYSA-N 421.475 2.998 5 40 HFBB COc1cccc(C(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 408642219 DSWBYRFLKMJYRK-HNNXBMFYSA-N 412.398 2.691 5 40 HFBB COC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(=O)(=O)c1ccc(Cl)cc1 113888589 WPUJMPRDLWUUTH-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccc(-n3cccn3)nn2)C1 62022768 TWEKGCJFUVBPQG-CYBMUJFWSA-N 411.397 2.565 5 40 HFBB Cc1c(N(CC(=O)N[C@@H](C)c2ccc(F)cc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220036015 KXJCRZRVTAFTSK-ZDUSSCGKSA-N 409.439 2.686 5 40 HFBB O=C(NC(=S)Nc1ccccc1S)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 17091454 JTXNGMXZXAQHKU-UHFFFAOYSA-N 418.500 2.847 5 40 HFBB O=C(CCc1nc(-c2ccc(F)cc2)no1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 40012856 VURGDTREOOVJMX-INIZCTEOSA-N 400.366 2.566 5 40 HFBB CCc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 8433892 MYPVOFSNPYALLU-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB O=C(NC(=S)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(F)cc1 8902601 ZDBZDSNKOZXAIY-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@@H](CO)Cc1ccco1 24205788 ZIMNPOUYPRRUAT-HNNXBMFYSA-N 423.491 2.626 5 40 HFBB CN(Cc1ccccc1)C(=O)N1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 40135301 SSGLFJXDSSAKOG-UHFFFAOYSA-N 400.464 2.678 5 40 HFBB O=C(NCc1cccc(N2CCCC2=O)c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 48309743 IXVXQYOWRZLHGK-UHFFFAOYSA-N 405.414 2.837 5 40 HFBB O=[N+]([O-])c1cc(I)c(I)cc1[N+](=O)[O-] 21999537 KAQQACPCRNDISO-UHFFFAOYSA-N 419.900 2.712 5 40 HFBB O=C(CN(C(=O)c1ccc(Cl)cc1)N1C(=O)CCC1=O)c1cccc([N+](=O)[O-])c1 408642537 DZLQAXJVSSTOTQ-UHFFFAOYSA-N 415.789 2.637 5 40 HFBB Cc1cc([N+](=O)[O-])nn1CCNC(=O)c1ccc(COc2ccc(F)cc2F)o1 2795523 UUJWRHVOEWCUPG-UHFFFAOYSA-N 406.345 2.980 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)c1 4393608 VYVZQJKUYYPXIG-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB COC(=O)C(=C\c1nc2ccc([N+](=O)[O-])cc2s1)/C(C(=O)OC)=C1\CCCN1C 5759138 COICVVAABJJKEZ-PRPHQEAXSA-N 417.443 2.914 5 40 HFBB COC[C@@H](C)NS(=O)(=O)c1ccc(NCc2ccccc2OC)c([N+](=O)[O-])c1 6623554 JVEYHKZRFWZRHA-CYBMUJFWSA-N 409.464 2.529 5 40 HFBB COc1ccc(C)cc1N(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 8369867 RKNOXQDWPUCKPT-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB O=C(OCc1cc(=O)oc2cc3c(cc12)CCC3)c1cc([N+](=O)[O-])ccc1NCCO 9127837 CBHGDLBQVAKFEY-UHFFFAOYSA-N 424.409 2.951 5 40 HFBB O=C(CSc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)s1)Nc1nccs1 9366096 PFHGXRJZBOBMRI-UHFFFAOYSA-N 422.473 2.886 5 40 HFBB CC1CCN(c2ccc(C(=O)NCCc3nnc4ccccn34)cc2[N+](=O)[O-])CC1 11546538 RXNNQAWEFYVNQR-UHFFFAOYSA-N 408.462 2.846 5 40 HFBB O=C(Nc1cccc([N+](=O)[O-])c1)C1CCN(S(=O)(=O)Cc2ccc(F)cc2)CC1 19868594 AAGRMTJONGNRPV-UHFFFAOYSA-N 421.450 2.914 5 40 HFBB Cc1cc(OCC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)ccc1[N+](=O)[O-] 24521128 HJSPFBUQDDZJKI-UHFFFAOYSA-N 404.444 2.877 5 40 HFBB Cc1c(C(=O)Nc2ccc3nc(CCN4CCOCC4)[nH]c3c2)cccc1[N+](=O)[O-] 78724175 XPJKUXXPPIFGTB-UHFFFAOYSA-N 409.446 2.907 5 40 HFBB COc1ccc(OC)c([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)c1 5523317 OAECXCTZWRADMY-SFHVURJKSA-N 412.402 2.879 5 40 HFBB CCn1c(CNC(=O)c2ccco2)nnc1SCC(=O)c1cccc([N+](=O)[O-])c1 9327585 PXOKLVNLYGJTTE-UHFFFAOYSA-N 415.431 2.704 5 40 HFBB CCN1C(=O)[C@@H]2[C@@H](C(=O)c3ccc([N+](=O)[O-])cc3)N3C=Cc4ccccc4[C@@H]3[C@@H]2C1=O 16027770 LFBANCJFDNIJKX-WCIQWLHISA-N 417.421 2.808 5 40 HFBB biogenic O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@@H]2C(=O)N1c1ccc(Br)cc1 101075884 DWXNCTJRXPRHGS-ZFWWWQNUSA-N 416.187 2.650 5 40 HFBB COc1ccc(-c2noc(CN(C)C(=O)Cc3ccccc3[N+](=O)[O-])n2)c(OC)c1 218163064 NJHSBRUZFAGXGM-UHFFFAOYSA-N 412.402 2.863 5 40 HFBB COc1ccc(N2C(=O)N=C(O)[C@@]3(Cc4cc([N+](=O)[O-])ccc4N(C)C3)C2=O)cc1 8995662 KQYTXCUHZCDCLQ-FQEVSTJZSA-N 410.386 2.705 5 40 HFBB CC[C@@H](Sc1nncn1C)C(=O)Nc1nnc(-c2cccc([N+](=O)[O-])c2)s1 11852417 VWLSHYICMDIDFU-LLVKDONJSA-N 405.465 2.751 5 40 HFBB O=C(c1ccc2c(c1)OCCO2)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 15534348 GNWKHTSXRZVGOC-UHFFFAOYSA-N 403.822 2.982 5 40 HFBB C[C@H](OC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1 21128952 STTQBJGMBDPSMP-LBPRGKRZSA-N 419.821 2.939 5 40 HFBB O=C(NC1CCCCC1)N1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 40086100 BZCVGKHHCLPACW-UHFFFAOYSA-N 404.467 2.621 5 40 HFBB CC(C)NC(=O)c1cc2c(=O)n3ccccc3nc2n(CCc2ccccc2)c1=N 101147513 IKXSZXKFGZDMCF-UHFFFAOYSA-N 401.470 2.510 5 40 HFBB COCCCn1c(-c2ccc(OC)cc2)nc2c(c(=O)c3ccccc3n2C)c1=O 2441301 QJUOHYRKJZIGSB-UHFFFAOYSA-N 405.454 2.961 5 40 HFBB C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2=O 3336259 XNPSWGZYKSTYKE-WLRWDXFRSA-N 406.414 2.809 5 40 HFBB CCN(CC(=O)NC(C)(C)C)c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 8401322 VTPGAVKSLURLAL-UHFFFAOYSA-N 411.402 2.629 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@@H](C)CCc1ccccc1)S(C)(=O)=O 10329129 IIKWNHMRUMMDCY-INIZCTEOSA-N 419.503 2.807 5 40 HFBB CCOc1ccc(-c2noc(CNS(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1 223590318 FYACWEVSPPPIBZ-UHFFFAOYSA-N 404.404 2.522 5 40 HFBB CN(C)c1ccc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1[N+](=O)[O-] 12527741 ZGEDVCSKKGGAJN-QGZVFWFLSA-N 404.492 2.526 5 40 HFBB C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ccc([N+](=O)[O-])c4cccnc34)CC2)C1 12735508 LETWNCVSPADLLO-IAGOWNOFSA-N 411.506 2.770 5 40 HFBB O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c(Cl)c1 13881633 UFFBYZSBZFRYIT-UHFFFAOYSA-N 400.800 2.547 5 40 HFBB C[C@@H](C(=O)N1CCCC1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 58161830 XOXPAACXJCEYJD-ZDUSSCGKSA-N 400.401 2.747 5 40 HFBB COc1ccccc1-c1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])n1N 89688823 ZYDBPEJMOUHHEL-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB CC(=O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@@H]2C(=O)N(c3cccc(Cl)c3)C(=O)[C@H]12 104496990 GGXKNQVEPWEXPE-WBVHZDCISA-N 412.789 2.571 5 40 HFBB O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccccc3)C2)c(S(=O)(=O)N2CCCC2)c1 23888451 RGGVAJZQHVZRTG-LJQANCHMSA-N 417.487 2.957 5 40 HFBB C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 58171523 CAWVCNZEEVFYNT-BBRMVZONSA-N 406.483 2.961 5 40 HFBB COCCCN1C(=O)[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)n2c1nc1ccccc12 39963987 DICATJKDCJJENX-SFHVURJKSA-N 423.429 2.898 5 40 HFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1nc(N2CCCCC2)ncc1Cl 47537964 QHWAWJUZOWSHPM-UHFFFAOYSA-N 404.858 2.870 5 40 HFBB CC(C)OC(=O)[C@H]1C[C@@](C)(O)C(=O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 4546806 DFQLPYSPKQLGGU-BIZBXSGISA-N 421.446 2.538 5 40 HFBB O=C(Nc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 6269199 CKRCRFAHHODBNA-UHFFFAOYSA-N 412.446 2.520 5 40 HFBB C[C@H](Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 8190632 SSIMKTUJZWDHSS-AWEZNQCLSA-N 418.475 2.818 5 40 HFBB C[C@H](OC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(=O)NC(=O)NC(C)(C)C 15682658 NLEZGWXDMXSYQU-ZDUSSCGKSA-N 420.466 2.755 5 40 HFBB Cc1n[nH]c(-n2ccc3nc4ccn(-c5ccc(Cl)cc5)c(=O)c4cc3c2=O)n1 40398590 XADYUOKUSGTTHM-UHFFFAOYSA-N 404.817 2.770 5 40 HFBB COc1ccc([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408565072 HOXYDFPYJNRIGW-QRXQEZHUSA-N 409.442 2.758 5 40 HFBB Cc1ccc(Nc2c([N+](=O)[O-])nn(-c3ccc4c(c3)OCCO4)[n+]2[O-])c(Cl)c1 5005433 DYZDXNYCPZCSEA-UHFFFAOYSA-N 403.782 2.891 5 40 HFBB COC(=O)c1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 5559937 XMHQWIDQUOFITH-QGZVFWFLSA-N 410.386 2.648 5 40 HFBB O=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 12738501 HWVOCDBALWSDMY-UHFFFAOYSA-N 415.471 2.840 5 40 HFBB C[C@@H](OC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1)C(=O)NC(=O)NC(C)(C)C 15682657 NLEZGWXDMXSYQU-CYBMUJFWSA-N 420.466 2.755 5 40 HFBB Cc1c(NS(=O)(=O)c2ccc(O[C@H](C)C(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] 408592680 NYFZJMRHOAIXKP-CQSZACIVSA-N 421.475 2.996 5 40 HFBB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 7232523 OOEANLOYLASTTJ-HOCLYGCPSA-N 411.414 2.686 5 40 HFBB CNc1ccc(C(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)cc1[N+](=O)[O-] 12587536 RRIMXLBYXJLFGS-VXGBXAGGSA-N 405.480 2.955 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1ccc(N2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 224907790 VTBAPRDVNGTQFM-UHFFFAOYSA-N 418.475 2.600 5 40 HFBB Cc1ccccc1Nc1nc(N)nc(COC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)n1 9468840 VLOMWMVVZPDMRL-UHFFFAOYSA-N 423.433 2.837 5 40 HFBB CCN1C(=O)[C@H]2[C@@H](C1=O)[C@H]1c3ccccc3C=CN1[C@H]2C(=O)c1ccc([N+](=O)[O-])cc1 19702969 LFBANCJFDNIJKX-IYWMVGAKSA-N 417.421 2.808 5 40 HFBB biogenic C[C@H](OC(=O)CNC(=O)c1ccccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20753448 UQURIENXZHEEKO-JTQLQIEISA-N 423.784 2.688 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CCCC(=O)NCCc1ccccc1)S(C)(=O)=O 222371607 WCLMJWQQHDKBDX-UHFFFAOYSA-N 419.503 2.808 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224756076 WJEUEYSMWSPDFG-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB C[C@H]1CCCCN1C(=O)CN1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O 409203068 VYBDIAMMLGFJGJ-GPILYODUSA-N 405.432 2.738 5 40 HFBB CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)NC1CCCCC1 40127939 CLSJTFUZSYFJQS-UHFFFAOYSA-N 416.434 2.785 5 40 HFBB C[C@]1(CCCO)CCCN1c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] 95455254 IOETUVMIZMNXQB-LJQANCHMSA-N 411.524 2.901 5 40 HFBB Cc1c(NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-] 6200725 MNABDZGTYBKSKM-UHFFFAOYSA-N 403.460 2.943 5 40 HFBB O=[N+]([O-])c1cc(F)ccc1N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 8053511 AYAPIQKVMGZQFI-UHFFFAOYSA-N 405.860 2.960 5 40 HFBB CCOC(=O)N1CCC(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 24470587 LHVMMVMSNMJPBI-UHFFFAOYSA-N 404.467 2.548 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cccc([N+](=O)[O-])c2C)cc1Cl 224965237 CRORCVZNJPWVSG-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB Cc1cccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1[N+](=O)[O-] 3448221 DMEAHSWJDLUFSZ-UHFFFAOYSA-N 417.443 2.738 5 40 HFBB C[C@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10412005 RYWQUIGZYVYWBO-MGPLVRAMSA-N 418.789 2.900 5 40 HFBB COc1ccc(S(=O)(=O)NCc2c(C)nn(-c3ccccc3)c2C)cc1[N+](=O)[O-] 17333884 HMHRQDAXQSMLSN-UHFFFAOYSA-N 416.459 2.884 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1cccc(OC)c1OC 3397278 RAAPICIDKSJRQO-NSHDSACASA-N 404.375 2.805 5 40 HFBB Cc1cc(C)n(CCCNc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])n1 6651441 OXLCCMOKADEBJT-UHFFFAOYSA-N 407.496 2.695 5 40 HFBB C[C@@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)Nc1cccc([N+](=O)[O-])c1 9074164 XNLJAVMDSWJMDH-SNVBAGLBSA-N 401.400 2.823 5 40 HFBB Cc1cccc(N2CCN(CCNc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)c1 31577129 MLMRSLIRLAAMQA-UHFFFAOYSA-N 418.519 2.541 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1ccc(C)cc1C)S(C)(=O)=O 6281791 XMNYVZAXYFVHAB-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB CCOc1ccccc1NC(=O)COC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 8416449 GZPYFBAAYKSBTN-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])s2)cc1 39757170 FGBBVWGVPBZBPB-UHFFFAOYSA-N 407.389 2.822 5 40 HFBB Cc1cccc(CNC(=O)[C@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220394127 GHADMNVFUJTTJM-HNNXBMFYSA-N 405.476 2.683 5 40 HFBB O=C(Nc1ccc(F)cc1[N+](=O)[O-])c1cccn(OCc2ccc(F)cc2)c1=O 4326007 FJHQUNQUVIHUBO-UHFFFAOYSA-N 401.325 2.916 5 40 HFBB COc1ccc([C@H](C)NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420555 NJQVCIYQPGDUTE-KBPBESRZSA-N 421.475 2.635 5 40 HFBB COCCCN1C(=O)S/C(=C\c2cc([N+](=O)[O-])ccc2N2CCOCC2)C1=O 409252434 XUNKJKALGGSLCM-VBKFSLOCSA-N 407.448 2.504 5 40 HFBB COc1cc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)ccc1OC(F)F 10441404 AGRFUBLEWRXGSV-UHFFFAOYSA-N 410.329 2.906 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)[C@@H]1C[C@@H]2[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]12 100204826 LOGYSZUFTVYLIL-XUBKROCYSA-N 403.394 2.769 5 40 HFBB COC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224777695 JKVKMCNYIVGZPE-UHFFFAOYSA-N 408.432 2.589 5 40 HFBB CN(CC(=O)NCCC1=CCCCC1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 6561412 LGLJMXOGCLXNDC-UHFFFAOYSA-N 415.899 2.875 5 40 HFBB COc1ccc(OCCOc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])cc1 9789791 QTKICRHAHJGQGN-UHFFFAOYSA-N 422.459 2.846 5 40 HFBB COC(=O)c1cc(C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)cc([N+](=O)[O-])c1 24943502 RFYNOKVYGDRKMU-UHFFFAOYSA-N 424.413 2.669 5 40 HFBB Cc1ccc(C(=O)COC(=O)[C@@H](C)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C 6033131 ODAOHTVTBBDHEC-CYBMUJFWSA-N 410.382 2.622 5 40 HFBB O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)NCc1ccc(C(=O)N2CCCC2)cc1 21140581 OHMCMIYBHXPVBH-BQYQJAHWSA-N 423.425 2.889 5 40 HFBB CC(C)[C@H](C)NC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 225188558 ZCJTWXBOQFPJLO-HNNXBMFYSA-N 405.476 2.951 5 40 HFBB CCOC(=O)c1sc2ncn3nc(Cn4nc(C)c([N+](=O)[O-])c4C)nc3c2c1C 2791228 ZBGXMKLBLMLPGQ-UHFFFAOYSA-N 415.435 2.594 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)CC(=O)Nc1ccccc1Cl 3352847 AMIOTVVUNFCIHI-UHFFFAOYSA-N 406.826 2.766 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)c1 4569675 QJVCNFGSFNTQRT-SFHVURJKSA-N 417.487 2.795 5 40 HFBB CCOC(=O)N1CCc2c(sc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C(N)=O)C1 9638901 MEPWPUGEJRKDAS-UHFFFAOYSA-N 424.460 2.584 5 40 HFBB NC(=O)c1ccc(N2CCN(Cc3csc(-c4ccco4)n3)CC2)c([N+](=O)[O-])c1 12545713 ASGOSJLWUOPPLG-UHFFFAOYSA-N 413.459 2.732 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 22258647 QTNQDEIYIQSYTM-OAHLLOKOSA-N 403.460 2.943 5 40 HFBB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 36447035 IZMDGDPAKBOVJH-UHFFFAOYSA-N 402.476 2.670 5 40 HFBB COc1ccccc1-n1ccc2nc3ccn(CCCN(C)C)c(=O)c3cc2c1=O 38829035 KMIUJKKAHGYZOP-UHFFFAOYSA-N 404.470 2.661 5 40 HFBB COc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220035690 ANIYNKFSZCEKNA-CQSZACIVSA-N 421.475 2.555 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1cccc(Cl)c1 408672781 ZZCNTDYYRPSREV-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB COc1cc(/C=C2/SC(=O)N(CC(=O)OC(C)C)C2=O)c([N+](=O)[O-])cc1OC 409093582 AWLQOIRWMIKUCU-MKMNVTDBSA-N 410.404 2.600 5 40 HFBB COc1ccc(S(=O)(=O)N2CCN=C2SCc2ccc([N+](=O)[O-])cc2)cc1 2711549 PFWSYMMNKGPFCU-UHFFFAOYSA-N 407.473 2.897 5 40 HFBB CC(C)(C)C(=O)Nc1nnc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Cl)s1 224037845 MOHFRMXLNVGOTI-UHFFFAOYSA-N 419.872 2.885 5 40 HFBB CSc1nn(CN2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c(=S)s1 32932607 XMWDIHHCHCVZMU-UHFFFAOYSA-N 417.563 2.781 5 40 HFBB COc1ccccc1N(C)S(=O)(=O)c1ccc2c(c1)c(=O)nc1cc(C)ccn12 40158665 BBVGCBQWDMBAMW-UHFFFAOYSA-N 409.467 2.990 5 40 HFBB O=C(c1ccccc1Cl)N1CCN(c2ccc(-n3cnnc3)cc2[N+](=O)[O-])CC1 70461898 ZYINNJSLBNGLEM-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB CCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccc(C)cc2)c1=N 100851450 PWIFMPSYRGQJEE-UHFFFAOYSA-N 401.470 2.544 5 40 HFBB CC[C@@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 223795934 YOBQQXJSHKQNRK-QGZVFWFLSA-N 407.448 2.787 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)NC1CCCCCCC1)S(C)(=O)=O 408614852 IWAPZYVRNFFWJS-UHFFFAOYSA-N 413.496 2.599 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCc1cccc(Cl)c1 5845208 YPHDRIVYLVDKRZ-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB Cc1nn(CC(=O)Nc2cc3c(cc2Br)OCCO3)c(C)c1[N+](=O)[O-] 11291506 MKLRSLRFKYSGCQ-UHFFFAOYSA-N 411.212 2.581 5 40 HFBB O=C(NCCNC(=O)c1nc(C2CCCCC2)no1)c1ccc(Cl)c([N+](=O)[O-])c1 21452474 HPZDYGWLDDRCRE-UHFFFAOYSA-N 421.841 2.839 5 40 HFBB CN1CCc2nc3ccccc3c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3)c2C1 25194272 KHHNQAORYDQEBW-UHFFFAOYSA-N 420.425 2.926 5 40 HFBB COc1cc(C(=O)Nc2ccc(N3CCCC3)nc2)c([N+](=O)[O-])c(OC)c1OC 36398809 GMSCFXPVOISCIV-UHFFFAOYSA-N 402.407 2.868 5 40 HFBB CCS(=O)(=O)C(Br)(Br)[C@@H](O)c1ccc([N+](=O)[O-])cc1 96520878 CTQFRYINPOMNPQ-VIFPVBQESA-N 417.075 2.507 5 40 HFBB COC(=O)C1=C(O)[C@H](C(=O)OC)[C@@H]2c3ccccc3[C@H]1[C@@]2(c1ccccc1)[N+](=O)[O-] 100644107 WPDBGDWRNAAKCD-WHEACTPUSA-N 409.394 2.828 5 40 HFBB CCCCCn1/c(=N\C(C)=O)c(C(=O)OCC)cc2c(=O)n3cccc(C)c3nc21 101099220 MCVGZAFNBCCUMZ-ATJXCDBQSA-N 410.474 2.772 5 40 HFBB CN(c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1)S(C)(=O)=O 225736231 JHMXMXNRDBFTTJ-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB COc1cc(NC(=O)COC(=O)c2[nH]c(C)c(C(C)=O)c2C)c(C)cc1[N+](=O)[O-] 6048896 RRSQVLHCWOXXEK-UHFFFAOYSA-N 403.391 2.855 5 40 HFBB Cc1ccc(OCCN(C)C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 12895926 BPUDTXWHCFOZOK-UHFFFAOYSA-N 422.441 2.909 5 40 HFBB CC(=O)N1CCc2cc(NC(=O)c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)ccc21 26902282 KPUQYPCREHDUDW-UHFFFAOYSA-N 410.430 2.593 5 40 HFBB CCCc1nc2c3cc(OC)c(OC)cc3n(Cc3ccc([N+](=O)[O-])cc3)c(=O)n2n1 65535087 QOYKZAZXJAXVFM-UHFFFAOYSA-N 423.429 2.970 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1C 7452560 IKDCQSMMZKFFFS-SFHVURJKSA-N 422.485 2.913 5 40 HFBB CC(C)CCSc1nc(-c2ccc([N+](=O)[O-])cc2)nc2c1c(=O)n(C)c(=O)n2C 4139149 UEGYVQDAENPXKK-UHFFFAOYSA-N 415.475 2.741 5 40 HFBB COC(=O)C1=C(C[S@@](=O)c2ccccc2[N+](=O)[O-])ON(C)[C@@H]1c1ccccc1 5813118 BOHJGMFFFQLPIO-WRHNGFHOSA-N 402.428 2.748 5 40 HFBB COc1ccc(OC)c([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 6052536 LUZZITRFTONOBV-SFHVURJKSA-N 412.402 2.879 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NC[C@H](CO)Cc1ccco1 24205971 ZXHBPMLKIMEMNB-SNVBAGLBSA-N 408.354 2.744 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1 43149612 APAAZJGSFAGIAD-HZPDHXFCSA-N 417.510 2.557 5 40 HFBB CCOc1cc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)cc([N+](=O)[O-])c1O 409009960 CSBQTJBJZMDUON-VGOFMYFVSA-N 401.350 2.931 5 40 HFBB CC1CCN(c2ccc(N3CCN(C(=O)c4cccc([N+](=O)[O-])c4)CC3)nn2)CC1 10213342 PDVLNOAVXDNITH-UHFFFAOYSA-N 410.478 2.584 5 40 HFBB Cc1cc(C)n2c(CNC(=O)c3ccc(N4CCCCC4)c([N+](=O)[O-])c3)nnc2n1 12592084 QLOCBNLIKPXOGC-UHFFFAOYSA-N 409.450 2.570 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 20106227 DIGUKCQFLKOAMK-OAHLLOKOSA-N 405.476 2.855 5 40 HFBB CCc1ccccc1NC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 408668824 VQDCDSRPMOXRLV-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)OCC(=O)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 3503237 VRKTYSBUZSAEPC-UHFFFAOYSA-N 402.384 2.519 5 40 HFBB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC 6052637 DGBOFCPPFRIZFX-GOSISDBHSA-N 412.402 2.879 5 40 HFBB CC(C)N1C(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C(=O)NC1=S 8914146 XBDYUWLGNUAQFB-OXQOHEQNSA-N 416.503 2.538 5 40 HFBB C[C@@H]1C[C@@H](C)CN(CCNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1 36397888 SOKHEIFVUHIISD-HZPDHXFCSA-N 410.540 2.769 5 40 HFBB COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCOCC2)cc(OC)c1OC 41091660 CNKOFDUUCZWTAP-UHFFFAOYSA-N 417.418 2.710 5 40 HFBB CN1CCC(Oc2ccc(CNS(=O)(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 216941343 UXCKQCIVVKMAAR-UHFFFAOYSA-N 405.476 2.546 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cccc([N+](=O)[O-])c2)cc1Cl 224963451 YPUYBGIFGRMUIC-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB C[C@@]1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3456919 MEMJTHWQJSWGID-SFHVURJKSA-N 420.784 2.793 5 40 HFBB COc1ccccc1[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1nccn1C 12583155 YKISLKUVQBEJKC-GOSISDBHSA-N 416.459 2.942 5 40 HFBB O=[N+]([O-])c1ccc(NCCO)c(NS(=O)(=O)c2ccccc2Br)c1 26540684 ZILOFPOEZQGJSP-UHFFFAOYSA-N 416.253 2.562 5 40 HFBB C[C@H]1CCCN(S(=O)(=O)c2ccc(NC[C@@H](C)Cn3cccn3)c([N+](=O)[O-])c2)C1 36390978 PHSLMBGROQDEAL-JKSUJKDBSA-N 421.523 2.960 5 40 HFBB Nn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1Cl 4315812 GDQIREHBBTWGBD-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB CC(=O)Oc1c(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)nn1-c1ccccc1 4907646 TYRQXYSURVWRPU-UHFFFAOYSA-N 401.400 2.847 5 40 HFBB CCOc1ccc2nc(COC(=O)c3cccc([N+](=O)[O-])c3)c(C(C)=O)[n+]([O-])c2c1 5530808 UHOYTUNXFDHPFQ-UHFFFAOYSA-N 411.370 2.735 5 40 HFBB O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CCN(c2cccc(Cl)c2)CC1 12528196 YBOQZPGGYWKXBW-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB Cc1ccc(O)c(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 17090585 PCUHGNTZRGWMNW-UHFFFAOYSA-N 416.459 2.572 5 40 HFBB CCn1cc(S(=O)(=O)N(Cc2cccc(C)c2)Cc2ccccn2)c([N+](=O)[O-])n1 83843354 BPOBKXXKXWBCKF-UHFFFAOYSA-N 415.475 2.906 5 40 HFBB Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c1 9227140 ISJKIJUDUVORPD-UHFFFAOYSA-N 403.460 2.943 5 40 HFBB CS(=O)(=O)c1ccc(NCCNC(=O)C2C3CC4CC(C3)CC2C4)c([N+](=O)[O-])c1 40013082 VBVJOUIZTKDQMR-UHFFFAOYSA-N 421.519 2.599 5 40 HFBB COc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1[N+](=O)[O-] 12652369 PHKNUGCPFCVZRW-UHFFFAOYSA-N 405.432 2.839 5 40 HFBB COCCCN1C(=O)[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)n2c1nc1ccccc12 39963986 DICATJKDCJJENX-GOSISDBHSA-N 423.429 2.898 5 40 HFBB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@@H](c1cccc([N+](=O)[O-])c1)N=2 408731591 LZQVOQAJZLHMDM-XBNGYDHASA-N 415.471 2.567 5 40 HFBB O=C(O)C1(C(=O)O)Cc2c(ccc([N+](=O)[O-])c2N2CCCCC2)N2CCCC[C@@H]21 6662770 MFNGEUALTRTGRM-MRXNPFEDSA-N 403.435 2.656 5 40 HFBB CCNC(=O)c1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1OC 10008954 LIFKRRYIEWJNDL-UHFFFAOYSA-N 413.839 2.807 5 40 HFBB CN(C)[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1Cl 23192435 CFMHPTKVBMGYSU-SFHVURJKSA-N 414.853 2.862 5 40 HFBB COc1ccc(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)cc1 218255514 ZGVVOCFHLUPJCT-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB COc1ccc(-c2nnc(SCC(=O)Nc3ccc(O)c([N+](=O)[O-])c3)n2C)cc1 409150769 DPGWKXIOLOOFDQ-UHFFFAOYSA-N 415.431 2.835 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@H](C)CCc1ccccc1)S(C)(=O)=O 10329136 IIKWNHMRUMMDCY-MRXNPFEDSA-N 419.503 2.807 5 40 HFBB COCCNc1ccc(C(=O)N2CCc3cc(OC)c(OC)cc3C2)cc1[N+](=O)[O-] 17064936 UYULPRSNFLVOJZ-UHFFFAOYSA-N 415.446 2.869 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17082332 KEODIMDTAMQUIH-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB O=c1c2cc(Cl)ccc2nc(CN2CCOCC2)n1-c1ccc([N+](=O)[O-])cc1 19286063 OPRKKIJDKFJYAU-UHFFFAOYSA-N 400.822 2.780 5 40 HFBB COc1ccc(NC(=O)[C@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 220380387 JRWNSRPSBMKHOO-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CNC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc1 12779645 KDGOTIWOYRGJFM-UHFFFAOYSA-N 417.487 2.925 5 40 HFBB O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 52410735 DDKAFZUUYYRMJZ-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB COc1cc(-c2nnc(Cn3cc([N+](=O)[O-])cc(Cl)c3=O)o2)cc(OC)c1OC 78824052 SQXRUMSGCCFFBM-UHFFFAOYSA-N 422.781 2.534 5 40 HFBB O=C(CNC(=O)c1ccc(Br)cc1)OCC(=O)c1cccc([N+](=O)[O-])c1 1853209 OTFMHUGJIQIMEE-UHFFFAOYSA-N 421.203 2.513 5 40 HFBB O=C(Cc1ccccc1)NN1C(=O)c2cc([N+](=O)[O-])cc3cc([N+](=O)[O-])cc(c23)C1=O 3067055 LDRFNHOKLHLPDO-UHFFFAOYSA-N 420.337 2.526 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(NC(C)=O)cc1 3250309 KIQZPNAXBMWFDN-NSHDSACASA-N 401.375 2.746 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)cc1[N+](=O)[O-] 17089585 LHLFGNFPZCGIAF-UHFFFAOYSA-N 413.503 2.782 5 40 HFBB C[C@H]1CCC[C@@H](C(=O)NS(=O)(=O)c2cc([N+](=O)[O-])c(N)cc2Br)C1 72310845 DJCOUONVKQPQFP-DTWKUNHWSA-N 420.285 2.571 5 40 HFBB O=C1[C@H]2[C@H](C(=O)N1c1cccc([N+](=O)[O-])c1)N1CCCN1[C@H]2c1ccc(Cl)cc1 102681499 PSIPYZBNSNOTQZ-FGTMMUONSA-N 412.833 2.784 5 40 HFBB C[C@H](C(=O)NCc1ccc(Cl)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220404805 DJQXHVPZPJIYRS-GFCCVEGCSA-N 411.867 2.719 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(OC)c(C)c1 224653558 ISXJGXRTLOSNOW-UHFFFAOYSA-N 422.459 2.979 5 40 HFBB Cc1cccc(-n2ncc3c(=O)n(CC(=O)Nc4ccc([N+](=O)[O-])cc4)cnc32)c1C 12237801 QHKBMKKYWIFERB-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(C(=O)/C=C/c2ccsc2)CC1 12983123 WGTWJHHUMWOFER-HWKANZROSA-N 421.500 2.511 5 40 HFBB O=C([C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)N1CCCCCCC1 40060218 ZQWQJTARGYQNCX-GOSISDBHSA-N 409.508 2.931 5 40 HFBB C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 40080427 ZUXDIDREFIMEAG-LLVKDONJSA-N 402.432 2.708 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)N1CCc2ccccc2C1)S(C)(=O)=O 220382891 MGTUCDJIPIVZOO-HNNXBMFYSA-N 417.487 2.643 5 40 HFBB Cn1c2c(c(=O)n(C)c1=O)[C@@H](c1cc([N+](=O)[O-])ccc1Cl)Nc1ccccc1O2 2322979 AWNNIEDOKBWDMF-MRXNPFEDSA-N 414.805 2.953 5 40 HFBB Cc1cc(C)cc(C(=O)NCC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1 3321019 IRFSYGFJXKHDJI-UHFFFAOYSA-N 400.387 2.551 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCCc1nnc2ccccn12 9672751 HCTILWWANJPYQQ-UHFFFAOYSA-N 415.353 2.586 5 40 HFBB Cc1ccc(C(=O)O)cc1NC(=S)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 16347679 SSCRFYCQQXYVNS-UHFFFAOYSA-N 404.360 2.636 5 40 HFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1 30847868 MQRFOVBJXHIAOS-UHFFFAOYSA-N 412.427 2.972 5 40 HFBB CC1CCN(C(=O)/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)n2ccccc2=O)CC1 8983701 GVZISROGOOMQOK-LICLKQGHSA-N 411.414 2.742 5 40 HFBB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 20457212 UFIVJKMUVKGDPH-IZZDOVSWSA-N 419.459 2.942 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N12 4311562 RCHZZIMMUJUXMH-UAFMIMERSA-N 403.394 2.574 5 40 HFBB Cc1cccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)c1 12421630 XUNJDXMAHMHPNL-IRXDYDNUSA-N 403.485 2.680 5 40 HFBB C[C@@H](Nc1ccc(N2CCCS2(=O)=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 40050827 PINWCGIRQDDPEG-CYBMUJFWSA-N 404.448 2.574 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(N(CCOC)Cc2cccnc2)c([N+](=O)[O-])c1 84773625 NFQRWFBOPQJDMH-UHFFFAOYSA-N 422.507 2.673 5 40 HFBB C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCCO)C(=O)Nc1ccc(Cl)cc1 6465381 AYFGJZLUIYJORQ-NSHDSACASA-N 407.810 2.836 5 40 HFBB C[C@H]1CCCCN1c1ccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)nn1 10213330 GNMRKOSJNFGCAD-INIZCTEOSA-N 410.478 2.726 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 19930722 DYIQMDYVOWDSCJ-UHFFFAOYSA-N 403.460 2.915 5 40 HFBB Cc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1C 22348301 PHLJSLHFTJIWBT-HNNXBMFYSA-N 405.476 2.855 5 40 HFBB CCOc1ccc(OCC)c(NC(=O)CNc2cc([N+](=O)[O-])ccc2NCCO)c1 22729999 RWADELHEMWDWDP-UHFFFAOYSA-N 418.450 2.847 5 40 HFBB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)COC(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)C2 104859532 XZMFSGAQVLGXAZ-QUGJLEDBSA-N 404.419 2.811 5 40 HFBB COC1(c2nc(CC(F)(F)F)no2)CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 566810749 RQKCEFNHFJZITR-UHFFFAOYSA-N 414.340 2.861 5 40 HFBB Cc1ccc(C(=O)NC[C@@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 2752861 FRNBGHBXCTWTOY-CYBMUJFWSA-N 400.391 2.668 5 40 HFBB COc1ccc(NC(=O)COC(=O)CCCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8413037 VOIVFJLWXUIOEI-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB CC[C@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(OC)cc1 22348308 CSNGUMDSCXWUTL-SFHVURJKSA-N 421.475 2.637 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])c1 40156374 DHIXIPUYYWUICK-AWEZNQCLSA-N 423.495 2.701 5 40 HFBB CON(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N(C)CCOc1cccc(C)c1 72307835 ILUOCPMEGIBGOG-UHFFFAOYSA-N 409.464 2.600 5 40 HFBB CC(=O)[C@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N21 103631130 RCHZZIMMUJUXMH-WTGUMLROSA-N 403.394 2.574 5 40 HFBB Cc1c(N(CC(=O)N[C@H]2CCCc3ccccc32)S(C)(=O)=O)cccc1[N+](=O)[O-] 220035577 WCLMDZNBGGVXDH-KRWDZBQOSA-N 417.487 2.863 5 40 HFBB CC[C@H](C(=O)NCc1ccc(F)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222528683 YBKBTQCVDPXHNG-QGZVFWFLSA-N 409.439 2.595 5 40 HFBB CCN(CC)C[C@H](O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(C)cc1 1900870 IURCDXBVRVEDOC-IBGZPJMESA-N 421.519 2.801 5 40 HFBB COC(=O)c1cc(C(=O)OCC(=O)N(c2ccccc2)C(C)C)cc([N+](=O)[O-])c1 3285711 QJOTZJROXANJJV-UHFFFAOYSA-N 400.387 2.980 5 40 HFBB COC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225085268 QFHFXFBIFSCPJE-UHFFFAOYSA-N 400.359 2.550 5 40 HFBB Cc1cccc(-n2ncc3c(=O)n(CC(=O)Nc4cccc([N+](=O)[O-])c4)cnc32)c1C 12237799 OTUMOYMMJWDPRB-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB Cc1c(NC(=O)CN2CCC(C(=O)N3CCCCCC3)CC2)cccc1[N+](=O)[O-] 12993563 MMNCPQJCGZCLLR-UHFFFAOYSA-N 402.495 2.956 5 40 HFBB COC(=O)c1cc(C(=O)OCc2ccc(C(=O)N3CCCC3)cc2)cc([N+](=O)[O-])c1 25697296 BAEBAXLTMYCGIQ-UHFFFAOYSA-N 412.398 2.974 5 40 HFBB CN(c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H]1CCc2ccccc21 12528280 JWHQRRNLKVXCSK-SFHVURJKSA-N 417.487 2.739 5 40 HFBB COc1cc([N+](=O)[O-])cc2sc(NC(=O)CS(=O)(=O)c3ccccc3)nc12 15391521 HSJCUXSJQQRJPR-UHFFFAOYSA-N 407.429 2.626 5 40 HFBB Nc1nc(NCc2ccccc2)nc(N2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] 54147607 SHLGRJCPQSNGJV-UHFFFAOYSA-N 419.489 2.901 5 40 HFBB CC(=O)N1N=C(c2ccc(NS(C)(=O)=O)cc2)C[C@H]1c1cccc([N+](=O)[O-])c1 4036016 SPNRAGFJKFQHMN-SFHVURJKSA-N 402.432 2.664 5 40 HFBB Cc1ccc(NC(=O)COC(=O)COc2ccc3ccc(=O)oc3c2)cc1[N+](=O)[O-] 6946155 RNAJPFRKAJSQHF-UHFFFAOYSA-N 412.354 2.570 5 40 HFBB COc1cc(C(=O)OCc2cc(=O)n3ccccc3n2)c([N+](=O)[O-])cc1OC(F)F 10275322 XCZXTFKLHNXUJX-UHFFFAOYSA-N 421.312 2.570 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N1c2ccccc2C[C@@H]1C)S(C)(=O)=O 10449932 CFCVHEYLTDNKRR-AWEZNQCLSA-N 403.460 2.647 5 40 HFBB COC(=O)c1cc(C(=O)Nc2nc(C)c(-c3nccn3C)s2)cc([N+](=O)[O-])c1 12576086 KDHNYJVBJQTWLC-UHFFFAOYSA-N 401.404 2.799 5 40 HFBB O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@H]2C(=O)N1c1cccc(Br)c1 101023005 FIEBQJVMPZGUTK-HIFRSBDPSA-N 416.187 2.650 5 40 HFBB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C1(c2ccc([N+](=O)[O-])cc2)CC1 225990188 KMSXUDOTWLUTGO-UHFFFAOYSA-N 403.460 2.824 5 40 HFBB NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 5603321 FKFJWYPXPIUVGU-SFHVURJKSA-N 400.435 2.957 5 40 HFBB COc1cc(OCC(=O)N2CCN(c3cccc(Cl)c3)CC2)ccc1[N+](=O)[O-] 66013804 DBGLVEHRISTEBM-UHFFFAOYSA-N 405.838 2.984 5 40 HFBB COC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OC)c(Cl)c1 224963392 HVKNCILKTBEMRQ-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@H]1c1cccc([N+](=O)[O-])c1 9667265 KIWFKUGDJPKNEV-KRWDZBQOSA-N 407.390 2.518 5 40 HFBB O=C(CSc1nnnn1-c1ccc(O)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 3446671 ZXLFXKHQRBUEHB-UHFFFAOYSA-N 406.811 2.660 5 40 HFBB CC(=O)[C@H](C(=O)OC(C)C)C(c1cccc([N+](=O)[O-])c1)[C@H](C(C)=O)C(=O)OC(C)C 5381323 DPHUMJWVOASNEI-ROUUACIJSA-N 421.446 2.992 5 40 HFBB Cc1ccc(NC(=O)C(=O)N2CCN(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 10327509 MNTGJIRKHMCBFV-UHFFFAOYSA-N 402.838 2.844 5 40 HFBB CC(=O)c1ccc(N2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)cc1 5689854 VKDGABIFGLRUGD-UHFFFAOYSA-N 403.460 2.528 5 40 HFBB CC(C)[C@H]1CN(C)CCN1c1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] 78824960 RJMNBONACNGXKG-HXUWFJFHSA-N 424.567 2.936 5 40 HFBB CCN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2ccccc2)CC1 4498925 CGCUZGFZRFEGFJ-UHFFFAOYSA-N 418.519 2.952 5 40 HFBB CCc1c(C)[nH]c(-n2nc(C)cc2NC(=O)c2cc([N+](=O)[O-])ccc2Cl)nc1=O 7421959 KFYIXDIVTYHDQT-UHFFFAOYSA-N 416.825 2.949 5 40 HFBB CC(=O)c1ccccc1OCCOC(=O)[C@H](C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 12851802 MLEARAOVTGBKQA-AWEZNQCLSA-N 421.427 2.582 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@@H](C)c1ccc(C)cc1)S(C)(=O)=O 20041026 AEIRXEGQQLBOFC-AWEZNQCLSA-N 421.475 2.555 5 40 HFBB CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2)sc2c1CCN(C(C)=O)C2 4281144 OFOYFWVOCFTWEI-UHFFFAOYSA-N 417.443 2.990 5 40 HFBB O=[N+]([O-])c1cc(Cl)ccc1NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 9934619 AIOOVPZTXOULAK-UHFFFAOYSA-N 400.800 2.547 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@@H](c2ccccc2F)n2nnnc2N3)c1 10296565 CDJCQUFSPMKPGJ-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB CCn1c(C)cc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1C 24768985 VIOBPNWGUANZJQ-UHFFFAOYSA-N 415.446 2.909 5 40 HFBB Cc1ccc(CN(CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)cc1 225648167 BFRUNSXDYBLIAI-UHFFFAOYSA-N 411.867 2.957 5 40 HFBB COc1ccc(OCC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 12773085 WZPYVJQDMBTXRB-UHFFFAOYSA-N 419.865 2.980 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)c1C 12982817 TVCNNNDRMSHHKF-UHFFFAOYSA-N 403.460 2.664 5 40 HFBB CCCC(=O)NC(=S)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 16636947 ZOQNMTNZQFSHRZ-UHFFFAOYSA-N 404.414 2.937 5 40 HFBB C[C@H](c1nc(N)nc(Nc2ccccc2)n1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 24716658 VNGVZKZWSBVHJG-OAHLLOKOSA-N 420.477 2.989 5 40 HFBB CCc1cccc(N2C[C@@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)c1 24864490 HTDFAWDQPCYOLA-SFHVURJKSA-N 422.485 2.859 5 40 HFBB O=C(Nc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1)[C@H]1CCCO1 32909274 JLNHPUHCFNDQPZ-HXUWFJFHSA-N 424.457 2.675 5 40 HFBB CN(C)c1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl)n(C)c(=O)n2C 408526199 AHJSXVUYZSJBCC-UHFFFAOYSA-N 403.826 2.757 5 40 HFBB CCC(=O)N1CCN(c2ccc(NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)cc2)CC1 4120502 NQGGEGWGWXTSCP-UHFFFAOYSA-N 412.446 2.914 5 40 HFBB COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 6552967 GRYHASUWPSQGEO-NSHDSACASA-N 404.375 2.805 5 40 HFBB COc1cc(C)c(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1OC 14712468 ITLLUUWNLZPYEK-UHFFFAOYSA-N 414.462 2.925 5 40 HFBB NC(=O)c1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 23045995 KPTSKABPOKOHDH-UHFFFAOYSA-N 411.292 2.508 5 40 HFBB COc1cc(OC)cc([C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])c2nccn2C)c1 24021505 MOWCKVBVNCAMMB-HXUWFJFHSA-N 410.430 2.794 5 40 HFBB Nn1c(SCc2ccccc2Cl)nnc(Nc2ccc([N+](=O)[O-])cc2)c1=O 28536245 JKTXQSSMGRQTBK-UHFFFAOYSA-N 404.839 2.950 5 40 HFBB CCOc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 4393696 CXVXYZHGNMMEJP-MSOLQXFVSA-N 417.443 2.606 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccccc1[N+](=O)[O-] 10326037 IYMXCASNMXEDJU-HNNXBMFYSA-N 407.382 2.694 5 40 HFBB COc1ccc(OC)c(CN2CCN(Cc3cc([N+](=O)[O-])ccc3OC)CC2)c1 12909964 NFOYCVGGUJBOCI-UHFFFAOYSA-N 401.463 2.938 5 40 HFBB CCN(CC)P(=O)(c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])N(CC)CC 102971573 BTISBJICYOIVSA-UHFFFAOYSA-N 403.332 2.913 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CCCN(C)S(=O)(=O)c1ccccc1 219715876 IKZWKWYSKWCNBZ-UHFFFAOYSA-N 407.448 2.643 5 40 HFBB CCN(c1cc(OC)c(OC)cc1C(=O)OC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225040740 LMGXJQPVBRNRAQ-UHFFFAOYSA-N 424.431 2.614 5 40 HFBB CCOc1cc2c(cc1/C=C1/NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C1=O)OCO2 409084129 BKWSTRCWJOSVLN-VIZOYTHASA-N 411.370 2.815 5 40 HFBB CCOP(=O)(OCC)c1nc(-c2cccc([N+](=O)[O-])c2)oc1N1CCOCC1 8868904 XWYYUGVLNLJORP-UHFFFAOYSA-N 411.351 2.978 5 40 HFBB CCn1nc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c2ccccc2c1=O 10964690 MHBUAYSPSVPSPP-UHFFFAOYSA-N 410.386 2.738 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1 14022787 PASQRSICPFHWQQ-HNNXBMFYSA-N 403.460 2.943 5 40 HFBB O=C(c1ccccc1Cl)N1CCN(c2ccc([N+](=O)[O-])cc2-n2cnnc2)CC1 70461851 KCJGPVKUTUWOPM-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB COC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225088599 ZKOZWSDRMRJKGL-UHFFFAOYSA-N 400.359 2.550 5 40 HFBB COc1ccc(NC(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8416546 DAUUHMINRQCSAQ-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC(Nc3nc4ccccn4c3[N+](=O)[O-])CC2)cc1 22319409 RWAWEMHWHJFCBH-UHFFFAOYSA-N 415.475 2.816 5 40 HFBB Nc1c(-c2ccccn2)nsc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 49007860 WBTSRRGKLKJIFB-UHFFFAOYSA-N 410.459 2.658 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)Nc1cccc([N+](=O)[O-])c1 408653219 DOCPVPJNYXEJSH-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(N3CCCCCC3)nn2)CC1 4583310 SVDAETCOLXWFNQ-UHFFFAOYSA-N 410.478 2.728 5 40 HFBB CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1 7881410 QKAHBCZKTZMBLJ-HNNXBMFYSA-N 412.398 2.773 5 40 HFBB C[C@H]1CN(C(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 12523925 UAZBWNRZXRLKPE-OKILXGFUSA-N 419.459 2.645 5 40 HFBB COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(N(C)S(C)(=O)=O)cc1OC 22251398 MXKKVLRUEBQRHC-UHFFFAOYSA-N 423.447 2.569 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCCCc1ccc(F)cc1)S(C)(=O)=O 22374765 CWICVPBSSQHKJR-UHFFFAOYSA-N 423.466 2.557 5 40 HFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1ccc(S(=O)(=O)N2CCCC2)cc1 40119352 LOSMHUYSOKBDEO-FMIVXFBMSA-N 415.471 2.709 5 40 HFBB COc1ccc(NC(=O)COC(=O)/C=C/c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 4836435 QGSVTGPNKWMWFV-XVNBXDOJSA-N 400.343 2.527 5 40 HFBB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1 5523327 OFTFTNBLYYCTGU-SFHVURJKSA-N 412.402 2.879 5 40 HFBB O=C(O)c1ccccc1SCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 12562934 BDKBGAITXAFULG-UHFFFAOYSA-N 401.444 2.734 5 40 HFBB O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CN(Cc1cccs1)C[C@H]1CCCO1 14230833 AKJZTRMTLIIOAZ-CYBMUJFWSA-N 401.444 2.891 5 40 HFBB CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 16692317 BAHFSDGGPCKDHP-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccccc1 35593239 RXNTVGOPCCYPSL-HNNXBMFYSA-N 404.492 2.704 5 40 HFBB CC(=O)[C@H](Cc1ccccc1)NC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl 57373616 BYBVQTQGZWHHIR-IBGZPJMESA-N 403.866 2.997 5 40 HFBB CCN1C[C@H](CN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)Oc2ccccc21 95428522 SEOKBTONWOFXIW-AWEZNQCLSA-N 413.430 2.726 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(NC(C)=O)cc1 3250311 KIQZPNAXBMWFDN-LLVKDONJSA-N 401.375 2.746 5 40 HFBB O=C(NCCCO)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1Cl 4652693 MBNQIPCSMZZMCZ-ATVHPVEESA-N 403.822 2.518 5 40 HFBB COc1cc(/C=C/C(=O)OCC(=O)Nc2cc(OC)c([N+](=O)[O-])cc2C)ccc1O 4916966 RZHLABYPLCGFSW-FNORWQNLSA-N 416.386 2.821 5 40 HFBB O=c1c2cc(Br)ccc2ncn1Cc1cc([N+](=O)[O-])cc2c1OCOC2 9049355 ALOPCIVGSMOZRK-UHFFFAOYSA-N 418.203 2.982 5 40 HFBB CN(Cc1ccccc1)C(=O)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 57672183 VDZLEQAIVRFNIC-UHFFFAOYSA-N 419.485 2.924 5 40 HFBB COC(=O)c1cc(C(=O)NCCc2nc3cc(Cl)ccc3n2C)cc([N+](=O)[O-])c1 72275334 GAZITEHTMFVVJD-UHFFFAOYSA-N 416.821 2.894 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1C 408662683 PERTVWQTLBTZRU-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 4393685 ZFCSVHCGHLXAAN-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB Nc1nc(N2CCCCCC2)nc(N2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] 54147592 UEEUPVDZIKDTER-UHFFFAOYSA-N 411.510 2.670 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220411624 LIXCEVSOTPINGL-GFCCVEGCSA-N 422.419 2.605 5 40 HFBB CCCOc1ccc(N(CC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 22390040 JONPVNCQPWWYSF-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1ccccc1CN1CCOCC1 24379720 JLMNZBMWXWMZHW-UHFFFAOYSA-N 412.490 2.936 5 40 HFBB CC1(C)Cc2cccc(OCCNC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)c2O1 24450273 BTCNGUJHSAZICU-UHFFFAOYSA-N 423.429 2.698 5 40 HFBB O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 33097668 HAEBKBLSTOAFFT-AWEZNQCLSA-N 412.233 2.728 5 40 HFBB CCN1C(=O)[C@@H]2[C@@H](C(=O)c3ccc([N+](=O)[O-])cc3)N3C=Cc4ccccc4[C@H]3[C@@H]2C1=O 33892624 LFBANCJFDNIJKX-FYQPLNBISA-N 417.421 2.808 5 40 HFBB biogenic CCOc1ccc(C(=O)NC(=S)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 408629109 ZLISRAHEKWVSGV-UHFFFAOYSA-N 403.416 2.892 5 40 HFBB CC(C)n1nccc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 5972348 CGRAWBLFTWCSQK-UHFFFAOYSA-N 401.423 2.768 5 40 HFBB CCOc1ccc(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 6355212 WFWHFAIBROBTRS-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@H](c2cccc(F)c2)n2nnnc2N3)c1 10296561 FBOQLLNKHJHYMW-INIZCTEOSA-N 406.337 2.578 5 40 HFBB Cc1cccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 17081871 BJIXZSFISFEYRT-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB CCCn1c(=N)c(C(=O)NCCc2ccccc2)cc2c(=O)n3cccc(C)c3nc21 100627813 BSLYDXWGCOMCGO-UHFFFAOYSA-N 415.497 2.820 5 40 HFBB Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)n1 1738639 OISWWUKDOPPBEP-UHFFFAOYSA-N 413.415 2.746 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 4071189 IQURNYGYDPXFBP-UHFFFAOYSA-N 407.448 2.886 5 40 HFBB COc1ccc(C)cc1N(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 6472981 DLKNBQNSKDDXLY-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB CCn1nc(C(=O)OCC(=O)Nc2cc(C)c(C)cc2[N+](=O)[O-])c2ccccc2c1=O 9612707 RNQXRWUTSHBEKI-UHFFFAOYSA-N 424.413 2.737 5 40 HFBB CC(=O)Oc1cn(CCCN2CCOCC2)c2nc(C)n3c4ccccc4nc3c12 20403659 HTICWFDELSKNCX-UHFFFAOYSA-N 407.474 2.793 5 40 HFBB CN1CCC(Oc2ccc(CNS(=O)(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CC1 217029363 MNLYQXBPAMUJTQ-UHFFFAOYSA-N 419.503 2.687 5 40 HFBB O=C(NCCSc1nc(-c2ccccc2)c[nH]1)C(=O)Nc1cccc([N+](=O)[O-])c1 4315966 QSJRPQHEHXGMJJ-UHFFFAOYSA-N 411.443 2.832 5 40 HFBB C[C@H](OC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)C(=O)Nc1ccccc1[N+](=O)[O-] 8760521 JLKPTUHKOONACC-GOEBONIOSA-N 411.414 2.514 5 40 HFBB C[C@H]1CCCN(S(=O)(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 27959687 LOQFYFMUDFNYBF-NSHDSACASA-N 410.418 2.592 5 40 HFBB COc1ccc(C(=O)CN2C(=O)c3ccccc3O[C@@H](C(C)C)C2=O)cc1[N+](=O)[O-] 6757092 LMYPNZPABJMDJB-IBGZPJMESA-N 412.398 2.872 5 40 HFBB CN(C)CCCNS(=O)(=O)c1ccc(NCc2ccccc2F)c([N+](=O)[O-])c1 6831343 VDXDAQFGPRXEDI-UHFFFAOYSA-N 410.471 2.576 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 8038716 AYSFSQKKQBRSPO-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB Cc1cc(C)cc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1 8433885 FIDWZCNLUUJZJZ-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB O=C(COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)Nc1ccc(F)cc1Cl 9506848 YVVXQMAIEWMTAR-UHFFFAOYSA-N 419.756 2.764 5 40 HFBB O=C(Nc1cccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)c1)c1ccco1 12521010 BPJAZXQPLJECHB-UHFFFAOYSA-N 403.372 2.947 5 40 HFBB O=c1c(Cl)c(N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)cnn1-c1ccccc1 22803767 ISVOJSLAZAKVEJ-UHFFFAOYSA-N 412.837 2.516 5 40 HFBB CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc([N+](=O)[O-])c1 23270415 PLEVPEIJAJDTOI-UHFFFAOYSA-N 422.397 2.988 5 40 HFBB COc1cc(C(=O)OCc2cc(=O)n3cc(Cl)ccc3n2)c([N+](=O)[O-])cc1OC 26718159 NMVWAZJBWHYDRS-UHFFFAOYSA-N 419.777 2.630 5 40 HFBB COC(=O)c1cc(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)cc([N+](=O)[O-])c1 72303152 FHZWQEWOEBQEAX-GOSISDBHSA-N 408.414 2.829 5 40 HFBB Cc1ccc(Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])cc1C 89643227 ZNNVORCARQMMCN-UHFFFAOYSA-N 404.492 2.891 5 40 HFBB CCOCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C[C@@H]1CCCO1 2392941 BGVYWHVBZVPGPI-HNNXBMFYSA-N 407.474 2.900 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 12139890 DXBNEPDFCBIQJD-KEYYUXOJSA-N 409.320 2.699 5 40 HFBB Cc1nc2ccccc2nc1COC(=O)[C@H](C)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 12904036 BZFAKVSGSYNTEC-LBPRGKRZSA-N 420.381 2.574 5 40 HFBB CNc1ccc([N+](=O)[O-])cc1-n1cc2c(c1-c1ccccc1)c(=O)n(C)c(=O)n2C 4995324 ZLFUOINEVKHWAN-UHFFFAOYSA-N 405.414 2.645 5 40 HFBB COc1ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc1OCc1ccccc1F 6761987 RWMWVSNZQGGNSQ-SOFGYWHQSA-N 413.361 2.869 5 40 HFBB CCc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 8064220 NVWABKGLXPPOSJ-QZTJIDSGSA-N 401.444 2.769 5 40 HFBB Cn1/c(=N\C(=O)CCS(=O)(=O)c2ccc(F)cc2)sc2cc([N+](=O)[O-])ccc21 12237958 AXBYWVZTHQLCPH-HTXNQAPBSA-N 423.447 2.578 5 40 HFBB Cc1cc(N2CCN(c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])CC2)nc(C(C)C)n1 15117776 MQRBMVQQKZDGAY-UHFFFAOYSA-N 419.507 2.547 5 40 HFBB COC(=O)c1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1OC 32999551 RNDKOUGRNICXNG-UHFFFAOYSA-N 413.430 2.920 5 40 HFBB Nc1nc(SCc2ccc([N+](=O)[O-])cc2)[nH]c(=O)c1NC(=O)c1ccccc1F 9518100 VKHZQXSWHHRSSR-UHFFFAOYSA-N 415.406 2.944 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CCN(C(=O)CC3CCCC3)CC2)c1C 12972353 FLOYQGHLERNDIP-UHFFFAOYSA-N 409.508 2.625 5 40 HFBB CC(C)Oc1ccccc1CN1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 40156904 YNCDVXATWQLKBE-UHFFFAOYSA-N 419.503 2.889 5 40 HFBB CCSc1n[nH]c(-n2ccc3nc4ccn(-c5ccccc5)c(=O)c4cc3c2=O)n1 40398932 BHCTUZJFTRSGON-UHFFFAOYSA-N 416.466 2.920 5 40 HFBB O=C(Nc1ncc([N+](=O)[O-])s1)c1cc(I)cc([N+](=O)[O-])c1 4015651 BMGFKFVJLVSGEK-UHFFFAOYSA-N 420.144 2.816 5 40 HFBB COc1cc(C(=O)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc(OC)c1OC 20410790 MEPYAWOBIBXWPB-UHFFFAOYSA-N 417.418 2.710 5 40 HFBB COc1ccccc1NC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(O)c([N+](=O)[O-])c1 33912067 AFQVGTGXKPJKNQ-SFHVURJKSA-N 422.401 2.828 5 40 HFBB Cc1cc(C(=O)NCC(=O)N2CCN(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] 3420247 IGHOPMOOEMISOA-UHFFFAOYSA-N 416.865 2.635 5 40 HFBB O=c1c2cccnc2n(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1Cc1ccc(F)cc1 5055077 MUJXWCTZGUEEBP-UHFFFAOYSA-N 406.373 2.702 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)Cc1ccc2c(c1)OCCO2 8225925 NPMXSLWGWRMKJN-ZDUSSCGKSA-N 401.419 2.834 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8626363 XJCSWNXGBBLROA-AWEZNQCLSA-N 420.443 2.637 5 40 HFBB CS(=O)(=O)c1ccc(-c2nnc(NC(=O)/C=C/c3cccc([N+](=O)[O-])c3)o2)cc1 9707662 AUXUSAABEHDYGC-BJMVGYQFSA-N 414.399 2.700 5 40 HFBB COc1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 30899821 XOEDFGGKCUZXJD-UHFFFAOYSA-N 403.822 2.855 5 40 HFBB C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 72289461 OXAFCBMYWYBLBH-CQSZACIVSA-N 415.425 2.911 5 40 HFBB CCNC(=O)[C@@H](C)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 8349059 TZTZBFJVTQVPRH-OAHLLOKOSA-N 421.457 2.631 5 40 HFBB COc1cc(Cl)c(C)cc1NC(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 25259594 YUUIYPNKMBSTAN-UHFFFAOYSA-N 407.810 2.942 5 40 HFBB Cc1c(C(=O)NC(=S)Nc2ccccc2N2CCOCC2)cccc1[N+](=O)[O-] 32115136 MEPQDKWITNMKMI-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB CCOC(=O)CN(CCOC)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 40139174 VYWXURPVHQNIIB-UHFFFAOYSA-N 401.419 2.990 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)c2cc(C)n(C)c2C)c([N+](=O)[O-])c1 4564818 WSZVQGIYOYEHAP-UHFFFAOYSA-N 423.491 2.842 5 40 HFBB Cc1cc(C(=O)NCCCNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1[N+](=O)[O-] 6271056 JOHLZKQNOAOKKC-UHFFFAOYSA-N 400.391 2.670 5 40 HFBB CCn1c(=N)c(C(=O)NCc2ccc(C)cc2)cc2c(=O)n3cccc(C)c3nc21 100861126 WVIWSTJPUMXMPF-UHFFFAOYSA-N 401.470 2.695 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225035107 GOHBJPRMIGIRFU-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@H](C)Oc1ccccc1[N+](=O)[O-] 7777445 BEVACMACDIVIJJ-ZDUSSCGKSA-N 407.448 2.560 5 40 HFBB CC(=O)Nc1ccc(NC(=O)c2cccn(OCc3cccc([N+](=O)[O-])c3)c2=O)cc1 16890484 LYEBDKUXRFBCHB-UHFFFAOYSA-N 422.397 2.596 5 40 HFBB CC1CCC(NS(=O)(=O)c2ccc(NCCN3CCCC3)c([N+](=O)[O-])c2)CC1 7187834 ZYJCETKBLZLVJA-UHFFFAOYSA-N 410.540 2.960 5 40 HFBB O=C1C[C@H](c2cccc([N+](=O)[O-])c2)[C@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 12559211 IKZBGIQAPPMHCZ-KYJSFNMBSA-N 408.332 2.948 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)Nc1cc(C(C)(C)C)no1 18025787 RYMHEODCNHUYBQ-UHFFFAOYSA-N 420.422 2.734 5 40 HFBB O=C(C1CCN(c2ccc([N+](=O)[O-])cn2)CC1)N1CCN(Cc2ccccc2)CC1 20649907 KDILOVSCIQSSHX-UHFFFAOYSA-N 409.490 2.551 5 40 HFBB COc1ccc(OCCN(C)S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 32770673 GDKYPYMQFSBLNO-UHFFFAOYSA-N 400.840 2.956 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2ON=C(c3ccccc3Cl)[C@H]2C1=O 101212244 SZRKLXYKGLFIIP-ZBFHGGJFSA-N 401.762 2.549 5 40 HFBB COc1ccc(N(CC(=O)O)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 225005905 FPQIXFNAXPUXSF-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB Nn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1cccc(Cl)c1 3322553 PNSQUQSFHWLZDP-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB CCCn1nc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O 5788274 FIXYYNCGYYOWIF-UHFFFAOYSA-N 410.386 2.510 5 40 HFBB COCCCN1C(=O)[C@@H](CC(=O)Nc2ccccc2[N+](=O)[O-])n2c1nc1ccccc12 23411187 XACIHMIOOMUQQL-GOSISDBHSA-N 423.429 2.898 5 40 HFBB CC(=O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@@H]2C(=O)N(c3cccc(Cl)c3)C(=O)[C@@H]12 104496998 GGXKNQVEPWEXPE-RDJZCZTQSA-N 412.789 2.571 5 40 HFBB CCc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3CCN(CC)CC3)c(O)n2n1 22854457 KYGQCYHJAKVSCP-MRXNPFEDSA-N 416.507 2.694 5 40 HFBB O=C(c1ccc([N+](=O)[O-])o1)N(CCN1CCOCC1)c1nc2ccccc2s1 22998154 BHXWGPAKPXUYBP-UHFFFAOYSA-N 402.432 2.777 5 40 HFBB Cc1cc(N2CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2)nc(C(C)C)n1 26337973 SCOXLAOQHMFOGK-UHFFFAOYSA-N 412.494 2.967 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 39986207 DQBFIJRVRRZPQP-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB COc1ccc(S(=O)(=O)N(C)C)cc1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C 224001167 PWDRUXOSFKVFLY-UHFFFAOYSA-N 421.475 2.733 5 40 HFBB COC(=O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225023929 CNXWNIREFVFYAF-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 408572118 GUJRCVLIDALTSX-UHFFFAOYSA-N 401.394 2.873 5 40 HFBB CCOC(=O)c1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc(C(=O)OCC)c1 3515179 KNGPIEIQVMOPHJ-UHFFFAOYSA-N 416.386 2.966 5 40 HFBB Cc1cccc(C)c1NC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 8038707 FRWSJJSMDBSTOK-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COc1ccc(NC(=O)[C@H](C)N2CCN(Cc3csc(C)n3)CC2)c([N+](=O)[O-])c1 12883686 YUDVXRRZCPDVFD-ZDUSSCGKSA-N 419.507 2.513 5 40 HFBB CC[C@H](NC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(C)cc1 32747527 QZZKMHCJXKJLEL-INIZCTEOSA-N 420.491 2.620 5 40 HFBB Cc1nc(C(=O)Nc2ccccc2N2CCOCC2)nn1-c1ccc([N+](=O)[O-])cc1 1397425 QHKOMKRWLYTJOU-UHFFFAOYSA-N 408.418 2.573 5 40 HFBB CCOc1ccc(NC(=O)COC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 3355458 IGTKEICMWXKTSF-UHFFFAOYSA-N 404.375 2.806 5 40 HFBB Cc1cccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@@H]32)c1C 7718543 YHYACIYGZHMSTF-ROUUACIJSA-N 401.444 2.824 5 40 HFBB CCS(=O)(=O)C(Br)(Br)[C@H](O)c1cccc([N+](=O)[O-])c1 96520888 WOEAICCVSBURES-SECBINFHSA-N 417.075 2.507 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(Cl)s2)cc1[N+](=O)[O-] 2651705 YREYNFKOJJMELX-UHFFFAOYSA-N 403.821 2.753 5 40 HFBB Cc1cc(=O)oc2cc(OCC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)ccc12 9493177 MSIWNTNTQDHQOT-UHFFFAOYSA-N 423.425 2.737 5 40 HFBB C[C@@H]1CCCN(S(=O)(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 27959684 LOQFYFMUDFNYBF-LLVKDONJSA-N 410.418 2.592 5 40 HFBB CCN(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(OC)cc1 39985240 XTKNAQISALFJNV-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)N1CCCN1[C@@H]2c1ccc(Cl)cc1 100759163 BNSAJMZXAPGHAE-KSZLIROESA-N 412.833 2.784 5 40 HFBB CCOc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 2806722 TVBPHXXRXHDASK-UHFFFAOYSA-N 400.391 2.864 5 40 HFBB Cc1noc(NS(=O)(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)c1C 3235997 WRTHDAANGMEWLF-UHFFFAOYSA-N 406.376 2.846 5 40 HFBB O=C(COC(=O)COc1ccccc1[N+](=O)[O-])Nc1ncc(Cl)cc1Cl 5560653 TYQDAIWEUSMYRS-UHFFFAOYSA-N 400.174 2.857 5 40 HFBB COC(=O)c1cccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c1 9125228 FDPDBPBJVLPLRV-UHFFFAOYSA-N 413.415 2.913 5 40 HFBB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1cc(Cl)ccc1[N+](=O)[O-] 6361852 ZHVNNMWVPFPYAB-UHFFFAOYSA-N 403.822 2.754 5 40 HFBB O=[N+]([O-])c1ccc([C@@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)cc1 10232639 NIOFMJCJTRBENZ-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB CN(CCOc1ccc(F)cc1)C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 24386925 SMKLEQCVTQRDBI-UHFFFAOYSA-N 403.410 2.722 5 40 HFBB CN(C(=O)Cn1nc(Br)c(=O)c2ccccc21)c1ccc([N+](=O)[O-])cc1 83869434 BVDIPWYVUMNSCM-UHFFFAOYSA-N 417.219 2.730 5 40 HFBB COC[C@H](C)NS(=O)(=O)c1ccc(Sc2nc(C)c(C)o2)c([N+](=O)[O-])c1 12764474 OAWAEYGETSVLMV-VIFPVBQESA-N 401.466 2.664 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)NNC2=Nc3ccccc3[C@H](c3ccccc3)N2)cc1 16478530 BRDDDRQNXCTRKQ-IBGZPJMESA-N 423.454 2.758 5 40 HFBB O=C(Nc1cc(O)nc2nc(CCc3ccccc3)nn12)c1cccc([N+](=O)[O-])c1 16995489 CQTUFEGQRPHFPS-UHFFFAOYSA-N 404.386 2.776 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O 409118824 RDPJHCBSOQTRAE-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)NC2(CCCCCCC2)C1=O 3340573 JTIZFQPBIFYWKR-UHFFFAOYSA-N 404.423 2.577 5 40 HFBB CCCOC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1N1CCOCC1 4712204 SNFQOAGAHWFNCT-UHFFFAOYSA-N 403.391 2.844 5 40 HFBB Nn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1Cl 5257348 AMETYGCOWNQACU-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc([N+](=O)[O-])c1 12977197 IOBGQGBDMPALBV-UHFFFAOYSA-N 403.460 2.699 5 40 HFBB CC(=O)[C@@H](C(=O)OC(C)C)C(c1cccc([N+](=O)[O-])c1)[C@H](C(C)=O)C(=O)OC(C)C 16575494 DPHUMJWVOASNEI-DFNIBXOVSA-N 421.446 2.992 5 40 HFBB COc1ncc(C)cc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 72309239 BGYJZZMWNXXJAI-UHFFFAOYSA-N 400.420 2.839 5 40 HFBB CCOc1ccc(NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220401350 OKCFAKKZGOBMOP-CYBMUJFWSA-N 407.448 2.787 5 40 HFBB COc1c(I)cc(/C=C2\SC(=O)N(C)C2=O)cc1[N+](=O)[O-] 408811041 LQPPLQANJJXIPL-UITAMQMPSA-N 420.184 2.874 5 40 HFBB O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 541338405 UWAIIUZXFZFUIF-AEFFLSMTSA-N 409.446 2.957 5 40 HFBB CCCCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1c(N)n(CCC)c(=O)[nH]c1=O 3421094 LKXVEKXIDOVQDI-UHFFFAOYSA-N 423.857 2.537 5 40 HFBB COCCOC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 7552649 PXXLXTCHPNSSAC-INIZCTEOSA-N 409.826 2.941 5 40 HFBB O=C(Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cncc(Br)c1 8902483 RMBULLGECRHODW-UHFFFAOYSA-N 407.224 2.841 5 40 HFBB C[C@H](OC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1 21129555 JUQUKISDDRHJLI-STQMWFEESA-N 415.377 2.657 5 40 HFBB CC[C@@H](C)OC(=O)CN1C(=O)S/C(=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)C1=O 409218614 WGINROQSWKRHEN-MRACZJACSA-N 410.404 2.687 5 40 HFBB O=C(O)C[C@H](NS(=O)(=O)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Cl 4690126 CJUGGWRFGKWHLJ-AWEZNQCLSA-N 402.787 2.882 5 40 HFBB O=C1N[C@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 13306882 XHWWAARUXDSGHW-LALPHHSUSA-N 415.349 2.760 5 40 HFBB CCOC(=O)c1cc2c(=O)n3cc(C)ccc3nc2n(CCc2ccccc2)c1=N 16742225 RNUFJAWEHDAYHT-UHFFFAOYSA-N 402.454 2.856 5 40 HFBB CCOC(=O)C1=C(COc2cccc([N+](=O)[O-])c2)NC(=O)N[C@@H]1c1ccc(C)o1 31676955 FOSVSSVDWCORMI-QGZVFWFLSA-N 401.375 2.746 5 40 HFBB CCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1nnnn1C 3420865 SQHVTJDWCJUXAI-UHFFFAOYSA-N 400.420 2.921 5 40 HFBB Cc1c(NC(=O)COc2ccc(S(=O)(=O)NCC(C)C)cc2)cccc1[N+](=O)[O-] 6280033 GKWVTOOCMFTAIQ-UHFFFAOYSA-N 421.475 2.855 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)cc1 8433897 BHZRKMZMORXXCZ-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB C[C@@H](NC(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 9355754 JZEXAGOSZSWMJQ-OAHLLOKOSA-N 417.487 2.873 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])o1 9443261 LYUBETMMBKVDRM-UHFFFAOYSA-N 409.420 2.623 5 40 HFBB COc1cc(C(=O)N2CCN(c3nccs3)CC2)c([N+](=O)[O-])cc1OC(F)F 10270633 ARQOQJOXPYKINS-UHFFFAOYSA-N 414.390 2.624 5 40 HFBB C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)NCC(F)(F)F 10723019 DJZNMVKFIHLUOT-LBPRGKRZSA-N 406.360 2.765 5 40 HFBB O=C(Nc1ccc(N2CCNCC2)c([N+](=O)[O-])c1)c1ccc(Cl)c([N+](=O)[O-])c1 20154270 NDURSMZEFHUACZ-UHFFFAOYSA-N 405.798 2.818 5 40 HFBB COC(=O)C1=C(O)[C@H](C(=O)OC)[C@H]2c3ccccc3[C@H]1[C@@]2(c1ccccc1)[N+](=O)[O-] 100644111 WPDBGDWRNAAKCD-KLSTYFJDSA-N 409.394 2.828 5 40 HFBB CS(=O)(=O)N(CCCC(=O)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 222365591 SMMCIWMRSKORBJ-UHFFFAOYSA-N 403.460 2.730 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1ccc(Cl)cc1 408670545 RBQZFHUNVIWCDB-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 541338408 UWAIIUZXFZFUIF-WMZOPIPTSA-N 409.446 2.957 5 40 HFBB CN(C(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 1463583 RWLHZQIUNKSOBM-UHFFFAOYSA-N 409.508 2.787 5 40 HFBB CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 7070783 VRWMZDPXBNDTAM-CQSZACIVSA-N 421.475 2.998 5 40 HFBB Cc1ccc(C(=O)Nc2nnc(CS(=O)(=O)c3ccccc3)s2)cc1[N+](=O)[O-] 9355778 UJUWKNDGTSDMSN-UHFFFAOYSA-N 418.456 2.981 5 40 HFBB CCOC(=O)[C@@H]1CCCN(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 14787639 XNMFRESAWUHPMA-CQSZACIVSA-N 418.475 2.932 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(N2CCCC2=O)c(C)c1 20039795 XGLMLBQZYKFBFA-UHFFFAOYSA-N 405.432 2.839 5 40 HFBB CCc1nnsc1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 25378505 ZGAVZMAPVANUJY-UHFFFAOYSA-N 415.397 2.990 5 40 HFBB COC(=O)C[C@@H](C(=O)OC)[C@@H](C[N+](=O)[O-])c1ccc(OC)c(OC2CCCC2)c1 65336763 ANIDZYMNYALTTQ-CVEARBPZSA-N 409.435 2.729 5 40 HFBB Cc1ccccc1C(=O)Nc1nnc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)s1 224927595 PZZNAPZANZMNNB-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB Cc1ccsc1CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 8917341 XAMHCTINARWLOG-AWEZNQCLSA-N 424.500 2.559 5 40 HFBB O=C(CCC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(F)cc1F 52615590 BLQJQEBHIUYLDW-UHFFFAOYSA-N 404.373 2.580 5 40 HFBB O=C(c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(OC[C@@H]2CCCO2)CC1 96011253 KXTRNMBVLIEJIE-KRWDZBQOSA-N 400.435 2.785 5 40 HFBB Cc1ccc(CNC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 222361021 FIHWPBZBHDYJPG-UHFFFAOYSA-N 405.476 2.766 5 40 HFBB CS(=O)(=O)c1ccc2nc(NC(=O)COc3ccccc3[N+](=O)[O-])sc2c1 2483595 WXRBGWTXGXVAGU-UHFFFAOYSA-N 407.429 2.626 5 40 HFBB O=C(COC(=O)COc1ccccc1[N+](=O)[O-])Nc1ccccc1Br 3234863 MVZJAFHNCPGCIL-UHFFFAOYSA-N 409.192 2.918 5 40 HFBB COc1ccc(CN(C)C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)cc1 32722073 BBZGSAGXDFUMDB-UHFFFAOYSA-N 408.414 2.730 5 40 HFBB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/SC(=O)N(CC(=O)O)C2=O)o1 409141298 IBDUNTJPOLMIEH-VGOFMYFVSA-N 404.356 2.984 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H](Cc1ccc(Cl)cc1)C(=O)O 548528319 ANLNFSGOWBRPKN-ZDUSSCGKSA-N 412.851 2.778 5 40 HFBB O=C(NC1CCC(NC(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1[N+](=O)[O-] 2086264 PMWPAYWCDPUUMR-UHFFFAOYSA-N 412.402 2.974 5 40 HFBB CC(C)(C)Nc1nc(C(Cl)(Cl)[N+](=O)[O-])nc(C(Cl)(Cl)[N+](=O)[O-])n1 4679039 TUGPWYGRMVJJKI-UHFFFAOYSA-N 408.029 2.811 5 40 HFBB C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(C(=O)NCc2ccccc2)CC1 12795492 BZUPTNIPRQBPHX-MRXNPFEDSA-N 410.474 2.950 5 40 HFBB Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)NCc1ccccc1-n1cccc1 15022515 CCPGIQLIHQMEDR-UHFFFAOYSA-N 418.251 2.969 5 40 HFBB CSc1n[nH]c(-n2ccc3nc4ccn(-c5ccc(C)cc5)c(=O)c4cc3c2=O)n1 40398888 QGNRVIITEKFDOJ-UHFFFAOYSA-N 416.466 2.838 5 40 HFBB O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccc(Br)cc1 101076357 XLSYZQQQEVRNQE-UKRRQHHQSA-N 416.187 2.650 5 40 HFBB CCOC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225085385 BJFIUTSXHZUDHG-UHFFFAOYSA-N 414.386 2.940 5 40 HFBB Cn1c(CC(=O)Nc2ccccc2)nnc1SCC(=O)c1cccc([N+](=O)[O-])c1 9327547 AGXDPTHDQRJGRD-UHFFFAOYSA-N 411.443 2.880 5 40 HFBB CCC(=O)Nc1ccc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)cc1 95971865 DSUYAXFZKLOFTN-UHFFFAOYSA-N 408.208 2.750 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 409115952 JZCWPVJXCXBJTI-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB CCn1c(Cc2ccccc2)nnc1SCC(=O)Nc1ncc([N+](=O)[O-])s1 9194612 SCDYCSFSVTWHGM-UHFFFAOYSA-N 404.477 2.984 5 40 HFBB COCC(=O)Nc1ccccc1C(=O)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)s1 39767744 SZEJLVYDTWIIES-UHFFFAOYSA-N 413.415 2.951 5 40 HFBB Cn1cnc([N+](=O)[O-])c1NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 40087067 JYHXOHHXLTXCSS-UHFFFAOYSA-N 412.416 2.971 5 40 HFBB Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccn(Cc3c(F)c(F)c(F)c(F)c3F)n2)n1 2782404 UKEZEKNAWKIDID-UHFFFAOYSA-N 416.266 2.521 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1c2cccc3cccc(c23)S1(=O)=O 4807195 MZIYPIXQXILEJU-UHFFFAOYSA-N 413.411 2.904 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C(=O)N1CCCC1 7361385 DBLSSOKVCLYMIL-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB COc1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 12977667 URJNSYJFTGVQRI-OAHLLOKOSA-N 420.443 2.900 5 40 HFBB CCOC(=O)c1c(C)n[nH]c1-n1ccc2nc3ccn(CC(C)C)c(=O)c3cc2c1=O 40399091 HPAYSCAYYRPNSY-UHFFFAOYSA-N 421.457 2.565 5 40 HFBB CN(CCCO)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 95976279 DUFKOWJUIKOMKR-UHFFFAOYSA-N 404.511 2.504 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 102415276 JRPSUKYENLATSN-BIPCEHGGSA-N 419.393 2.864 5 40 HFBB COc1cc(Cl)c([C@@H]2CN(C)[C@@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1OC 408567827 RPAMAYVIJGLZTE-GCKAQTDUSA-N 417.849 2.879 5 40 HFBB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 8942202 RGBBJXLPVNMXSP-FQEVSTJZSA-N 414.393 2.920 5 40 HFBB C[C@H]1CCc2c(sc3ncn(C[C@H](O)COc4cccc([N+](=O)[O-])c4)c(=O)c23)C1 24834131 QBMNIJQMUARYLB-JSGCOSHPSA-N 415.471 2.931 5 40 HFBB Cc1nn(CC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)c(C)c1[N+](=O)[O-] 27203318 DUBNGOJRSUFAPO-UHFFFAOYSA-N 411.384 2.776 5 40 HFBB Cc1ccc(CNC(=O)CSc2nc3ccccc3c3nc(=O)c(C)nn23)cc1 58046918 GZQGIMKMSPQWAR-UHFFFAOYSA-N 405.483 2.663 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1cccc(C(F)(F)F)c1 100876334 GXOVXWRMIRKGNK-HIFRSBDPSA-N 405.288 2.906 5 40 HFBB C[C@@H](C(=O)c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O 408658569 VBSIBGJTJKCSOT-AWEZNQCLSA-N 409.398 2.763 5 40 HFBB Cc1ccccc1N1C[C@@H](C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O 7450909 WNOJQULGEZVTDE-KRWDZBQOSA-N 408.458 2.605 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CCOC[C@@H]1C1CC1 95446186 VWIUDEBBCOHTTG-LJQANCHMSA-N 409.508 2.775 5 40 HFBB O=C(Nc1ccc(S(=O)(=O)NCc2ccco2)cc1)c1cccc([N+](=O)[O-])c1 6552282 MCVRJIKVBQIJAO-UHFFFAOYSA-N 401.400 2.919 5 40 HFBB CCOc1ccc(NC(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8416470 NIARWFWPANPNEQ-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB O=[N+]([O-])c1ccc(N2C(=S)N(c3ccc(F)cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 12421627 YHAQKJMTFXCZJQ-HZPDHXFCSA-N 407.448 2.511 5 40 HFBB CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1nc2ccccc2c(=O)[nH]1 12862819 XIQWBNIWKCVXTI-UHFFFAOYSA-N 415.837 2.945 5 40 HFBB COC(=O)CN(c1ccc(OC(C)C)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225014593 NQOJXKHFUDMUSQ-UHFFFAOYSA-N 408.432 2.750 5 40 HFBB Cc1cc(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c(C)n1C[C@@H]1CCCO1 3602191 DOQUKEPMZSVZHC-HNNXBMFYSA-N 411.414 2.671 5 40 HFBB O=C(CN1CCC(NC(=O)NC2CCCCC2)CC1)Nc1cccc([N+](=O)[O-])c1 4909049 LVLMVHVRESQROP-UHFFFAOYSA-N 403.483 2.630 5 40 HFBB CC1CCN(S(=O)(=O)c2ccc(NCCCN3CCCC3)c([N+](=O)[O-])c2)CC1 8725864 QYACGVRKEMHNHR-UHFFFAOYSA-N 410.540 2.913 5 40 HFBB CC(C)CCO[C@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)C1 79049066 INNWFRBBCDHYQE-INIZCTEOSA-N 405.451 2.947 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@@]2(CCCC[C@@H]2NCc2cccnc2)C1 306133262 MGUIUDHIGPYTFL-UNMCSNQZSA-N 410.474 2.933 5 40 HFBB COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2O)cc1OC 5350917 HNAXEDISCAOJKE-XBXARRHUSA-N 403.416 2.844 5 40 HFBB COc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]2C(=O)Nc2cccc([N+](=O)[O-])c2)c1 22230002 LOQMEBIFSLFDHM-QGZVFWFLSA-N 419.459 2.704 5 40 HFBB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(Br)c2)o1 95450502 RJDKVXLZTNCYGY-UHFFFAOYSA-N 403.210 2.747 5 40 HFBB CCc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 8064219 NVWABKGLXPPOSJ-ROUUACIJSA-N 401.444 2.769 5 40 HFBB Cc1ncc([N+](=O)[O-])n1CCOC(=S)NC(=O)c1ccccc1Br 16363367 FYGMEDBYSIBBSR-UHFFFAOYSA-N 413.253 2.594 5 40 HFBB CCc1ccccc1N1C[C@@H](C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CC1=O 59057116 PPOYASDTDXRCNP-SFHVURJKSA-N 422.485 2.859 5 40 HFBB CS(=O)(=O)c1ccc(NCCNC(=O)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 12769383 RJYOHIBRHVMMFI-QGZVFWFLSA-N 417.487 2.647 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220387986 ZICIXVVBFPVZJM-LBPRGKRZSA-N 422.419 2.605 5 40 HFBB C[C@@H](Oc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13)C(=O)NCCCO 6624586 SJSQNRRZYCKUBC-CQSZACIVSA-N 415.449 2.858 5 40 HFBB biogenic O=C(CSC1=NS(=O)(=O)c2cc(F)ccc2N1)Nc1cccc([N+](=O)[O-])c1 9762003 DROFBGKWQYOKEH-UHFFFAOYSA-N 410.408 2.576 5 40 HFBB CCCN(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 9836318 DQRZZABFHGBRTA-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB CC(=O)C1=NN(c2cccc(Cl)c2)[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]12 18190495 FQULRKZWCCGDQF-DOTOQJQBSA-N 412.789 2.571 5 40 HFBB CC1CCN(c2ccc(C(=O)NCC(C)(C)N3CCOCC3)cc2[N+](=O)[O-])CC1 23466477 MWFWLMXONUCQRH-UHFFFAOYSA-N 404.511 2.672 5 40 HFBB CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@H]3C[C@H]3[N+](=O)[O-])ccc2C)cc1 40143713 YDVFWTYSIQIQLG-DLBZAZTESA-N 419.459 2.798 5 40 HFBB CCn1c(=O)n(CC)c2cc([N+](=O)[O-])c(NS(=O)(=O)c3ccc(C)cc3)cc21 408536307 WBNKJDDZQLEXDG-UHFFFAOYSA-N 404.448 2.860 5 40 HFBB COc1cc(/C=C/C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1O 3245335 PJGDTEKXRGOWCS-BIPYJSMBSA-N 416.386 2.901 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 16383987 JNKUABSZJPPEGF-UHFFFAOYSA-N 420.809 2.884 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1)Nc1cccc([N+](=O)[O-])c1 30953376 WVIAEKFAEXRBQT-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 408643773 RVJPLSFYKDLTHI-LLVKDONJSA-N 400.347 2.503 5 40 HFBB NC(=O)c1c(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)sc2c1CCC2 16399701 PMJSUNMFFSQUHS-BQYQJAHWSA-N 416.484 2.770 5 40 HFBB COc1cc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])ccc1OC(=O)c1ccccc1 33590421 HLSKMNGLFWIVFA-VQHVLOKHSA-N 409.354 2.782 5 40 HFBB CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1nc(=O)c2ccccc2[nH]1 36321646 UGSOOZMPAUVIJP-UHFFFAOYSA-N 401.810 2.555 5 40 HFBB Cc1ccc(S(=O)(=O)NCc2ccc(OC3CCN(C)CC3)cc2)cc1[N+](=O)[O-] 216941435 SBJQJXSXFRONFS-UHFFFAOYSA-N 419.503 2.855 5 40 HFBB CCNc1ccc(C(=O)OCC(=O)NCc2cc(C)c(O)c(C)c2)cc1[N+](=O)[O-] 7984326 SNFIMSRXCQQOQA-UHFFFAOYSA-N 401.419 2.822 5 40 HFBB O=[N+]([O-])c1cccc(S(=O)(=O)N2CCC(c3nc(-c4ccncc4)no3)CC2)c1 8677622 HDKWTOSMWDYAEX-UHFFFAOYSA-N 415.431 2.608 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@@H](c2ccccc2F)n2nnnc2N3)cc1 10296255 QUUKWLZQLGXWBF-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB C[C@H](Sc1nnc(C(F)(F)F)n1N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36791586 DAHUHOAKCYXRLP-YFKPBYRVSA-N 410.765 2.692 5 40 HFBB COCCCN1C(=O)[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)n2c1nc1ccccc12 39963981 IAXLZCCSNMLOKG-SFHVURJKSA-N 423.429 2.898 5 40 HFBB CCOc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC(C)C 408700426 FULCEXOYQRCLPF-UHFFFAOYSA-N 407.448 2.933 5 40 HFBB C[C@@]1(CCc2ccccc2)NC(=O)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1=O 3322794 FLPJAYMIJWFKNW-NRFANRHFSA-N 411.414 2.905 5 40 HFBB CCn1nnc2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)ccc21 5805181 WRUQDPJMCZLFFO-JTQLQIEISA-N 401.354 2.683 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])NC(=S)Nc1cc(C(=O)O)ccc1Cl 6884691 NSZBFHPZKAZFEK-UHFFFAOYSA-N 409.807 2.838 5 40 HFBB O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 12111175 TZOXHBKRYAPXCC-UHFFFAOYSA-N 416.459 2.961 5 40 HFBB CC(=O)c1ccc(N2CCN(CC(=O)Nc3cccc(F)c3)CC2)c([N+](=O)[O-])c1 57942992 IPXZTSLQKCORDI-UHFFFAOYSA-N 400.410 2.697 5 40 HFBB CNS(=O)(=O)c1ccc(N2CCC[C@H]2CN(C)c2ccccc2)c([N+](=O)[O-])c1 58157293 JADUHOOBBXAVMC-INIZCTEOSA-N 404.492 2.608 5 40 HFBB CCOC(=O)[C@@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 58244962 PUMKZDMIADUMJF-MRXNPFEDSA-N 414.386 2.798 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)c1 4393609 VYVZQJKUYYPXIG-ROUUACIJSA-N 401.444 2.824 5 40 HFBB COc1ccc(NC(=O)CN(C)CC(=O)Nc2ccccc2SC)c([N+](=O)[O-])c1 6637007 JHMAAJVHFWFLQZ-UHFFFAOYSA-N 418.475 2.834 5 40 HFBB CCOc1ccc(NC(=O)CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8415222 MSSIWLWSLIMYPA-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-])c1ccc(F)cc1 37210675 XYGBJTSAQCCUKY-AWEZNQCLSA-N 422.482 2.843 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1cccc(F)c1)S(C)(=O)=O 220475402 YBOIBLWLLKFFRU-LLVKDONJSA-N 411.411 2.536 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 909094 HRGJNHXILMPDRT-TYNCELHUSA-N 415.349 2.760 5 40 HFBB CCc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1 6652953 IUTUOXFBYBJINF-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(Cc2nc(-c3ccccc3)no2)CC1 40063366 VIXNTWCHZMTZQN-UHFFFAOYSA-N 407.430 2.532 5 40 HFBB Cc1cccc(CNC(=O)CN2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 95941519 NACGDZYXGONICA-UHFFFAOYSA-N 422.489 2.608 5 40 HFBB CCn1c(=N)c(S(=O)(=O)c2ccc(C)cc2)cc2c(=O)n3cc(C)ccc3nc21 100846633 CJUITUFILCKCLZ-UHFFFAOYSA-N 408.483 2.598 5 40 HFBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 2084499 NVMLWVRPOKXNPC-SSDOTTSWSA-N 411.871 2.677 5 40 HFBB Nc1ccc(C(=O)OCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)cc1[N+](=O)[O-] 5659025 ALCAOIWZCJEYIW-UHFFFAOYSA-N 400.416 2.711 5 40 HFBB CC[C@H](C)N1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 8995961 MBRANFPVIJLCSR-IFCGJNOESA-N 414.462 2.763 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1cccc(F)c1)N(C)C 12565379 XSCYYVIUJGVHBL-IBGZPJMESA-N 404.442 2.825 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1C 15248173 CYIOOQDQFMDKFQ-IBGZPJMESA-N 419.503 2.563 5 40 HFBB CCOC(=O)/C(C(=O)Nc1ccccc1)=C(\N)NNc1cc(Cl)ccc1[N+](=O)[O-] 16681967 QBEVESJEZQHQDZ-FOCLMDBBSA-N 419.825 2.537 5 40 HFBB COC(=O)C(=C\c1nc2ccc([N+](=O)[O-])cc2s1)/C(C(=O)OC)=C1/CCCN1C 17174745 COICVVAABJJKEZ-LHNBAYGQSA-N 417.443 2.914 5 40 HFBB Cc1nccn1-c1cc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)ccn1 40154741 XVEDEDXMMMKLIY-UHFFFAOYSA-N 403.402 2.600 5 40 HFBB CCOC(=O)c1cc(C(=O)NCc2ccc(-n3ccnc3C)nc2)cc([N+](=O)[O-])c1 40156077 VVTDBWSOHPPOJN-UHFFFAOYSA-N 409.402 2.591 5 40 HFBB Cn1c(=O)nc2n(-c3ccc(N4CCCC4)cc3)c3ccc([N+](=O)[O-])cc3cc-2c1=O 59497872 QKQBETJIEBRXMN-UHFFFAOYSA-N 417.425 2.698 5 40 HFBB C[C@@H](OC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 3425923 REBYXHCNFHOUJZ-CYBMUJFWSA-N 424.475 2.550 5 40 HFBB C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2=O 3336263 XNPSWGZYKSTYKE-NSPYISDASA-N 406.414 2.809 5 40 HFBB Cc1ccc(C(=O)n2nc(C)c(S(=O)(=O)N3CCCCCC3)c2C)cc1[N+](=O)[O-] 4375835 QFBVQBVVUMRCLV-UHFFFAOYSA-N 420.491 2.970 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)N(C)c2ccccc2)c([N+](=O)[O-])c1 6084856 ZGUSFRWDFMGCAX-UHFFFAOYSA-N 421.475 2.667 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCO1 7363393 XAOVNVMAWVUOIB-HNNXBMFYSA-N 419.459 2.613 5 40 HFBB COc1ccc(OC)c([C@@H]2CCCN2C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)c1 12783356 RCSFXYRAJTWYPA-SFHVURJKSA-N 413.430 2.706 5 40 HFBB CCOc1ccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2O)cc1[N+](=O)[O-] 17083364 HLNSJBUHFFKPOT-UHFFFAOYSA-N 406.376 2.734 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@H](c1ccc(Cl)cc1)N1CCCN21 19168511 BNSAJMZXAPGHAE-SQNIBIBYSA-N 412.833 2.784 5 40 HFBB CCc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3CCN(CC)CC3)c(O)n2n1 22854454 KYGQCYHJAKVSCP-INIZCTEOSA-N 416.507 2.694 5 40 HFBB O=c1nc2n(-c3cccc(Br)c3)c3ccc([N+](=O)[O-])cc3cc-2c(=O)[nH]1 59497769 HHJGHHYABRTYQF-UHFFFAOYSA-N 413.187 2.850 5 40 HFBB O=C(Nc1ncc([N+](=O)[O-])s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 9144418 HUNXSRQTXZNIHP-UHFFFAOYSA-N 414.440 2.617 5 40 HFBB CC(C)[C@@H](C)NC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 225188514 ZCJTWXBOQFPJLO-OAHLLOKOSA-N 405.476 2.951 5 40 HFBB O=C(O)c1cc(N2C(=O)c3ccc([N+](=O)[O-])c4c([N+](=O)[O-])ccc(c34)C2=O)ccc1O 3659029 UDTWAKPGWUEPHZ-UHFFFAOYSA-N 423.293 2.861 5 40 HFBB CCOC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1 7061880 WCVPDZNCPUDXIK-DOTOQJQBSA-N 405.476 2.842 5 40 HFBB O=C(O)CCCC(=O)Nc1ccc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 8473704 RUEVPCNKFPWJSX-UHFFFAOYSA-N 414.370 2.828 5 40 HFBB COc1cc(NC(=O)CSc2nnc(-c3ccncc3)n2C)c(C)cc1[N+](=O)[O-] 15981408 KDPKTHFEJMPIAR-UHFFFAOYSA-N 414.447 2.833 5 40 HFBB C[C@H](OC(=O)Cc1ccc(N2CCCC2=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 25113005 DXCMTBIJRZSOKJ-AWEZNQCLSA-N 411.414 2.835 5 40 HFBB O=C(Cc1ccccc1)NN1C(=O)c2ccc([N+](=O)[O-])c3c([N+](=O)[O-])ccc(c23)C1=O 95470748 INYLHHADYVAERL-UHFFFAOYSA-N 420.337 2.526 5 40 HFBB COc1ccc(C)cc1N([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220336368 DFUWZBBOCZVIJN-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CCc1ccc(CN(C(=O)c2ccccc2[N+](=O)[O-])[C@H]2CCS(=O)(=O)C2)cc1 4318710 CNKUWBKRDHKZDP-KRWDZBQOSA-N 402.472 2.987 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2ccc(NCc3ccccc3)nn2)CC1 4583167 SXBHSGBGFBNVBH-UHFFFAOYSA-N 418.457 2.959 5 40 HFBB CCOC(=O)C1=C(C(N)=O)NC2=C(C(=N)CC(C)(C)C2)[C@H]1c1ccc([N+](=O)[O-])cc1 5790025 ILDRLZWDHOHVOV-OAHLLOKOSA-N 412.446 2.678 5 40 HFBB COC(=O)c1cc(OC)c(OC)cc1N(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224791103 VJBVGQOAGNTJIW-UHFFFAOYSA-N 424.431 2.532 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225086108 YYFHBVUGYFJURV-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)/C=C/c1cnc2ccccc2n1 14360914 BQPNSJVUJPVLNA-RMKNXTFCSA-N 408.370 2.742 5 40 HFBB Cc1ccc(C)c([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 22347902 JCCFQHMWZDEZHR-OAHLLOKOSA-N 405.476 2.855 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 36056510 HRGJNHXILMPDRT-SLEUVZQESA-N 415.349 2.760 5 40 HFBB CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 50732272 JXRJXRXBOZOXSJ-HOTGVXAUSA-N 413.478 2.938 5 40 HFBB O=C(/C=C/c1ccccc1OC(F)F)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 58168988 OGAIOVSEYLPGHF-VMPITWQZSA-N 404.373 2.953 5 40 HFBB CCOc1ccc(N(CC(=O)OC)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 225074818 OSSHSARKARYYTH-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1cc(Cl)c([C@@H]2[C@H](C)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1OC 408569718 XELHHTRKORBTQX-YMUVEIQISA-N 417.849 2.925 5 40 HFBB CCCNC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 409117710 MDPUQXIPLQZRHV-UHFFFAOYSA-N 421.475 2.633 5 40 HFBB O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 4526163 WZNGSCLDBFLJEE-QZTJIDSGSA-N 412.402 2.974 5 40 HFBB CSCC[C@@H](NC(=O)COc1ccccc1)C(=O)OCc1ccc([N+](=O)[O-])cc1 12945194 XNQVXFFWWFFRDV-GOSISDBHSA-N 418.471 2.955 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1N1CCCC1=O 44847446 SRKSKKJTBGEBOB-UHFFFAOYSA-N 405.432 2.839 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CS(=O)(=O)N2CCCC2)cc1 44899980 FSCHEJYSPLBTTG-UHFFFAOYSA-N 419.459 2.781 5 40 HFBB CC[C@H](C)OC(=O)CN1C(=O)S/C(=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)C1=O 409218615 WGINROQSWKRHEN-PBJWJZLWSA-N 410.404 2.687 5 40 HFBB Cc1ccc(C(=O)CN(C(=O)c2ccc([N+](=O)[O-])cc2)N2C(=O)CCCC2=O)cc1 7881761 IZFDBMDFNMEKJF-UHFFFAOYSA-N 409.398 2.682 5 40 HFBB Cc1cc(=O)nc(-n2nc(-c3cccs3)cc2NC(=O)c2ccc([N+](=O)[O-])o2)[nH]1 11854491 KTUGDESXITUGFM-UHFFFAOYSA-N 412.387 2.746 5 40 HFBB COC(=O)c1cc(OC)c(OC)cc1N(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225093216 CALKXBKLJIBSBN-UHFFFAOYSA-N 424.431 2.532 5 40 HFBB Cc1ccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 12421617 WNSAESYGWOVYOB-SJORKVTESA-N 403.485 2.680 5 40 HFBB C[C@@H](OC(=O)C[C@@H]1Sc2ccccc2NC1=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 12425360 NROHRHZEKCTYGD-BZNIZROVSA-N 415.427 2.968 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1C 22348297 PHLJSLHFTJIWBT-OAHLLOKOSA-N 405.476 2.855 5 40 HFBB Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1C[C@H]1COc2ccccc2O1 25254713 FZRYUWVBTSPSSV-KRWDZBQOSA-N 423.425 2.898 5 40 HFBB COc1ccccc1NC(=O)CCCC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 8417330 HSRCKKMDFBONER-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB Cc1nnc(NC(=O)c2ccc3c(c2)C(=O)N(c2cccc([N+](=O)[O-])c2)C3=O)s1 12857815 XXFMRTSKKHZZAL-UHFFFAOYSA-N 409.383 2.808 5 40 HFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 12989737 ZRRRZXSDYISCPD-CYBMUJFWSA-N 403.460 2.869 5 40 HFBB CCCCCCN(CCN1CCOCC1)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC 72308251 MDIACSQRPXTSFI-UHFFFAOYSA-N 422.526 2.756 5 40 HFBB Cc1c(C(=O)NCCN2C(=O)S/C(=C/c3cccnc3)C2=O)cccc1[N+](=O)[O-] 82055741 WTSRMFGVNDBHJR-MHWRWJLKSA-N 412.427 2.765 5 40 HFBB CCNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 223541331 LFFNTIGUXRXWNJ-OAHLLOKOSA-N 415.446 2.536 5 40 HFBB Cc1nn(CC(=O)OCC(=O)N(Cc2ccccc2)C(C)(C)C)c(C)c1[N+](=O)[O-] 3364609 NLUIZWHMHGAUNG-UHFFFAOYSA-N 402.451 2.779 5 40 HFBB CC(C)CCNC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 6325725 BQOMJEADKKMFNI-UHFFFAOYSA-N 405.476 2.952 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)CC2=O)cc1 6502073 YGEICLBHCPHQTO-CQSZACIVSA-N 412.398 2.866 5 40 HFBB O=C([C@H]1Cc2ccccc2CN1Cn1ncc2ccc([N+](=O)[O-])cc21)N1CCCC1 12819330 KZIDBHCJCYJSOX-OAQYLSRUSA-N 405.458 2.951 5 40 HFBB CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Br)cn1 36397585 LRZRSRULVJCELB-UHFFFAOYSA-N 421.251 2.866 5 40 HFBB Cc1cc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)ccc1[N+](=O)[O-] 4713595 LAGHRSOIEYIRIN-UHFFFAOYSA-N 412.402 2.718 5 40 HFBB CC[C@H](C(=O)NCc1ccccc1C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222518165 UIWRXFHAKKTHGU-GOSISDBHSA-N 405.476 2.764 5 40 HFBB O=C1N[C@@]2(CCCc3ccccc32)C(=O)N1Cc1cc([N+](=O)[O-])cc2c1OCOC2 2646925 UTUJOOOCXUGXST-OAQYLSRUSA-N 409.398 2.745 5 40 HFBB Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)NCc1nc2ccccc2[nH]1 4625267 GFRZFWBAGDRZQN-VIFPVBQESA-N 407.228 2.616 5 40 HFBB CC[C@@H](CCNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1 6554928 RYSDMYNNEWQUIL-HNNXBMFYSA-N 400.391 2.832 5 40 HFBB CO[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1 96006531 QKVACYBTSDMMGR-HUUCEWRRSA-N 422.482 2.537 5 40 HFBB O=C(Nc1ccc([N+](=O)[O-])cn1)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])cn2)c1 8456227 XRLGIYVGBXHGRH-UHFFFAOYSA-N 408.330 2.798 5 40 HFBB CCOC(=O)C[C@@H](NS(=O)(=O)c1ccc(OCC)cc1)c1cccc([N+](=O)[O-])c1 8868270 ORTVKFTYTXTLRH-GOSISDBHSA-N 422.459 2.966 5 40 HFBB COc1ccc(NC(=S)NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] 9975297 WVOTVUIBSJTDCN-UHFFFAOYSA-N 421.431 2.756 5 40 HFBB O=C(/C=C/c1ccc(N2CCCS2(=O)=O)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 13005566 AMVHUNWKXYAPAU-RUDMXATFSA-N 405.407 2.926 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(Oc3ccc(F)c(F)c3)c([N+](=O)[O-])c2)CC1 35574321 JGLYTEQUEQMGCK-UHFFFAOYSA-N 413.402 2.601 5 40 HFBB CCOc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(F)c([N+](=O)[O-])c3)n2)cc1 5396410 JWQFUQGWMBNDIL-UHFFFAOYSA-N 412.377 2.995 5 40 HFBB CCCc1cnc2c(c1SCc1cccc([N+](=O)[O-])c1)c(=O)n(C)c(=O)n2C 10216823 GZTNCWXJAPVKHL-UHFFFAOYSA-N 400.460 2.785 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccccc2Cn2cccn2)c1C 10959379 FSPUGDGIHDENNQ-UHFFFAOYSA-N 400.460 2.935 5 40 HFBB Cc1cc(C)c2c(n1)sc1c2ncn2nc([C@@H]3CCCN(S(C)(=O)=O)C3)nc12 13643701 COFQZGRWCFRYTC-GFCCVEGCSA-N 416.532 2.643 5 40 HFBB CCn1ccnc1CN1CCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C[C@H]1C 78806587 ZWBGBTIQRXKMBU-CQSZACIVSA-N 403.508 2.880 5 40 HFBB CCS(=O)(=O)C(Br)(Br)C(=O)c1ccc([N+](=O)[O-])cc1 96518484 HYDMQRUAXDAMFF-UHFFFAOYSA-N 415.059 2.656 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)N2CCCC2)cc1 5653002 IFNRNUONSBYMJQ-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB COc1cc(C(=O)Nc2nnc(-c3ccccc3[N+](=O)[O-])o2)cc(OC)c1OC 20496226 YKSMYOSCGWMNKD-UHFFFAOYSA-N 400.347 2.923 5 40 HFBB CCOC(=O)CN(c1cccc(OCC)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225037890 VEHARESLEVQQAQ-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB C[C@@H]1CCCCN1C(=O)CN1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O 409203071 VYBDIAMMLGFJGJ-PDICVPPASA-N 405.432 2.738 5 40 HFBB CS(=O)(=O)c1ccc2nc(NC(=O)COc3ccc([N+](=O)[O-])cc3)sc2c1 1777548 JEZZJYZFELOPLV-UHFFFAOYSA-N 407.429 2.626 5 40 HFBB O=c1c2c3nc4ccccc4nc3n(C[C@H]3CCCO3)c2ncn1C[C@@H]1CCCO1 2220722 DJUCCVCQOMVAJM-LSDHHAIUSA-N 405.458 2.652 5 40 HFBB COc1ccc(CN(C)CC(=O)Nc2cc(OC)c([N+](=O)[O-])cc2C)cc1OC 7973406 LMQABHVZAXYNGA-UHFFFAOYSA-N 403.435 3.000 5 40 HFBB COCCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 7671464 UGUZHSZIVKMQHW-UHFFFAOYSA-N 416.821 2.774 5 40 HFBB CCCCn1c(=O)[nH]c(=O)c2c1nc(COc1ccc([N+](=O)[O-])c(C)c1)n2CCC 22265750 LHWJORFYAFWEJY-UHFFFAOYSA-N 415.450 2.892 5 40 HFBB COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc(OC)cc1 2216430 RJRHYEHCZIAEIP-UHFFFAOYSA-N 415.453 2.998 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c(C)c1 8433868 CQVREWYQGOMVED-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 15312510 WHUDWVLKTPCKKC-UHFFFAOYSA-N 409.489 2.884 5 40 HFBB COc1ccc(Cl)cc1NC(=O)COC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 21421525 LPZMUNAGDAPXAW-UHFFFAOYSA-N 422.777 2.824 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2-c2nc(C3CC3)n[nH]2)ccc1O 26541356 OVGBNPQUXWNXIT-UHFFFAOYSA-N 401.404 2.764 5 40 HFBB O=C1[C@@H]2[C@@H](c3ccc(Cl)cc3)N3CCCN3[C@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 102681500 PSIPYZBNSNOTQZ-KZNAEPCWSA-N 412.833 2.784 5 40 HFBB CCOC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225074336 GTHXWXYDUWDXFK-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@@]2(CCCC[C@H]2NCc2cccnc2)C1 306133260 MGUIUDHIGPYTFL-IRLDBZIGSA-N 410.474 2.933 5 40 HFBB COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2-c1ccc(OC)cc1 2279054 XRAIWNKREAJNBZ-UHFFFAOYSA-N 401.426 2.939 5 40 HFBB CCc1ccccc1N1C[C@@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 5786587 VTMNETPIHYPECV-HNNXBMFYSA-N 411.414 2.692 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N[C@H](CC(=O)Nc1cccc(C(C)=O)c1)C(=O)O 6590287 PBOHNULHPMPGTK-MRXNPFEDSA-N 401.375 2.700 5 40 HFBB CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1 19163495 IAEWAYAYGQLPHX-UHFFFAOYSA-N 401.803 2.890 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])N1CCN(CCOc2ccc(Cl)cc2)CC1 23731724 WRNHDRMVKLPJRF-UHFFFAOYSA-N 419.865 2.850 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N[C@@H]1c2ccccc2C[C@@H]1O 53602100 NJNDJELKWWXFDB-LSDHHAIUSA-N 402.350 2.959 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@H]([C@H]4C(c5cccc([N+](=O)[O-])c5)=NO[C@H]34)[C@H]2C(=O)N1c1ccccc1 100204832 NZMQAHHANQBGMI-HHVJRXKPSA-N 403.394 2.769 5 40 HFBB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1=O 408548040 CHLBRECUGVGDAI-KPKJPENVSA-N 405.750 2.574 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 11024262 KCHCKPCXEDFKQB-KEYYUXOJSA-N 409.320 2.699 5 40 HFBB COc1ccc(S(=O)(=O)N2CCN=C2SCc2cccc([N+](=O)[O-])c2)cc1 2711841 VXHNQJWDHAXABF-UHFFFAOYSA-N 407.473 2.897 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2OC)cc([N+](=O)[O-])c1 3513576 PVINZZIDQLADMP-LLVKDONJSA-N 402.359 2.574 5 40 HFBB COc1ccc(CCNC(=O)[C@@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)cc1OC 20648753 WTOYLIITJJSIIC-MRXNPFEDSA-N 414.462 2.582 5 40 HFBB COc1cc(OCC(=O)N(C)Cc2nc(-c3ccc(C)cc3)no2)ccc1[N+](=O)[O-] 219829642 DIUCXHMHVMFNRX-UHFFFAOYSA-N 412.402 2.999 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)N[C@H](C)c1ccccc1)S(C)(=O)=O 220384323 KYRQYBQWYLORNL-CABCVRRESA-N 405.476 2.935 5 40 HFBB COc1ccc(NC2=N[C@@H](c3ccc([N+](=O)[O-])cc3)n3c(nc(C)cc3=O)N2)cc1 7496347 GJGJTAKBESGSDY-GOSISDBHSA-N 406.402 2.909 5 40 HFBB COc1cccc(NC(=O)COC(=O)CCCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 8413029 ZHMCYKRSFLGGQV-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB CC1CCC(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 28276285 GJFZZTQQKZRPNK-JMLCCBQJSA-N 409.508 2.833 5 40 HFBB CC[C@H](C(=O)Nc1ccc(OC)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222515037 VFLLOTYYJVFQNF-QGZVFWFLSA-N 407.448 2.787 5 40 HFBB COc1ccc(C(=O)Nc2nc(CN3C[C@H](C)O[C@H](C)C3)cs2)cc1[N+](=O)[O-] 12783328 CCFAAYZFRVMMDS-TXEJJXNPSA-N 406.464 2.921 5 40 HFBB O=C(N/C(=C\c1ccccc1Cl)C(=O)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 13126092 OMTLNRFAWRODPR-AQTBWJFISA-N 415.833 2.878 5 40 HFBB O=C(N[C@H]1C=Nc2ccc([N+](=O)[O-])cc2NC1=O)c1cc(Cl)cc([N+](=O)[O-])c1 5809421 ZGHYXQZXLUYDJA-AWEZNQCLSA-N 403.738 2.609 5 40 HFBB O=C(CN1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)NCC1CC1 40120734 PQQDLSBCUTUURV-UHFFFAOYSA-N 414.531 2.967 5 40 HFBB O=C(NCc1ccco1)[C@H](C(=O)c1cccc([N+](=O)[O-])c1)n1cc(Cl)ccc1=O 199408113 BPMCRRXMLSDDEV-KRWDZBQOSA-N 415.789 2.743 5 40 HFBB Cc1c(N(CC(=O)N[C@@H]2CCCc3ccccc32)S(C)(=O)=O)cccc1[N+](=O)[O-] 220035519 WCLMDZNBGGVXDH-QGZVFWFLSA-N 417.487 2.863 5 40 HFBB Cc1cc(C(=O)NCC(=O)OCC(=O)Nc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] 3412620 BBSWNCJMQMKRJI-UHFFFAOYSA-N 413.430 2.938 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@@H]([C@H]4C(c5ccc([N+](=O)[O-])cc5)=NO[C@H]34)[C@H]2C(=O)N1c1ccccc1 4744604 LOGYSZUFTVYLIL-NJHADGRTSA-N 403.394 2.769 5 40 HFBB C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 9843043 IDTBIJMXKCCQFR-CYBMUJFWSA-N 413.386 2.853 5 40 HFBB O=[N+]([O-])c1cccc([C@@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)c1 10232641 PVVPQOWTACVCDK-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB O=C(O)CCCN1C(=O)c2cccc3c(Br)c([N+](=O)[O-])cc(c23)C1=O 95470815 IKEBWPDQQXMFFE-UHFFFAOYSA-N 407.176 2.971 5 40 HFBB O=C(NCCN1C(=O)S/C(=C/c2ccc(F)cc2)C1=O)c1ccc([N+](=O)[O-])o1 96544253 RQWVYMTXPWYUGF-UKTHLTGXSA-N 405.363 2.793 5 40 HFBB COCCn1/c(=N/C(=O)c2ccc([N+](=O)[O-])o2)sc2cc(OC)c(OC)cc21 101035661 YCHIFCWJOLCYHQ-ZCXUNETKSA-N 407.404 2.609 5 40 HFBB O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)NC1CC1 2634714 RUHKUMNBAQATRC-UHFFFAOYSA-N 402.790 2.915 5 40 HFBB CNc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 4509188 SAHRQXSKFMEJGA-LLVKDONJSA-N 401.375 2.592 5 40 HFBB O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(=O)N1CCOCC1 12983434 GYCPKSDKLFZMBB-UHFFFAOYSA-N 401.444 2.798 5 40 HFBB CCOCCCn1c(=N)c(C(=O)NC2CCCC2)cc2c(=O)n3cccc(C)c3nc21 100628082 CDRACUKPGWNTPP-UHFFFAOYSA-N 423.517 2.536 5 40 HFBB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)COC(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)C2 102140780 XZMFSGAQVLGXAZ-RBOBLBHYSA-N 404.419 2.811 5 40 HFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccn(OCc2ccccc2F)c1=O 4326178 QQNLYHUENGBYSK-UHFFFAOYSA-N 401.325 2.916 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3ccc(F)cc3)CC2=O)cc1[N+](=O)[O-] 8433895 LWQZGVNFZCOZEJ-ZDUSSCGKSA-N 415.377 2.577 5 40 HFBB Cc1nc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc([N+](=O)[O-])cc2)sc1C 28425476 NPWGLMPYFUQHDT-OAHLLOKOSA-N 424.504 2.850 5 40 HFBB CC[C@H](NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1ccc(S(C)(=O)=O)cc1 219828823 LBDBZBSSYYQTHS-INIZCTEOSA-N 422.459 2.653 5 40 HFBB Cc1cccc(CCCNC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220417468 LLTOGZHCLKPYRF-INIZCTEOSA-N 419.503 2.807 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 408678862 DNRWERGCZQGOPY-XAMWDVODSA-N 417.421 2.959 5 40 HFBB O=C(OCc1cc(=O)n2cc(Br)ccc2n1)c1cccc([N+](=O)[O-])c1 3313582 AZNUAAOWFYOKNO-UHFFFAOYSA-N 404.176 2.722 5 40 HFBB Cc1cc(C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2)ccc1[N+](=O)[O-] 22438209 UCNZGLNZXCJOLR-UHFFFAOYSA-N 414.487 2.862 5 40 HFBB CS(=O)(=O)c1ccc(N2CCCC[C@@H]2CNC(=O)c2ccccc2)c([N+](=O)[O-])c1 72310227 TYKUFOKCPQXKQS-MRXNPFEDSA-N 417.487 2.787 5 40 HFBB O=C(O)[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 547878916 HZEUMUBLUQIGLN-AWEZNQCLSA-N 412.851 2.611 5 40 HFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CNc1ccccc1I 865512 APLYMTOSYDRLEC-UHFFFAOYSA-N 423.166 2.865 5 40 HFBB CNc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] 6507386 LHGHYPMXESHCKQ-UHFFFAOYSA-N 401.375 2.593 5 40 HFBB C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(n2c(=O)[nH]c3ccccc32)CC1 32806180 MVJASROCYALTKM-AWEZNQCLSA-N 409.446 2.902 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](c1c(C)nn(C)c1C)C(F)(F)F 95408814 RAKCUBOVBDCEGH-AWEZNQCLSA-N 406.386 2.835 5 40 HFBB O=C1[C@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)N1CCCN1[C@H]2c1ccc(Cl)cc1 102681042 BNSAJMZXAPGHAE-FGTMMUONSA-N 412.833 2.784 5 40 HFBB O=[N+]([O-])c1ccccc1[C@H]1c2c(/C=C/c3ccccc3)nnc(O)c2Nc2nnnn21 10297892 ZEKDLMZBJGWKQT-ZGKFYVQTSA-N 414.385 2.942 5 40 HFBB CCc1ccccc1NC(=O)CN1C(=O)N/C(=C/c2ccc(OC)c([N+](=O)[O-])c2)C1=O 409229953 AGDAODBKSACRPC-MHWRWJLKSA-N 424.413 2.697 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 4393611 VYVZQJKUYYPXIG-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CCC2 5252913 NMODBRSSSQOAHN-UHFFFAOYSA-N 408.414 2.861 5 40 HFBB Cc1ccc(O)c(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 17090581 DODWEOJUPXRJSC-UHFFFAOYSA-N 416.459 2.572 5 40 HFBB C[C@@H](OCC(F)(F)F)C(=O)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 43008012 YLKQESJRYMVGLX-GFCCVEGCSA-N 412.368 2.759 5 40 HFBB O=C(C1=NO[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12)c1cccc2ccccc12 100355324 PRJIOQNROJDCJD-XLIONFOSSA-N 415.361 2.875 5 40 HFBB CC[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1ccc(OC)cc1)S(C)(=O)=O 220646164 PVCAPNSHRCFPCG-KRWDZBQOSA-N 407.448 2.787 5 40 HFBB C[N+](C)(C)CCCCCNC(=O)c1ccc(C(=O)NCCCCC[N+](C)(C)C)cc1 575442826 DUSJERBGADZBLB-UHFFFAOYSA-P 420.642 2.899 5 40 HFBB O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)NCCc1ccc(Cl)cc1Cl 2621193 ATGIUSMAYSFJIM-UHFFFAOYSA-N 421.240 2.970 5 40 HFBB CCc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4393630 BOQZMORDPYBFTJ-MSOLQXFVSA-N 401.444 2.769 5 40 HFBB Cc1ccc(/C=C2\SC(=O)N(CC(=O)Nc3ccc([N+](=O)[O-])cc3O)C2=O)o1 16921276 YUMJPIVMXKRNPA-AUWJEWJLSA-N 403.372 2.877 5 40 HFBB CCOc1ccccc1N1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1 28498030 SXBJDTZBLKHNIX-UHFFFAOYSA-N 405.476 2.813 5 40 HFBB CCCc1ccc([C@@H](C)N(CC(N)=O)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 58154959 WWPGKDUECLLYBT-CQSZACIVSA-N 405.476 2.785 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1NC[C@H]1COc2ccccc2O1 5693684 ITPBITUWORIACO-AWEZNQCLSA-N 419.459 2.631 5 40 HFBB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 8644144 GWTLALCARCENAF-LJQANCHMSA-N 400.366 2.530 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccc(Br)cc1 100858725 XLSYZQQQEVRNQE-HIFRSBDPSA-N 416.187 2.650 5 40 HFBB COc1ccc(Br)cc1S(=O)(=O)n1cnc2cc([N+](=O)[O-])ccc21 863569 SRALHPXNRWSXME-UHFFFAOYSA-N 412.221 2.953 5 40 HFBB Cc1cc(NC(=O)CSc2nnc3ccc(-c4cccc([N+](=O)[O-])c4)nn23)no1 9829072 WDYPDNRCUZVLBY-UHFFFAOYSA-N 411.403 2.727 5 40 HFBB CCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(Cc2cn3ccccc3n2)CC1 60112861 CKXFAOYULANPGS-UHFFFAOYSA-N 409.446 2.741 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)Nc2ccc(NC(C)=O)cc2)CC1=O 408647884 XUZWYRGHYONVMJ-CYBMUJFWSA-N 412.402 2.553 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 39986144 KAMBLPYUVKGIDX-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB CCc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3-n3cnnc3)CC2)cc1 70461856 DTXNCKHOQGCDEM-UHFFFAOYSA-N 406.446 2.700 5 40 HFBB COc1cccc(-c2noc(CN(C)S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)n2)c1 223762895 AJGLQJSNLOLNFW-UHFFFAOYSA-N 418.431 2.783 5 40 HFBB COC(=O)C(C(=O)OC)[C@@H](c1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)[N+](=O)[O-] 1722457 BGUMLHXQINGZKB-WBVHZDCISA-N 402.359 2.659 5 40 HFBB COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2OC)cc([N+](=O)[O-])c1 3513574 PVINZZIDQLADMP-NSHDSACASA-N 402.359 2.574 5 40 HFBB C[C@@H](NC(=O)c1ccccc1)C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 16684597 IOFOHUJCUMJSNC-LLVKDONJSA-N 405.794 2.548 5 40 HFBB O=C(COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)Nc1ccc(F)c(F)c1 33401429 BIMNSOZASYCXOA-UHFFFAOYSA-N 421.356 2.505 5 40 HFBB Cc1ccc(Oc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])cc1C 35574375 LXMCIULREVRYGD-UHFFFAOYSA-N 405.476 2.940 5 40 HFBB COc1ccc(CCNC(=O)c2ccc3nc4ccccc4c(=O)n3c2)cc1OC 57477717 CZYJCEYUXIMNKF-UHFFFAOYSA-N 403.438 2.837 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)C[C@H]1CNC(=O)OC(C)(C)C 95971292 YKRYYFMOWAYRTL-OAHLLOKOSA-N 407.471 2.576 5 40 HFBB CCn1c(=N)c(S(=O)(=O)c2ccc(C)c(C)c2)cc2c(=O)n3cc(C)ccc3nc21 100942178 KWRGQAWGAFUBTN-UHFFFAOYSA-N 422.510 2.907 5 40 HFBB Cc1c(NC(=O)COc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cccc1[N+](=O)[O-] 6200727 KDKPXTALLRVRML-UHFFFAOYSA-N 421.475 2.998 5 40 HFBB CN(C)CCN(C(=O)c1ccc([N+](=O)[O-])o1)c1nc2cc3c(cc2s1)OCCO3 10065997 LTTINWWRXQFTTL-UHFFFAOYSA-N 418.431 2.777 5 40 HFBB Cc1cc(C(=O)N(C)CC(=O)N2c3ccccc3NC(=O)C[C@H]2C)ccc1[N+](=O)[O-] 12764966 IBFCVFIKUATALL-CQSZACIVSA-N 410.430 2.739 5 40 HFBB O=c1cc(CN2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)nc2sccn12 15143769 GXQMJULRTSMRES-UHFFFAOYSA-N 405.867 2.640 5 40 HFBB CC(C)N(CCNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(C)C 84597265 LRMPITOYTWSXCU-UHFFFAOYSA-N 408.318 2.754 5 40 HFBB C[C@@H](C(=O)NCc1ccc(Cl)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220404727 DJQXHVPZPJIYRS-LBPRGKRZSA-N 411.867 2.719 5 40 HFBB O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)N1CCC(Cc2ccccc2)CC1 3602309 IKSYLBOMHXLIBR-UHFFFAOYSA-N 407.426 2.672 5 40 HFBB O=C1C[C@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 5578168 IKZBGIQAPPMHCZ-UWWQBHOKSA-N 408.332 2.948 5 40 HFBB Cc1ccc(NC(=O)COC(=O)CCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] 7939704 SLXBSIFRQBOINM-UHFFFAOYSA-N 403.366 2.943 5 40 HFBB COc1ccc(CC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC 16143236 IQNUSEGNSBXAGR-UHFFFAOYSA-N 404.419 2.531 5 40 HFBB COc1ccccc1N1CCN(C(=O)c2cn[nH]c2-c2ccc([N+](=O)[O-])cc2)CC1 72328747 VWQHYILUIIAIPC-UHFFFAOYSA-N 407.430 2.956 5 40 HFBB C[C@@H](C(=O)N[C@H](C)CCc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220413852 KYSLIEMQBVEPFP-CVEARBPZSA-N 419.503 2.887 5 40 HFBB Cc1c(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)c(=O)n(-c2ccccc2)n1C 4008762 RYZWGBJDJLIZQZ-UHFFFAOYSA-N 422.850 2.847 5 40 HFBB O=C(CSc1ccc2nnc(-c3ccncc3)n2n1)Nc1ccc([N+](=O)[O-])cc1 9599849 FAZNLGFTQDKADJ-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB O=C(O)c1cc(Br)ccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 13342857 AYXLVSSBTCAKII-UHFFFAOYSA-N 401.194 2.856 5 40 HFBB Cc1ccc(C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] 13986705 WNJZMJJPPFTHSQ-INIZCTEOSA-N 422.441 2.961 5 40 HFBB O=C(NCc1cccnc1)C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 30655343 YSBGVZUWTWTAHW-UHFFFAOYSA-N 402.838 2.812 5 40 HFBB O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(CS(=O)(=O)C(F)F)cc1 89787933 PNQHHMTVBBLWKT-UHFFFAOYSA-N 410.358 2.861 5 40 HFBB COC(=O)C1=C(O)[C@@H](C(=O)OC)[C@H]2c3ccccc3[C@H]1[C@@]2(c1ccccc1)[N+](=O)[O-] 100644113 WPDBGDWRNAAKCD-BREDGVMVSA-N 409.394 2.828 5 40 HFBB COc1cccc(N([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)c1 220171591 HHKMRGNQOJONJX-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COc1ccc2nc(NC(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)sc2c1 3479247 LULWWKSKVPISEH-UHFFFAOYSA-N 400.416 2.972 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1C 8038801 JXEIJEGGBMXGPS-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCCC(=O)/N=c1/c(C(=O)OCC)cc2c(=O)n3ccccc3nc2n1CC(C)C 31936999 ANDVOLANQSDJSX-GFMRDNFCSA-N 410.474 2.709 5 40 HFBB C[C@H](O)C[C@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1 79104836 IIGVKBXENOVMRY-QFBILLFUSA-N 413.474 2.716 5 40 HFBB COc1cc(C=O)cc(Br)c1OS(=O)(=O)c1cccc([N+](=O)[O-])c1 95470235 WGUUEQQUDULZCY-UHFFFAOYSA-N 416.205 2.946 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C 408606995 MUEIKHNMENPVSO-CQSZACIVSA-N 421.475 2.916 5 40 HFBB Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC[C@@H]1CCCO1 4698029 RADHFQNRCYBZBY-KRWDZBQOSA-N 419.459 2.613 5 40 HFBB CC[C@@H](C(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 12764644 CKGICXMSJVMIPA-MRXNPFEDSA-N 405.476 2.720 5 40 HFBB O=C(Nc1ccccc1CN1CCSCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 58138698 QHTCBSGSRWMMLL-UHFFFAOYSA-N 424.486 2.977 5 40 HFBB CCN(CC)CCN(CC(=O)NC1CCCCC1)C(=O)c1ccc([N+](=O)[O-])cc1 5453244 SPPTZIIONCJRCO-UHFFFAOYSA-N 404.511 2.828 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NC[C@@H](CO)Cc1ccco1 24205976 ZXHBPMLKIMEMNB-JTQLQIEISA-N 408.354 2.744 5 40 HFBB O=C(COc1ccccc1C(=O)N1CCOCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 24438783 CZBNIBBIJWIFAQ-UHFFFAOYSA-N 419.821 2.738 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCC(=O)Nc1ccncc1 58174284 RYNZJOJXNVFTPN-UHFFFAOYSA-N 400.438 2.695 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCCc1ccc(OC(F)F)cc1 6589976 JYCCFQCGZZACDK-UHFFFAOYSA-N 407.373 2.675 5 40 HFBB O=C(CSc1nnc(-c2cccnc2)s1)Nc1cc(C(=O)O)cc([N+](=O)[O-])c1 14944531 YTCRVDQQQOOAKN-UHFFFAOYSA-N 417.428 2.937 5 40 HFBB Cc1nn(C(=O)c2ccccc2[N+](=O)[O-])c(C)c1S(=O)(=O)N1CCC(C)CC1 16976555 ZDAVLYVPLWULIY-UHFFFAOYSA-N 406.464 2.517 5 40 HFBB COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1 32778229 VDQKKNHNNMAGHY-UHFFFAOYSA-N 405.476 2.731 5 40 HFBB CN1CCN(c2cc(C(=O)c3ccccc3O)cn3c(=O)c4ccccc4nc23)CC1 6651910 OBUIWBJGFBGHHE-UHFFFAOYSA-N 414.465 2.536 5 40 HFBB COc1ccc(C)cc1CCNC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O 12926540 UTVYROGDUAVWCV-UHFFFAOYSA-N 422.441 2.739 5 40 HFBB Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(-c2noc(-c3ccncc3)n2)cc1 15022581 QHHSSNSWRGYQQF-UHFFFAOYSA-N 405.374 2.850 5 40 HFBB CC(=O)[C@H]1[C@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@H]2[C@@H]2C=Cc3ccccc3N21 16037558 WPYHZQLSBWADGA-VMXMFDLUSA-N 417.421 2.882 5 40 HFBB COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 48302968 RPQWCAFHJSOLBD-LJQANCHMSA-N 412.446 2.669 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 170506167 BSPCBUCEMAJTSF-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB O=C(Cn1ccs/c1=N\C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 409205262 AYLPRKVTAZMXOY-HNENSFHCSA-N 412.383 2.990 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(S(=O)(=O)NCC(C)C)cc1 409244513 DVKZOQMORIXGSF-UHFFFAOYSA-N 421.475 2.855 5 40 HFBB CC(=O)N1N=C(c2cccc(NS(C)(=O)=O)c2)C[C@@H]1c1cccc([N+](=O)[O-])c1 4036112 DBOTWWGDUKBXBS-GOSISDBHSA-N 402.432 2.664 5 40 HFBB CCN(CC(F)(F)C(F)F)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 4794476 GCOOCEDEUUEMBU-UHFFFAOYSA-N 403.310 2.633 5 40 HFBB O=C(NCCNC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1nc(C2CCCCC2)no1 21452476 NRIVBZGGKJRQFT-UHFFFAOYSA-N 421.841 2.839 5 40 HFBB COCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H]2CCCN2C[C@@H]1C 1519068426 VETNXFHDSYWEPO-YJBOKZPZSA-N 400.483 2.563 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O 24068369 UPRGVKRJQPWFEH-ODXCJYRJSA-N 402.451 2.979 5 40 HFBB O=C(NC(=S)Nc1cccc(F)c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 408620404 ISBPFECPZGNBRB-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB COc1cc(C(=O)OCC(=O)N2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])cc1OC 3450096 HMVGDIOGMYHTSS-LBPRGKRZSA-N 400.387 2.747 5 40 HFBB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3596263 FEGHIMNENHEMOR-FQEVSTJZSA-N 414.393 2.920 5 40 HFBB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)c([N+](=O)[O-])c1 4469015 VPTYPBADHJDSGW-NRFANRHFSA-N 408.414 2.625 5 40 HFBB CCCn1c(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)nc2ccccc21 6587435 GIBFFIORVCTUGU-UHFFFAOYSA-N 407.386 2.589 5 40 HFBB CCOc1ccccc1COc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 16091209 QRLHPHXJDHGXMQ-UHFFFAOYSA-N 422.459 2.593 5 40 HFBB CCOc1cc([C@@H]2NC(=O)c3c(sc4c3CCN(C)C4)N2)cc([N+](=O)[O-])c1O 18046179 YHPWWKZOMYKNBF-MRXNPFEDSA-N 404.448 2.603 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCCN1[C@H]2c1ccccc1 19169674 VSDIHQASPCYNQC-BZSNNMDCSA-N 412.833 2.784 5 40 HFBB CNc1ccc([C@H]2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC(C)C)cc1[N+](=O)[O-] 57464783 VBHKHBFJDXHFAU-SFHVURJKSA-N 403.435 2.996 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)C[C@@H]1CNC(=O)OC(C)(C)C 95971291 YKRYYFMOWAYRTL-HNNXBMFYSA-N 407.471 2.576 5 40 HFBB O=[N+]([O-])c1ccc(NCc2cccc(Cl)c2)c(S(=O)(=O)N2CCOCC2)c1 12556411 ISLBFOVQVWLTFN-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB COc1cccc([C@@H](NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c2nccn2C)c1 17522316 HLWRKKKGRLJUIO-GOSISDBHSA-N 416.459 2.713 5 40 HFBB CC(=O)C1=NN(c2cccc(Cl)c2)[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]12 18190498 FQULRKZWCCGDQF-WBVHZDCISA-N 412.789 2.571 5 40 HFBB Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 22061549 SVLFGNFBPUFFQD-KSSFIOAISA-N 417.487 2.813 5 40 HFBB COc1ccc(NC(=O)CN2C(=O)S/C(=C/c3ccc([N+](=O)[O-])o3)C2=O)cc1 409255204 YKORFGVOWVZPLA-MDWZMJQESA-N 403.372 2.871 5 40 HFBB COc1ccc(-n2nc3c(c2NC(=O)c2ccccc2[N+](=O)[O-])C[S@@](=O)C3)cc1 2724991 AWIHYCRHJDUJAB-LJAQVGFWSA-N 412.427 2.804 5 40 HFBB Cc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1C 4393615 OGZOITFFPLASDZ-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)cc1[N+](=O)[O-] 7940225 RJDXMSVUHAGGAG-AWEZNQCLSA-N 403.435 2.566 5 40 HFBB Cc1cc(C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)c(C)n1[C@@H](C)c1ccccc1 27054158 YIRPWSLNBSDTRI-AWEZNQCLSA-N 422.441 2.766 5 40 HFBB COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222593465 ZNNJNJLWFGYHNA-ZIAGYGMSSA-N 421.475 2.635 5 40 HFBB COc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 9355750 RKQPFEDOISTJPV-UHFFFAOYSA-N 419.459 2.643 5 40 HFBB Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccn(C)n3)cc2)cc1[N+](=O)[O-] 10135496 VHSXTBHLUKIKPX-UHFFFAOYSA-N 415.431 2.690 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3C)C(=O)[C@H]2[C@@H]2C=Cc3ccccc3N21 16035170 DXVZRCABYVDXEY-UWHLTILDSA-N 417.421 2.882 5 40 HFBB CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 16320914 ODGSNOKYLITMKT-UHFFFAOYSA-N 417.472 2.555 5 40 HFBB C[C@@H](Sc1n[nH]c(=O)n1CCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 26335777 QRXSQVNYFGQZGD-CYBMUJFWSA-N 413.459 2.842 5 40 HFBB CC(=O)Nc1ccc(NC(=O)CSc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 2685320 YZDLJPAZMVMJLU-UHFFFAOYSA-N 423.472 2.688 5 40 HFBB COc1cccc(NC(=O)COC(=O)CCCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 8417301 JAZXPSVFDKQXNL-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB Cc1ccc([C@H]2c3c(-c4cccc([N+](=O)[O-])c4)nnc(O)c3Nc3nnnn32)cc1 10296454 UDZZKCOTHLFAPP-KRWDZBQOSA-N 402.374 2.747 5 40 HFBB Cc1ccccc1N1C(=S)N(c2ccc([N+](=O)[O-])cc2)[C@H]2CS(=O)(=O)C[C@@H]21 12421634 KILJAUPCAWJQHD-IRXDYDNUSA-N 403.485 2.680 5 40 HFBB CCOc1ccc(CN2CCN(S(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 45799108 HSSHFUPOEIPTRH-UHFFFAOYSA-N 419.503 2.641 5 40 HFBB O=c1c2c3nc4ccccc4nc3n(C[C@H]3CCCO3)c2ncn1C[C@H]1CCCO1 2220720 DJUCCVCQOMVAJM-HUUCEWRRSA-N 405.458 2.652 5 40 HFBB O=C1N[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4263334 KCHCKPCXEDFKQB-GRDNDAEWSA-N 409.320 2.699 5 40 HFBB Cc1ccc(NC(=S)NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c(O)c1 17090583 UYKFFWFKHOUIHL-UHFFFAOYSA-N 416.459 2.572 5 40 HFBB O=C(NCc1ccc(CN2CCOCC2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 32926761 NQLJKFAOHOXQPZ-UHFFFAOYSA-N 421.457 2.543 5 40 HFBB NC(=O)CCn1c(SCCOc2cccc([N+](=O)[O-])c2)nnc1-c1cccs1 40127875 PJOYOFPVXQIAIN-UHFFFAOYSA-N 419.488 2.961 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)/N=c2/sc3cc([N+](=O)[O-])ccc3n2C)cc1 101036806 QVGAEVXUDPMJOF-VHEBQXMUSA-N 419.484 2.748 5 40 HFBB COc1ccc(C(=O)[C@@H](C)OC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 408651216 NHTDSPPLKOPFHH-UKRRQHHQSA-N 412.398 2.771 5 40 HFBB CCOc1cc(/C=C2\SC(=O)N(CC(=O)OCC(C)C)C2=O)cc([N+](=O)[O-])c1O 409210213 IRDXGHHSFTZTDI-AUWJEWJLSA-N 424.431 2.935 5 40 HFBB COc1ccc(N2C[C@@H](NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2=O)cc1OC 4497698 VULWDBMHDRFXED-ANOSYLROSA-N 411.414 2.547 5 40 HFBB Cc1ccc(C)c(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1 8036460 UAYUEJSPGLXBQC-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 9963355 GPRPRLWENHXDDP-NSHDSACASA-N 400.420 2.698 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCCSc1ccccc1)S(C)(=O)=O 10360998 UOXGVFGPTJBWOH-UHFFFAOYSA-N 423.516 2.578 5 40 HFBB C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1)c1ccc(F)cc1 12641708 BZBUXYWGBDLYMF-CYBMUJFWSA-N 409.439 2.928 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCc2noc(-c3ccco3)n2)c([N+](=O)[O-])c1 12853332 MHALGTRZEJGKET-UHFFFAOYSA-N 422.419 2.847 5 40 HFBB COc1cccc(-n2nnnc2SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 15079590 JDSUYFNWNQKINF-UHFFFAOYSA-N 400.420 2.618 5 40 HFBB CCc1ccc(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2OC)S(C)(=O)=O)cc1 409119489 SODJHYXZVQDWDI-UHFFFAOYSA-N 407.448 2.571 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccc(F)cc1 8050840 SJCNGEADWBXRRX-ZDUSSCGKSA-N 409.439 2.928 5 40 HFBB CC(C)[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 8124456 DBYMDHRODAPAQZ-FQEVSTJZSA-N 413.430 2.609 5 40 HFBB O=C1[C@@H]2[C@@H](c3ccccc3)N3CCCN3[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 102694541 VSDIHQASPCYNQC-KZNAEPCWSA-N 412.833 2.784 5 40 HFBB COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222593526 ZNNJNJLWFGYHNA-UONOGXRCSA-N 421.475 2.635 5 40 HFBB CCOc1ccccc1NC(=O)COC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 3291031 RFHRJIKMJDJLBV-UHFFFAOYSA-N 402.359 2.576 5 40 HFBB O=[N+]([O-])c1ccccc1[C@@H]1c2c(-c3ccc(F)cc3)nnc(O)c2Nc2nnnn21 10232643 OLZNGHPYVXPTFC-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB Cc1c(C(=O)N2CCC(NS(=O)(=O)c3cccs3)CC2)cccc1[N+](=O)[O-] 11450822 KWAQUWQSSKYAOF-UHFFFAOYSA-N 409.489 2.548 5 40 HFBB C[C@H](O)C[C@@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1 79104826 IIGVKBXENOVMRY-LPHOPBHVSA-N 413.474 2.716 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220411687 LIXCEVSOTPINGL-LBPRGKRZSA-N 422.419 2.605 5 40 HFBB COC(=O)c1ccccc1NC(=O)c1cccn(Cc2cccc([N+](=O)[O-])c2)c1=O 5270726 ARZVOMMEPWYRHC-UHFFFAOYSA-N 407.382 2.844 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 7872063 YQFUVQPLSNHYLS-NSHDSACASA-N 411.411 2.536 5 40 HFBB O=C(CN(C(=O)c1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O)c1ccc(F)cc1 7881762 RDFFLYDSKFBCTM-UHFFFAOYSA-N 413.361 2.513 5 40 HFBB CCCn1c(=N)c(C(=O)NCc2ccccc2)cc2c(=O)n3cc(C)ccc3nc21 100627789 FYOOIHXLUMBRSK-UHFFFAOYSA-N 401.470 2.777 5 40 HFBB O=C(O)[C@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 547873651 RBZGHVAUJFHYGH-NSHDSACASA-N 416.814 2.609 5 40 HFBB COC(=O)c1sc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2)c(C(=O)OC)c1C 2763175 KJAYLIUYQQWTFM-SNVBAGLBSA-N 422.415 2.944 5 40 HFBB C[C@@H](OC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)Nc1cc(F)ccc1F 7820137 YQCQYDPKSDGAPZ-SECBINFHSA-N 408.313 2.828 5 40 HFBB COC(=O)c1cccc(S(=O)(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 591705835 QEOQUFQPNWAUIK-UHFFFAOYSA-N 416.415 2.676 5 40 HFBB Cc1ccc(C(=O)NC[C@H](C)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 2752862 FRNBGHBXCTWTOY-ZDUSSCGKSA-N 400.391 2.668 5 40 HFBB CSCC[C@@H](CO)NC(=O)COc1ccc2c(oc(=O)c3ccccc32)c1C 6759693 XWQXDLBIYGJPBI-AWEZNQCLSA-N 401.484 2.864 5 40 HFBB O=C(O)C[C@H](NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 7787327 SHPCUINDVWZRJA-ZDUSSCGKSA-N 402.787 2.882 5 40 HFBB CCOCCn1/c(=N/C(=O)c2ccc([N+](=O)[O-])o2)sc2cc(OC)c(OC)cc21 101035663 DZJKCIQFVQFBOE-HNENSFHCSA-N 421.431 2.999 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225793622 JBJMBMJQVPNHPS-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB COc1ccccc1[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1nccn1C 12583159 YKISLKUVQBEJKC-SFHVURJKSA-N 416.459 2.942 5 40 HFBB CC[C@@H](C(=O)NCCc1ccccc1)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 222530914 GLWMQKPPFYDIAW-SFHVURJKSA-N 419.503 2.807 5 40 HFBB Cc1nnc(N2C(=O)c3ccc(C(=O)OCc4ccc([N+](=O)[O-])cc4)cc3C2=O)s1 408680737 DUZFJSHDNWUGFQ-UHFFFAOYSA-N 424.394 2.912 5 40 HFBB O=C(NN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O)c1ccc([N+](=O)[O-])cc1 409001502 WIIXMCSMGRTNSB-NVNXTCNLSA-N 413.367 2.705 5 40 HFBB COC(=O)CN(c1cc(Cl)ccc1OC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 8729447 HRSQYNFSGYOXKS-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB Cc1cccc(OCCn2c3nc(=O)[nH]c(=O)c-3nc3cc(C(F)(F)F)ccc32)c1 8783562 AHNXUVJUJNMRHF-UHFFFAOYSA-N 416.359 2.991 5 40 HFBB biogenic,in-vitro C[C@H](OC(=O)c1ccc(CN2CCCC2=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 12797908 OEMNOXDQRMKUAW-AWEZNQCLSA-N 411.414 2.901 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H](C)c2ccc(-n3cncn3)cc2)c1C 15334261 AQGWOGBOZFIYQL-AWEZNQCLSA-N 401.448 2.832 5 40 HFBB CCCn1c(=N)c(C(=O)NCc2ccc(C)cc2)cc2c(=O)n3ccccc3nc21 100861093 YCXHJJIDXJPQHV-UHFFFAOYSA-N 401.470 2.777 5 40 HFBB O=C(NC(=S)Nc1ccc(F)cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 408623744 RSUOOXJVUFTPAT-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB COc1ccc(N2C(=O)N=C(O)[C@]3(Cc4cc([N+](=O)[O-])ccc4N(C)C3)C2=O)cc1 8995663 KQYTXCUHZCDCLQ-HXUWFJFHSA-N 410.386 2.705 5 40 HFBB C[C@@H]1CCCCN1c1ccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)nn1 10213329 GNMRKOSJNFGCAD-MRXNPFEDSA-N 410.478 2.726 5 40 HFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 12989742 ZRRRZXSDYISCPD-ZDUSSCGKSA-N 403.460 2.869 5 40 HFBB COc1ccccc1COC[C@@H](O)Cn1cnc2cc(Cl)c([N+](=O)[O-])cc2c1=O 24830209 NCOVLZJLWILJJC-ZDUSSCGKSA-N 419.821 2.544 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 220452652 XWMGYSITYNZLFO-NSHDSACASA-N 413.402 2.975 5 40 HFBB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])c(OC)cc2OC)C1=O 409018717 YOXOAEBRNULIQX-DUJAKZANSA-N 410.404 2.600 5 40 HFBB CCOc1ccc(C(C)=O)cc1COC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 3518335 XGMIEOMETDFCEA-UHFFFAOYSA-N 421.427 2.957 5 40 HFBB CCOc1ccccc1N(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 7066142 HYPZNASGHCHGPC-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB CCCn1c(=N)c(C(=O)NCc2ccc(F)cc2)cc2c(=O)n3ccccc3nc21 101127330 QJUPTVGXQPVTJP-UHFFFAOYSA-N 405.433 2.608 5 40 HFBB CN1C(=O)[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2cc(Br)ccc21 4554970 WOPIWOWQZLKLDI-QGZVFWFLSA-N 405.204 2.794 5 40 HFBB Cc1ccc(C(=O)N2CCC(NS(=O)(=O)c3cccs3)CC2)cc1[N+](=O)[O-] 11449921 NDNJEQLRYMVWTK-UHFFFAOYSA-N 409.489 2.548 5 40 HFBB Cc1ccsc1CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)C1 16742585 USILFGZGNAHFOI-OAHLLOKOSA-N 424.500 2.559 5 40 HFBB O=C(O)CN(c1cccc(Br)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113877550 IETWWSLDZMHSEO-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB CC[C@@H](C(=O)N1CCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222526406 VWCRFDKSAUUMHC-KRWDZBQOSA-N 403.460 2.729 5 40 HFBB COc1ccc(/C=C2/SC(=O)N(CC(=O)N3CCC(C)CC3)C2=O)cc1[N+](=O)[O-] 409365803 OXYLCOSGRWSIDR-MHWRWJLKSA-N 419.459 2.898 5 40 HFBB C[C@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10415438 ZWAXXKSIAGVNNU-MGPLVRAMSA-N 418.789 2.900 5 40 HFBB O=C(COc1ccc(Cl)cc1[N+](=O)[O-])NCC1(N2CCOCC2)CCCCC1 12977944 NOWFKLITHISQJZ-UHFFFAOYSA-N 411.886 2.778 5 40 HFBB COc1cc(N2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc(OC)c1OC 12980659 RARALCCJJOLLQW-GFCCVEGCSA-N 415.402 2.612 5 40 HFBB C[C@H](C(=O)NCc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 57456067 SQUMUOBFMKTKCY-QGZVFWFLSA-N 419.485 2.970 5 40 HFBB C[C@@H](OC(=O)C[C@H]1Sc2ccccc2NC1=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 12425362 NROHRHZEKCTYGD-BDJLRTHQSA-N 415.427 2.968 5 40 HFBB CC(=O)c1cccc(NC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 222363784 ZJLGXHJHZVAGIB-UHFFFAOYSA-N 419.459 2.982 5 40 HFBB COc1ccc(C(=O)[C@@H](C)OC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 7881404 SGKIACVQFCDFER-HIFRSBDPSA-N 412.398 2.771 5 40 HFBB O=C1NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCC[C@H]32)C(=O)N1C1CCCCC1 8974778 AFNXLSQGTMEUTP-UWJYYQICSA-N 412.446 2.517 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 12371141 LFHKQZIDMYRDRT-UHFFFAOYSA-N 413.839 2.662 5 40 HFBB Cc1ccc([C@H](CN2CCOCC2)NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 12783631 FFSWQXNNTDIALQ-IBGZPJMESA-N 419.503 2.563 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] 8036861 RLXJMUCHCCDGTC-ZDUSSCGKSA-N 415.377 2.577 5 40 HFBB O=[N+]([O-])c1ccc(CN2C[C@H](O)C[C@H]2c2nc(-c3ccc4c(c3)OCO4)no2)cc1 15674986 XUADLQSFRMHWGF-CVEARBPZSA-N 410.386 2.681 5 40 HFBB biogenic,in-vitro O=C(Cc1ccccc1Cl)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 25021808 MPFGODSEHFHUOS-UHFFFAOYSA-N 417.849 2.683 5 40 HFBB Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H]3CCC(=O)NC3)c([N+](=O)[O-])c2)c(C)c1 58201787 FPUSJAFWGWOXGD-CQSZACIVSA-N 418.475 2.703 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1cccc(Cl)c1 408672779 ZZCNTDYYRPSREV-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB CNc1ccc([N+](=O)[O-])cc1-n1cc2c(c1-c1ccc(C)cc1)c(=O)n(C)c(=O)n2C 4151186 QGMQWKNUDGOVFG-UHFFFAOYSA-N 419.441 2.953 5 40 HFBB COc1cccc(NC(=O)CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c1 58161345 SRMHGVYGCJOUJG-UHFFFAOYSA-N 406.826 2.766 5 40 HFBB COCCn1/c(=N/C(=O)c2ccc3c(c2)OCCO3)sc2cc([N+](=O)[O-])ccc21 100872702 RGIGVNHOPPHUQT-VXPUYCOJSA-N 415.427 2.770 5 40 HFBB COC(=O)Cn1/c(=N/C(=O)c2ccccc2[N+](=O)[O-])sc2cc(OC)ccc21 100877084 SZDOLYRNAWSVQE-HNENSFHCSA-N 401.400 2.534 5 40 HFBB O=C(CN1C(=O)c2ccc(Br)cc2C1=O)OCc1ccc([N+](=O)[O-])cc1 22505713 IIZRQLITZIHESV-UHFFFAOYSA-N 419.187 2.697 5 40 HFBB CCOC(=O)c1cnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nc1N 24456064 SNCKWOHCQFEGCN-UHFFFAOYSA-N 411.827 2.528 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2ON=C(c3ccccc3Cl)[C@H]2C1=O 103540540 SZRKLXYKGLFIIP-GDBMZVCRSA-N 401.762 2.549 5 40 HFBB COc1ccc(Cl)cc1N(CC(=O)O)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113892592 JMVZDEVCYFXJSC-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB Cc1ccc([C@H](C)NC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220420710 VLHOLQUJUQIJKP-LSDHHAIUSA-N 405.476 2.935 5 40 HFBB O=[N+]([O-])c1ccc2cnn(-c3ccc(S(=O)(=O)N4CCCC4)cc3[N+](=O)[O-])c2c1 9507048 WWMAPJWZZPWADA-UHFFFAOYSA-N 417.403 2.626 5 40 HFBB O=C(CCn1c(=O)oc2cc(Cl)ccc21)Nc1cc2c(cc1[N+](=O)[O-])OCCO2 32747501 MXKVHCFKNYZCAW-UHFFFAOYSA-N 419.777 2.956 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)Cc1ccc(OC)c(OC)c1 6552958 QVJXLBMYMWFXJY-GFCCVEGCSA-N 418.402 2.734 5 40 HFBB C[C@H]1CCN2c3ccc([N+](=O)[O-])cc3C[C@]3(C(=O)NC(=O)N(C(C)(C)C)C3=O)[C@@H]2C1 9014118 YEPHOXHJHDAUQS-LBJGKRIESA-N 414.462 2.619 5 40 HFBB O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H](c1cccs1)N1CCOCC1 12594991 YFMSMTDMSRLILV-KRWDZBQOSA-N 404.492 2.648 5 40 HFBB C[C@]1(CCc2ccccc2)NC(=O)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1=O 3322793 FLPJAYMIJWFKNW-OAQYLSRUSA-N 411.414 2.905 5 40 HFBB COc1cccc(NC(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 8416423 UXMOYIJQGYMFCN-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB COC(=O)c1cc(-c2ccc(/C=C/c3[nH]c(=O)[nH]c(=O)c3[N+](=O)[O-])o2)ccc1Cl 9234697 QFBAMFWXEAIKQN-ZZXKWVIFSA-N 417.761 2.842 5 40 HFBB O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)C(F)F)cc1 11453501 FKDHEMFYNKSTCE-UHFFFAOYSA-N 404.322 2.748 5 40 HFBB Cc1cc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)ccc1F 12594812 UGVZIECFXJMKEB-UHFFFAOYSA-N 409.439 2.675 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1 57851525 XPBXQEWMGBCHCV-CQSZACIVSA-N 402.426 2.892 5 40 HFBB CC(C)[C@@H](C)NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 225188417 PNSAHBNGRLIYQA-OAHLLOKOSA-N 405.476 2.951 5 40 HFBB O=C(Cn1nc([N+](=O)[O-])nc1Br)NC(c1ccccc1)c1ccccc1 1315745 VKACHKKCPNPLIZ-UHFFFAOYSA-N 416.235 2.855 5 40 HFBB CCOC(=O)C[C@@H](NS(=O)(=O)c1ccc(OC)c(C)c1)c1cccc([N+](=O)[O-])c1 3623159 TWROGONYHCNKRT-QGZVFWFLSA-N 422.459 2.885 5 40 HFBB O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCN1CCOCC1)c1ccccc1 6785616 JCJLDFNQQJRTIA-IBGZPJMESA-N 418.881 2.850 5 40 HFBB CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 72289309 NNHJJRZLYXDTND-WMLDXEAASA-N 418.473 2.609 5 40 HFBB CCCCOC(=O)CN1C(=O)S/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)C1=O 409344875 JKVDZTYNWGUVCT-NSIKDUERSA-N 408.388 2.703 5 40 HFBB COC(=O)/C(=C\Nc1cc(OC)cc(OC)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 575616656 WJOUJMVNDOYQHV-GZTJUZNOSA-N 422.415 2.512 5 40 HFBB O=C(Cn1cnc2c(cnn2-c2ccc(Cl)cc2)c1=O)Nc1ccc([N+](=O)[O-])cc1 9416431 YJTSXTXRDIZLGP-UHFFFAOYSA-N 424.804 2.783 5 40 HFBB Cc1cc(N2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)nc(C(C)C)n1 12847475 AWHALEXGSWXOGY-UHFFFAOYSA-N 419.507 2.636 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCc2cccc(C(=O)OC)c2)c([N+](=O)[O-])c1 24706999 SGSPXIZIBCLSFT-UHFFFAOYSA-N 422.459 2.991 5 40 HFBB CN(C)[C@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(F)c1 27145242 KMROKBGRBUDZLG-HXUWFJFHSA-N 416.453 2.603 5 40 HFBB O=C(Cn1cnc2cc(F)c([N+](=O)[O-])cc2c1=O)N1CCC[C@H]1c1cccs1 32934999 DTTIYMDVNLTTLA-AWEZNQCLSA-N 402.407 2.869 5 40 HFBB Cc1ccc(NC(=O)/C=c2/[nH]c(=O)/c(=C/c3cc([N+](=O)[O-])ccc3Cl)s2)cc1 105626523 CWNORHPJCFGAKJ-MUHQFLTOSA-N 415.858 2.554 5 40 HFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCN1C(=O)c1cccs1 2658965 BDOGOOHUUNZKQI-OAHLLOKOSA-N 418.427 2.871 5 40 HFBB CCOc1ccccc1N1CCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)CC1 29487582 CMOUUXMBPITUEK-UHFFFAOYSA-N 422.445 2.537 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccccc1C(F)(F)F 100870129 MDEYYKNAFIBUDY-HIFRSBDPSA-N 405.288 2.906 5 40 HFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCN1C(=O)c1cccs1 2658964 BDOGOOHUUNZKQI-HNNXBMFYSA-N 418.427 2.871 5 40 HFBB COc1cc(/C=C/C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)ccc1O 5754658 XGCOCGGILXCHIX-XBXARRHUSA-N 402.359 2.513 5 40 HFBB CCOC(=O)CSc1c([N+](=O)[O-])nc(C)n1Cc1ccc(OC)c([N+](=O)[O-])c1 6194902 YWSJCRNFTJQCIW-UHFFFAOYSA-N 410.408 2.720 5 40 HFBB COc1ccc(NC(=O)CCC(=O)OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 8412283 XXDZQCNAFZBXSA-UHFFFAOYSA-N 415.402 2.812 5 40 HFBB O=C1N[C@@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9090196 XHWWAARUXDSGHW-XUJVJEKNSA-N 415.349 2.760 5 40 HFBB COc1ccc([N+](=O)[O-])cc1OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1 31674040 SWRMGLKRPRZWFL-UHFFFAOYSA-N 419.865 2.980 5 40 HFBB O=C(NCCCN1CCc2ccccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 40069096 HPIGZDOUNJEGCD-UHFFFAOYSA-N 409.490 2.879 5 40 HFBB COC(=O)c1ccccc1NC(=O)c1ccc(=O)n(Cc2cccc([N+](=O)[O-])c2)c1 10187945 CSNWAPYSFIODAW-UHFFFAOYSA-N 407.382 2.844 5 40 HFBB Cc1ccc(CN(C)c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)c(C)c1 17281593 LMBVITFZFILVTH-UHFFFAOYSA-N 419.503 2.869 5 40 HFBB O=C(Nc1ccc(N2CCNCC2)c([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1Cl 20154264 NORQZLNXHKVRJK-UHFFFAOYSA-N 405.798 2.818 5 40 HFBB Cc1ccccc1NC(=S)NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 408621605 NANJELGVNBMOHE-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB O=C(NCc1cccnc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 4863880 YWDNWCZEFNPPOD-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB Cc1[nH]c(-n2nc(-c3ccco3)cc2NC(=O)c2ccc([N+](=O)[O-])o2)nc(=O)c1C 12008476 QLBMBRPCHWTJGQ-UHFFFAOYSA-N 410.346 2.586 5 40 HFBB CCS(=O)(=O)N(C)c1cc(OC)c(OC)cc1C(=O)Nc1cccc([N+](=O)[O-])c1 22252846 XWSUYTSIDCGOEL-UHFFFAOYSA-N 423.447 2.650 5 40 HFBB COc1ccccc1[C@H](C)NC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 223235103 ZEZSQFGUPRVEPL-AWEZNQCLSA-N 421.475 2.555 5 40 HFBB COc1ccccc1[C@@H]1[C@H]2SC(N)=NC2=NN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 16228423 QAFRUPKHGMKQQW-HUUCEWRRSA-N 414.403 2.817 5 40 HFBB CCOC(=O)C1=C(CN2C[C@@H](C)C[C@H](C)C2)NC(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 55226457 LJLIJZXNGHHLPB-CKFHNAJUSA-N 416.478 2.744 5 40 HFBB COC(=O)C[C@H](C(=O)OC)[C@H](C[N+](=O)[O-])c1ccc(OC)c(OC2CCCC2)c1 65336764 ANIDZYMNYALTTQ-JKSUJKDBSA-N 409.435 2.729 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccncc2)n1C 3379250 SCLHZSPVKSNPTC-UHFFFAOYSA-N 400.420 2.525 5 40 HFBB CC(C)OC(=O)[C@@H]1C[C@@](C)(O)C(=O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 4546803 DFQLPYSPKQLGGU-BZLDKRAPSA-N 421.446 2.538 5 40 HFBB O=C1N[C@@H](c2ccccc2[N+](=O)[O-])[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9090198 XHWWAARUXDSGHW-HUBLWGQQSA-N 415.349 2.760 5 40 HFBB COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1[N+](=O)[O-] 17082330 VRHUJPAHAPKCMH-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB COC(=O)c1cc(N2CCN(CCOc3ccc(OC)cc3)CC2)ccc1[N+](=O)[O-] 29345267 XHPHMQAYQREHAZ-UHFFFAOYSA-N 415.446 2.591 5 40 HFBB CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCC1(CCO)CCC1 95429401 XWVUWOWNJVFERS-INIZCTEOSA-N 411.886 2.672 5 40 HFBB O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)Nc1ccc(Br)cc1 2622475 JGAOFDNVHTTXOM-UHFFFAOYSA-N 403.192 2.706 5 40 HFBB COc1ccc(NC(=O)CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8412159 PEELFAUPIWXSBC-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB C[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)OCC(=O)NCc1ccco1 9285601 VPRAVOKVRLJFCT-JTQLQIEISA-N 415.324 2.867 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N1c2ccccc2C[C@H]1C)S(C)(=O)=O 10449933 CFCVHEYLTDNKRR-CQSZACIVSA-N 403.460 2.647 5 40 HFBB O=C(NCc1ccncc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 17168622 JKTGOHDJYDDCNO-UHFFFAOYSA-N 412.427 2.721 5 40 HFBB NC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)C(c1ccccc1)c1ccccc1 206985512 BHLIFRKNCINWDV-FQEVSTJZSA-N 403.438 2.940 5 40 HFBB O=[N+]([O-])c1ccc(-n2cccc2[C@@H]2[C@H](c3ccccn3)NC(=S)N2CCO)cc1 223589435 YHPFMXHILZVEKZ-RBUKOAKNSA-N 409.471 2.745 5 40 HFBB CCN(CC)c1cc2[nH]c(O)nc2cc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 408535371 SLIBEIQHSHEGDI-UHFFFAOYSA-N 405.436 2.824 5 40 HFBB C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(C(=O)NCc2ccccc2)CC1 12795498 BZUPTNIPRQBPHX-INIZCTEOSA-N 410.474 2.950 5 40 HFBB O=C(OCC(=O)c1c[nH]c2ccccc12)c1cc([N+](=O)[O-])ccc1N1CCOCC1 15277971 UPEHGGZCYANLIS-UHFFFAOYSA-N 409.398 2.952 5 40 HFBB O=C(CCn1ccc2ccccc21)N1C[C@@H]2C[C@H](C1)c1ccc([N+](=O)[O-])c(=O)n1C2 524731326 SUEASGXTWMXEDA-DOTOQJQBSA-N 406.442 2.747 5 40 HFBB biogenic O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 3360338 PNZBVQJFBNQMHT-UHFFFAOYSA-N 403.738 2.505 5 40 HFBB CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl 57373614 BYBVQTQGZWHHIR-LJQANCHMSA-N 403.866 2.997 5 40 HFBB Cc1c(NC(=O)[C@H](C)N(c2ccc(F)c(F)c2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220452983 AUPFGCHLACKNSJ-NSHDSACASA-N 413.402 2.975 5 40 HFBB COc1ccc(Cl)cc1N(CC(=O)O)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225028012 ZVZYIFLTHSOOPK-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB COC(=O)c1cc(C(=O)OCc2nc3sc(C)c(C)c3c(=O)[nH]2)cc([N+](=O)[O-])c1 3274908 ZQPWMXWHQMGULW-UHFFFAOYSA-N 417.399 2.653 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 4884724 MIXKIKKICSJSTA-UHFFFAOYSA-N 417.443 2.703 5 40 HFBB CC[C@H](CCNC(=O)c1cccc([N+](=O)[O-])c1)NC(=O)c1cccc([N+](=O)[O-])c1 6555354 RYSDMYNNEWQUIL-OAHLLOKOSA-N 400.391 2.832 5 40 HFBB O=C(O)C1(C(=O)O)Cc2c(ccc([N+](=O)[O-])c2N2CCCCC2)N2CCCC[C@H]21 6662771 MFNGEUALTRTGRM-INIZCTEOSA-N 403.435 2.656 5 40 HFBB Cc1ccccc1NC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc(C)c([N+](=O)[O-])c2)C1 8433903 LPLPNZFZBVJVGO-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccncc2)CC1 48333356 FULZIPMMXLGDDE-AWEZNQCLSA-N 414.487 2.891 5 40 HFBB COc1ccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1 115132238 NZABJZJYRICDSW-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB COc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3O)n2)cc1 408545019 MLLVVDKOQNCRPG-UHFFFAOYSA-N 401.404 2.825 5 40 HFBB Nn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1 5257333 JCRUJHHBOFHJBG-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB COc1cc(C(=O)NCc2ccc(CN(C)C)cc2)c([N+](=O)[O-])c(OC)c1OC 16102431 PFMPBXHZOCMWLQ-UHFFFAOYSA-N 403.435 2.612 5 40 HFBB C[C@@H](C(=O)NCCCc1ccc(F)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220416272 RAGWXGWAGAOVFD-AWEZNQCLSA-N 423.466 2.637 5 40 HFBB COC(=O)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 5560633 GDSLDIYQWPCEBM-KRWDZBQOSA-N 410.386 2.648 5 40 HFBB COc1ccc(COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1OC 7952091 WYZZXKHHVQJEPT-UHFFFAOYSA-N 402.403 2.806 5 40 HFBB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C 408555499 XGLFGJSBKBPABV-ZDUSSCGKSA-N 407.448 2.526 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N 3271764 PTKSEIRMACJCTF-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB COC(=O)c1ccc(N2CCN(CC(=O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 36023247 DKVOVVKCJFFEQF-UHFFFAOYSA-N 401.394 2.525 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2C(c3ccc(Cl)cc3)=NO[C@H]2C1=O 102562232 GNNCAMFHTUDLJS-GOEBONIOSA-N 401.762 2.549 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H]1C[C@H]2CC[C@H]1C2 108921371 FWBOHCNVWBDEKI-JKQORVJESA-N 409.508 2.852 5 40 HFBB Cc1ccc(C)c(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1 8433870 LWDDXARHISDYRA-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COc1cccc([C@H](NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c2nccn2C)c1 17522317 HLWRKKKGRLJUIO-SFHVURJKSA-N 416.459 2.713 5 40 HFBB CS(=O)(=O)N(CCCC(=O)Nc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 222361479 KNTBAQVVTLBLTF-UHFFFAOYSA-N 421.431 2.508 5 40 HFBB O=C(NN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O)c1cccc([N+](=O)[O-])c1 3015060 JDYAIGSSFQOSMV-UHFFFAOYSA-N 406.310 2.597 5 40 HFBB C/N=c1\ss/c(=N\S(=O)(=O)c2ccc(C)cc2)n1-c1ccc([N+](=O)[O-])cc1 4235222 JDMHNSKGNLDNSN-IQRFGFHNSA-N 422.513 2.637 5 40 HFBB COc1cccc(NC(=O)CN(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 8294523 VKYUWDYJTFGCTB-UHFFFAOYSA-N 412.446 2.914 5 40 HFBB COC(=O)c1cc(C(=O)N2CCCN(C)c3nc4ccccc4nc32)cc([N+](=O)[O-])c1 12993086 BOZZCEXINNPBMM-UHFFFAOYSA-N 421.413 2.811 5 40 HFBB CCN(CC)S(=O)(=O)c1cccc(NC(=O)COc2cc(C)ccc2[N+](=O)[O-])c1 24542472 ALMFDIVMIAGSBB-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB O=C1N/C(=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)C(=O)N1c1ccc(Cl)cc1 409246780 DJNFNGNXKQUWDK-WUXMJOGZSA-N 404.722 2.959 5 40 HFBB O=C(Nc1ccc(Br)cn1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4739314 OGFGNFZBYCVHNC-UHFFFAOYSA-N 407.224 2.841 5 40 HFBB Cc1ccc(C(=O)[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2)N2C(=O)CCC2=O)cc1 7881744 LUGGQCTXBWNAGK-CQSZACIVSA-N 409.398 2.681 5 40 HFBB Cc1nnc2ccc(-c3cccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)c3)nn12 12237567 JJSHUCCPCUOBCA-UHFFFAOYSA-N 410.415 2.809 5 40 HFBB O=[N+]([O-])c1ccc(CSC2=N[C@@H]3CS(=O)(=O)C[C@H]3N2c2ccccc2)cc1 32640667 BZEMBVCEVLXDTJ-IAGOWNOFSA-N 403.485 2.870 5 40 HFBB CCCc1cc(=O)n(CC(=O)Nc2ccc([N+](=O)[O-])cc2)c(-n2nc(C)cc2C)n1 5254737 WEDOFQVDSAGUAH-UHFFFAOYSA-N 410.434 2.545 5 40 HFBB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 13018271 KRSSLBJRISDVPS-UHFFFAOYSA-N 419.397 2.632 5 40 HFBB COc1cccc(N([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220171209 FAOLLDYCUZTMNT-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CCn1c(=O)n(CC)c2cc(NC(=O)CSc3ccc([N+](=O)[O-])cn3)ccc21 4997954 RGGUTDXTLGGNOW-UHFFFAOYSA-N 401.448 2.877 5 40 HFBB COc1ccc(OC)c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 6552041 URKDPRZBGGDNRX-LLVKDONJSA-N 404.375 2.805 5 40 HFBB COC(=O)C1=C(O)[C@@H](C(=O)OC)[C@@H]2c3ccccc3[C@H]1[C@@]2(c1ccccc1)[N+](=O)[O-] 100644108 WPDBGDWRNAAKCD-FCQWJQKHSA-N 409.394 2.828 5 40 HFBB CCCn1c(=N)c(S(=O)(=O)c2ccc(C)cc2)cc2c(=O)n3cc(C)ccc3nc21 100846649 NXDVSCNERACSDG-UHFFFAOYSA-N 422.510 2.988 5 40 HFBB Cc1cc(C(F)(F)F)nn1CCCNC(=O)CCn1cc(Cl)c([N+](=O)[O-])n1 2731208 VXFGNZWDYIWGCH-UHFFFAOYSA-N 408.768 2.565 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1cccc(OC)c1OC 3397280 RAAPICIDKSJRQO-LLVKDONJSA-N 404.375 2.805 5 40 HFBB CCOCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 4834634 ATAOFMIHGBTNNN-UHFFFAOYSA-N 421.475 2.860 5 40 HFBB O=C(OCCN1C(=O)c2ccccc2C1=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 5972201 OGLCDNFIVKWYLL-UHFFFAOYSA-N 409.398 2.648 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1cc(Cl)c2c(c1)OCO2 7742646 MBGCMLDEOVDVOW-UHFFFAOYSA-N 406.778 2.840 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(N(C)CC3CCCCC3)c([N+](=O)[O-])c2)CC1 12736767 SPJFLKKQJPBOKR-UHFFFAOYSA-N 410.540 2.547 5 40 HFBB C[C@@H](OC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2c(=O)[nH]1 23596602 LAMFGRSPOJCZGF-CYBMUJFWSA-N 424.413 2.586 5 40 HFBB O=C([C@H]1C[C@@H]1[N+](=O)[O-])N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 40115905 CMFDXNXNBXMTCT-OALUTQOASA-N 401.413 2.864 5 40 HFBB C[C@@H](CCc1ccccc1)NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220413663 KYSLIEMQBVEPFP-JKSUJKDBSA-N 419.503 2.887 5 40 HFBB COC(=O)CN(c1ccc(OC(C)C)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225039836 WZQIUBMHYUAFRG-UHFFFAOYSA-N 408.432 2.750 5 40 HFBB Cc1cc(NS(=O)(=O)c2ccc(CN(C)C)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 582375037 RZWJHYJSCQVWEG-UHFFFAOYSA-N 415.475 2.951 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O 2648437 SHVHTHBJMJSFOD-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB COc1cc(NC(=O)COC(=O)c2cc(=O)c3ccccc3o2)c(C)cc1[N+](=O)[O-] 5784285 CSMCTSFZJXWNTJ-UHFFFAOYSA-N 412.354 2.814 5 40 HFBB O=C(Nc1ccccc1N1CCOCC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 7842632 ZAKPUHKIPREFDN-UHFFFAOYSA-N 412.446 2.520 5 40 HFBB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 12593084 ZSBJFIZTTWQGQZ-GOSISDBHSA-N 412.471 2.747 5 40 HFBB Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)cc1 32238641 LIEMATUOCHRIIZ-IBGZPJMESA-N 409.446 2.583 5 40 HFBB Cc1ccc(S(=O)(=O)N2c3cccc4cccc(c34)S2(=O)=O)c([N+](=O)[O-])c1 1438220 ZCZOUOOMSORCRW-UHFFFAOYSA-N 404.425 2.954 5 40 HFBB Cc1ccc(C)c(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1 8036463 UAYUEJSPGLXBQC-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1c(C)nc2nc(SC)nn2c1C 12998165 QAEGDXZGFAUYAT-UHFFFAOYSA-N 402.436 2.561 5 40 HFBB Cc1ccc(S(=O)(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)c([N+](=O)[O-])c1 72274878 GURSPQIUSYMROA-UHFFFAOYSA-N 418.475 2.793 5 40 HFBB COC(=O)CN(c1cc([N+](=O)[O-])ccc1Cl)S(=O)(=O)c1ccc(OC)cc1 224872505 IYQPBISMSJUWHP-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB CC(=O)[C@H](C[C@](C(C)=O)(C(=O)OC(C)C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)C 227144389 IWLSTPVDTVMQDS-GHTZIAJQSA-N 421.446 2.920 5 40 HFBB O=C1CSc2ccc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)cc2N1 9218660 DYRVIPQXCHEDCX-UHFFFAOYSA-N 402.384 2.863 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc3n2[C@@H](CS(=O)(=O)c2ccccc2)CS3)cc1 9614814 MHTLFQVCUHKZGT-CQSZACIVSA-N 402.457 2.974 5 40 HFBB O=C1N[C@H](c2ccccc2[N+](=O)[O-])[C@@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 110548196 XHWWAARUXDSGHW-YWPYICTPSA-N 415.349 2.760 5 40 HFBB CC(C)(C)c1nnc2sc(SCC(=O)c3cccc([N+](=O)[O-])c3)nn2c1=O 11025960 CGOKCUNQXVSNRF-UHFFFAOYSA-N 405.461 2.727 5 40 HFBB CCCCn1/c(=N\C(=O)C(C)C)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 103628123 JMBFTPDKNDGAAN-CLCOLTQESA-N 410.474 2.709 5 40 HFBB CC1CCN(c2ccc(C(=O)N3CCN(c4ncccn4)CC3)cc2[N+](=O)[O-])CC1 6709211 KJKKMUDHIQRENQ-UHFFFAOYSA-N 410.478 2.584 5 40 HFBB COc1cccc(-n2ccc3nc4ccn(C[C@H]5CCCO5)c(=O)c4cc3c2=O)c1 38829104 FGTNYRZKRHRBQQ-QGZVFWFLSA-N 403.438 2.888 5 40 HFBB CN1CCN(C[C@H]2CC3(CCN(Cc4cccc([N+](=O)[O-])c4Cl)CC3)O2)CC1 306142369 WXJPOYHBPAGJIM-QGZVFWFLSA-N 408.930 2.619 5 40 HFBB COc1cccc(NC(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 8416538 JMMXHXQZCUQBLC-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB CCCCNC(=O)c1cc2c(=O)n3ccccc3nc2n(CCc2ccccc2)c1=N 101165956 KHYOYRMLLOCTDD-UHFFFAOYSA-N 415.497 2.901 5 40 HFBB Cc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220035924 JZCYQKXZBYYQJX-HNNXBMFYSA-N 405.476 2.855 5 40 HFBB COc1cc(/C=C2/SC(=O)N(CC(=O)OCC(C)C)C2=O)cc([N+](=O)[O-])c1O 409199886 FMMOMVNSFFWGDS-AWNIVKPZSA-N 410.404 2.545 5 40 HFBB COC(=O)c1c(NC(=O)c2ccccc2[N+](=O)[O-])sc2c1[C@H](C(=O)OC)CC2 1779911 HJXBIAZJAQUURT-SNVBAGLBSA-N 404.400 2.898 5 40 HFBB COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 6552973 XTVZBHUSAVULQS-LLVKDONJSA-N 402.359 2.574 5 40 HFBB COc1ccc(NC(=O)NCCN2CCN(C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 31794271 DDKSHDYHBQKUCH-HXUWFJFHSA-N 413.478 2.714 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)N1CCc2ccccc2C1)S(C)(=O)=O 220382972 MGTUCDJIPIVZOO-OAHLLOKOSA-N 417.487 2.643 5 40 HFBB C[C@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3593780 RMENPENOCDSHOW-GOSISDBHSA-N 420.784 2.793 5 40 HFBB CN1C(=O)[C@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2cc(Br)ccc21 4555007 WWMLKTNABMYNIP-KRWDZBQOSA-N 405.204 2.794 5 40 HFBB O=C1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)NC(Nc2cccc(C(F)(F)F)c2)=N1 9192459 MOHNBKOOYBJASI-AWEZNQCLSA-N 421.335 2.909 5 40 HFBB biogenic CCOc1ccc(-c2noc(CN(C)S(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 223591696 CDBAXAYUCGFCIN-UHFFFAOYSA-N 418.431 2.864 5 40 HFBB CCOC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1 7061887 WCVPDZNCPUDXIK-NVXWUHKLSA-N 405.476 2.842 5 40 HFBB C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 14139644 SKKPYKSSRYOHPX-CQSZACIVSA-N 409.446 2.902 5 40 HFBB Cc1cnc2c(S(=O)(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cccc2c1 24752373 PNWJVICFUUYMAC-UHFFFAOYSA-N 412.471 2.962 5 40 HFBB C[C@H]1CN(C(=O)COc2c([N+](=O)[O-])cnc3ccc(Br)cc23)C[C@@H](C)O1 96003402 YXZZTKVIISIDSB-PHIMTYICSA-N 424.251 2.920 5 40 HFBB Cc1c(C(=O)NC(=S)Nc2ccccc2N2CCN(C)CC2)cccc1[N+](=O)[O-] 107586772 MRKREVRJOWXAJP-UHFFFAOYSA-N 413.503 2.782 5 40 HFBB O=C(CN(C(=O)c1ccccc1[N+](=O)[O-])N1C(=O)CCC1=O)c1ccc(Cl)cc1 138653575 ZETCLIQQZFNPRK-UHFFFAOYSA-N 415.789 2.637 5 40 HFBB CCOC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225035881 GTMGFMKLGFPXCS-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 2662956 JZYUONGARMKYBF-UHFFFAOYSA-N 421.427 2.677 5 40 HFBB COc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1N1CCCCC1=O 5330201 DPMCXGGQSRXKPV-UHFFFAOYSA-N 405.432 2.921 5 40 HFBB Cc1nn(C)c(C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 7370582 HHUXAPBYSXKHII-AWEZNQCLSA-N 415.450 2.729 5 40 HFBB Cc1ccc([C@@H]2c3c(-c4ccc([N+](=O)[O-])cc4)nnc(O)c3Nc3nnnn32)cc1 10296110 BQHNHKDERADGBY-QGZVFWFLSA-N 402.374 2.747 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3cccc(F)c3)CC2)c2ccncc12 12557955 LNAKLXQWKVSAHQ-UHFFFAOYSA-N 416.434 2.793 5 40 HFBB O=C(N/C(=C\c1ccc(Cl)cc1)C(=O)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 13126093 GAGCMHZCNDHNLL-AQTBWJFISA-N 415.833 2.878 5 40 HFBB O=C(Cn1cnc([N+](=O)[O-])n1)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 40154871 FTNFPEGKHYJXCZ-AWEZNQCLSA-N 406.358 2.903 5 40 HFBB C[C@@H](C(=O)NC(C)(C)Cc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 225264830 ZUVNSCNGIISKPO-HNNXBMFYSA-N 419.503 2.887 5 40 HFBB COc1cc(Cl)c([C@@H]2CN(C)[C@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1OC 408567829 RPAMAYVIJGLZTE-UOXRKKOCSA-N 417.849 2.879 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 408642557 OVRNROQZKBKGSX-LBPRGKRZSA-N 414.374 2.812 5 40 HFBB COc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1 408651217 NHTDSPPLKOPFHH-ZFWWWQNUSA-N 412.398 2.771 5 40 HFBB CCCCN1c2ccc([N+](=O)[O-])cc2CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]1CCC 5370493 VQCSKHHKZHQIRB-KRWDZBQOSA-N 416.478 2.963 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(N2CCCC2=O)cc1 6362572 ATLWONLMUWLQOB-UHFFFAOYSA-N 413.386 2.526 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)OCCCn1c(=O)[nH]c2ccccc21 6607484 UMOCZCQWMWFQAZ-UHFFFAOYSA-N 414.418 2.543 5 40 HFBB Cc1cc(C)cc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)c1 12421638 BZNXDXZWQSANHX-ROUUACIJSA-N 417.512 2.989 5 40 HFBB Cc1ccc(NC(=O)CN2CCC(C(=O)N3CCCCCC3)CC2)cc1[N+](=O)[O-] 12889824 BLXZKYJUGZGYCA-UHFFFAOYSA-N 402.495 2.956 5 40 HFBB C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 40080553 APMQBLCXLLMRAH-MRXNPFEDSA-N 424.501 2.666 5 40 HFBB CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H](c2cccs2)N2CCOCC2)s1 95455261 QIHVGCPJZGSIJY-LBPRGKRZSA-N 417.534 2.607 5 40 HFBB CCCn1c(=N)c(C(=O)NCCc2ccccc2)cc2c(=O)n3cc(C)ccc3nc21 100627815 HKVOPZQHXWEGHZ-UHFFFAOYSA-N 415.497 2.820 5 40 HFBB O=[N+]([O-])c1cccc(-n2cccc2[C@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c1 223589266 QCYSYABARBKDJB-OALUTQOASA-N 409.471 2.745 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 3230051 FSVLKTBMSHTDEF-UHFFFAOYSA-N 409.738 2.961 5 40 HFBB Cc1cc2nnc(Sc3ccc(S(N)(=O)=O)cc3[N+](=O)[O-])n2c2ccccc12 9639266 JEHJRMJHIVAKRB-UHFFFAOYSA-N 415.456 2.898 5 40 HFBB C[C@@H](OC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1)C(=O)Nc1cccc([N+](=O)[O-])c1 21129558 JUQUKISDDRHJLI-CHWSQXEVSA-N 415.377 2.657 5 40 HFBB CN(c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 12528279 JWHQRRNLKVXCSK-GOSISDBHSA-N 417.487 2.739 5 40 HFBB O=C(NCc1ccccc1)C1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 16695342 GLORUJOZHFZKLP-UHFFFAOYSA-N 411.458 2.990 5 40 HFBB Cc1cccn2c(=O)c3cc(C(=O)NC(C)C)c(=N)n(Cc4ccccc4)c3nc12 101106976 HEZVFNURJRSGHY-UHFFFAOYSA-N 401.470 2.624 5 40 HFBB CN1CCN(C[C@@H]2CC3(CCN(Cc4cccc([N+](=O)[O-])c4Cl)CC3)O2)CC1 503877953 WXJPOYHBPAGJIM-KRWDZBQOSA-N 408.930 2.619 5 40 HFBB COC(=O)C(=C/c1nc2ccc([N+](=O)[O-])cc2s1)/C(C(=O)OC)=C1/CCCN1C 17174747 COICVVAABJJKEZ-XSJNGTIOSA-N 417.443 2.914 5 40 HFBB COC(=O)c1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc([N+](=O)[O-])c1 18017444 OXRQVGODIXEVDI-UHFFFAOYSA-N 417.849 2.993 5 40 HFBB COc1cc(C(=O)Nc2cc([N+](=O)[O-])c(OC)c([N+](=O)[O-])c2)cc(OC)c1OC 20528928 SBMQRJYPSDLYRW-UHFFFAOYSA-N 407.335 2.790 5 40 HFBB O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H](c1ccccc1Cl)N1CCOCC1 29805074 HCFWORHUXRLLOT-IBGZPJMESA-N 403.866 2.980 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1CCCN1[C@H]2C(=O)c1ccccc1 248118995 QWNBLHFUXGLTON-FRYIKTPZSA-N 419.437 2.738 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1C 408662678 PERTVWQTLBTZRU-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cn1c(SCC(=O)NC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(F)cc1 2620517 MUGMKLSUGVUBBK-UHFFFAOYSA-N 415.406 2.578 5 40 HFBB O=C(NCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc([N+](=O)[O-])cc1 2753440 VJNVPPFGDGVBOD-UHFFFAOYSA-N 412.402 2.785 5 40 HFBB COc1ccc2c(c1)C=C([N+](=O)[O-])[C@@H]([C@@H]1OC(C)(C)O[C@H]1[C@H]1COC(C)(C)O1)O2 5741845 XCSPWLQVNNIZQE-OWSLCNJRSA-N 407.419 2.745 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 7701447 WQLCSKPFJOFIEJ-UHFFFAOYSA-N 419.459 2.643 5 40 HFBB CCOc1ccc(NC(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8416332 ZFMBKCRWQRDRGV-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cnc32)cc1 10251509 NHXHFCIUHWXBRR-UHFFFAOYSA-N 424.804 2.836 5 40 HFBB Cc1ccc(/C=C2\SC(=O)N(CC(=O)Nc3cc([N+](=O)[O-])ccc3O)C2=O)o1 16921271 DRLCXDVZNDEIDB-AUWJEWJLSA-N 403.372 2.877 5 40 HFBB NC(=O)c1ccccc1NC(=S)NC(=O)c1cc([N+](=O)[O-])ccc1Br 34920987 ODGVDJAIRIUVJP-UHFFFAOYSA-N 423.248 2.583 5 40 HFBB COc1ccc(N(C)C(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1OC 58155261 LPSLTCHETGPNCJ-UHFFFAOYSA-N 401.419 2.725 5 40 HFBB O=C(O)CN(c1ccc(Br)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113876993 HGSYMCMJOKGMSC-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)Nc1cccc([N+](=O)[O-])c1 15629362 SALSVXWSSUTFID-UHFFFAOYSA-N 403.460 2.951 5 40 HFBB CCOC(=O)c1c(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)sc(C(N)=O)c1C 2737622 OSUVLLAOAWTRED-RMKNXTFCSA-N 403.416 2.892 5 40 HFBB CCNc1ccc(C(=O)O[C@@H](C)C(=O)NCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 7777954 CPQHPJOKNCXNOY-LBPRGKRZSA-N 415.402 2.617 5 40 HFBB C[C@@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10411994 RYWQUIGZYVYWBO-HWPZZCPQSA-N 418.789 2.900 5 40 HFBB Cc1ccccc1N1C(=S)N(c2ccc([N+](=O)[O-])cc2)[C@@H]2CS(=O)(=O)C[C@@H]21 12421636 KILJAUPCAWJQHD-SJORKVTESA-N 403.485 2.680 5 40 HFBB CC[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)N(c1ccccc1)S(C)(=O)=O 13711439 VCPOBLFBUCVKOO-MRXNPFEDSA-N 407.448 2.787 5 40 HFBB COCCNC(=O)CSc1ccccc1C(=O)OCc1ccccc1[N+](=O)[O-] 21742747 LTOAXFWVEJFASM-UHFFFAOYSA-N 404.444 2.807 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H]1C[C@@H]2CC[C@@H]1C2 103005854 FWBOHCNVWBDEKI-KCYZZUKISA-N 409.508 2.852 5 40 HFBB O=C(O)c1cc(C(=O)O)cc(-c2ccc(/C=C\c3nc(O)c([N+](=O)[O-])c(O)n3)o2)c1 409327607 LLWHTXLFJMEWTQ-RQOWECAXSA-N 413.298 2.623 5 40 HFBB Nc1ccc(C(=O)OCC(=O)Nc2c(F)c(F)c(F)c(F)c2F)cc1[N+](=O)[O-] 5658506 NOIAHEZHFKYBTF-UHFFFAOYSA-N 405.235 2.668 5 40 HFBB CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 6120358 LBELCCWPAZIFLK-HNNXBMFYSA-N 414.462 2.639 5 40 HFBB CCn1c(=O)sc2cc(S(=O)(=O)Nc3cc([N+](=O)[O-])ccc3OC)ccc21 225690478 TTZYBAXUPCJZOW-UHFFFAOYSA-N 409.445 2.801 5 40 HFBB C[C@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 3302822 WQBNDGJCLICCGD-NSHDSACASA-N 414.399 2.536 5 40 HFBB O=C1CCCN1CCCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] 5601832 HYKLDIALQHZEAP-UHFFFAOYSA-N 418.475 2.820 5 40 HFBB CCN1C[C@H](CN(C)C(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)Oc2ccccc21 7257052 XOKFSRZHCOUPQO-KRWDZBQOSA-N 413.430 2.741 5 40 HFBB CC(C)OC(=O)[C@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 101176166 LTAJSQLTORSAHL-OEMYIYORSA-N 421.446 2.538 5 40 HFBB C[C@H](C(=O)N[C@@H]1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220420156 WKNVPKVTVXLQFL-AUUYWEPGSA-N 417.487 2.943 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1Cl 222514903 KJQUGHORXMKMPQ-UHFFFAOYSA-N 413.839 2.905 5 40 HFBB O=C1NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCC[C@H]32)C(=O)N1C1CCCCC1 8974777 AFNXLSQGTMEUTP-LAUBAEHRSA-N 412.446 2.517 5 40 HFBB CCc1c(C(=O)NCc2nnc3n2CCCCC3)cnn1-c1ccc([N+](=O)[O-])cc1 40088915 DGFONMXTXHDBPG-UHFFFAOYSA-N 409.450 2.591 5 40 HFBB CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 50732270 JXRJXRXBOZOXSJ-JKSUJKDBSA-N 413.478 2.938 5 40 HFBB C[C@@H]1CN(C(=O)COc2c([N+](=O)[O-])cnc3ccc(Br)cc23)C[C@@H](C)O1 96003404 YXZZTKVIISIDSB-GHMZBOCLSA-N 424.251 2.920 5 40 HFBB Cc1n[nH]c(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)c1[N+](=O)[O-] 4148588 VSUOQONPLVMPEN-ZETCQYMHSA-N 409.493 2.642 5 40 HFBB O=C(CN1C(=O)c2ccc(Br)cc2C1=O)Nc1cccc([N+](=O)[O-])c1 8434677 ZUZWVGGUWFYLOG-UHFFFAOYSA-N 404.176 2.592 5 40 HFBB COc1ccc(NC(=O)CSc2nnnn2-c2ccc(C)cc2C)c([N+](=O)[O-])c1 12643464 NLIMDGWGVZVDOL-UHFFFAOYSA-N 414.447 2.927 5 40 HFBB CCc1noc(C)c1C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 13138482 QAVSSELVOLPAPF-UHFFFAOYSA-N 422.444 2.995 5 40 HFBB COc1c(F)c(F)c(C(=O)NC(=S)NNc2ccc([N+](=O)[O-])cc2)c(F)c1F 17091368 GZJXSLAMUPVFTJ-UHFFFAOYSA-N 418.328 2.791 5 40 HFBB C[C@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@H]1C[C@H]2CC[C@H]1C2 108921379 FWBOHCNVWBDEKI-QBYUYEEZSA-N 409.508 2.852 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCc2cc(OC)c(OC)cc2C1 5347565 WTQATFVIWJDQPG-UHFFFAOYSA-N 401.419 2.617 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)N[C@H](C)c1ccccc1)S(C)(=O)=O 220384401 KYRQYBQWYLORNL-HUUCEWRRSA-N 405.476 2.935 5 40 HFBB CCOC(=O)CSc1nnc(Cn2c3ccccc3c(=O)c3ccccc32)n1C 4622603 REUDDUZJERGIDN-UHFFFAOYSA-N 408.483 2.987 5 40 HFBB CC(=O)c1cccc(NC(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 8416481 HGNWRZVJWAFUEQ-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB Cc1cc(C(=O)O[C@@H](C)C(=O)N2CCN(Cc3ccccc3)CC2)ccc1[N+](=O)[O-] 16221189 UWOPBPMUIBMBHM-KRWDZBQOSA-N 411.458 2.793 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(OC)c(N2CCCC2=O)c1 20495696 OWCQHGVTVPKTSK-UHFFFAOYSA-N 421.431 2.540 5 40 HFBB CN(C(=O)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1)c1ccccc1 57452433 YMWHGCBKIKRIRC-UHFFFAOYSA-N 405.458 2.928 5 40 HFBB CCOc1ccc(NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220401420 OKCFAKKZGOBMOP-ZDUSSCGKSA-N 407.448 2.787 5 40 HFBB O=c1c(Cl)cn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1Cc1ccc([N+](=O)[O-])cc1 1514763 AQMWDQFBXFOKHX-UHFFFAOYSA-N 416.777 2.576 5 40 HFBB C[C@H](OC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 3425922 REBYXHCNFHOUJZ-ZDUSSCGKSA-N 424.475 2.550 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCC(=O)Nc2ccccc2)c1 8416272 MAQVEFPJUOBDCP-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)Nc1ccc([N+](=O)[O-])cc1Cl 31634604 VTSFGZUEXAWFLP-LJQANCHMSA-N 414.805 2.580 5 40 HFBB CNS(=O)(=O)c1ccc(Nc2ccc(OC[C@@H]3CCCO3)cc2)c([N+](=O)[O-])c1 40153789 DSBAFBBVSKMHIC-HNNXBMFYSA-N 407.448 2.804 5 40 HFBB COc1cccc(-c2noc(CN(C)S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)n2)c1 223772484 IUJTVLOJLIMUOW-UHFFFAOYSA-N 418.431 2.783 5 40 HFBB COC(=O)c1cc(NCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc(C(=O)OC)c1 3243833 POWIJGSQCMNICA-UHFFFAOYSA-N 401.375 2.527 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 8429755 QMEWHESWLREMHT-UHFFFAOYSA-N 405.476 2.864 5 40 HFBB CC(C)Cn1c(=O)[nH]c(=O)c2c(C(=O)Nc3cccc([N+](=O)[O-])c3)cc(C3CC3)nc21 32032486 VNKYKRCJMOUBFK-UHFFFAOYSA-N 423.429 2.779 5 40 HFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCCN(c2ccc(-n3cccn3)nn2)C1 62022767 TWEKGCJFUVBPQG-ZDUSSCGKSA-N 411.397 2.565 5 40 HFBB Cc1ccc(OCc2ccc(C(N)=O)cc2[N+](=O)[O-])c(I)n1 89626807 WPUAIDBFQOQFHA-UHFFFAOYSA-N 413.171 2.581 5 40 HFBB CC(=O)N1N=C(c2ccc(NS(C)(=O)=O)cc2)C[C@@H]1c1cccc([N+](=O)[O-])c1 4036017 SPNRAGFJKFQHMN-GOSISDBHSA-N 402.432 2.664 5 40 HFBB Cc1ccccc1N1C[C@H](C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O 7450900 WNOJQULGEZVTDE-QGZVFWFLSA-N 408.458 2.605 5 40 HFBB Cc1cccc(Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])c1C 13137164 GQXBHXHQAXPFRW-UHFFFAOYSA-N 404.492 2.891 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] 19932874 AGWQVDBXIRWMKI-UHFFFAOYSA-N 419.459 2.569 5 40 HFBB CS(=O)(=O)N(CC(=O)N[C@@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 22348272 XZJCGYIVNIPIPL-GOSISDBHSA-N 403.460 2.555 5 40 HFBB Cc1ccc(C(=O)[C@H](C)OC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C 7000089 UTPHGZAYGATNIL-ZDUSSCGKSA-N 410.382 2.622 5 40 HFBB CC1CCN(S(=O)(=O)c2ccc(-n3nnc4ccccc43)c([N+](=O)[O-])c2)CC1 8079490 LUVYTSNSRUHPML-UHFFFAOYSA-N 401.448 2.749 5 40 HFBB CCc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 224979012 XWUSHICKGAEBKO-AWEZNQCLSA-N 405.476 2.801 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 4569698 VTDGFFFDPIEHAR-SFHVURJKSA-N 417.487 2.795 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1NCC(=O)Nc1ccc(C)c(S(=O)(=O)N(C)C)c1 5657453 FGTAYHAVPKSMPI-UHFFFAOYSA-N 406.464 2.513 5 40 HFBB CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2)cc1 8562395 JQCWTZHVLYGVJF-CYBMUJFWSA-N 407.448 2.689 5 40 HFBB COc1ccc(NC(=O)CSc2nncn2-c2ccccc2OC)c([N+](=O)[O-])c1 9715220 OKKZOKCPTCPDIZ-UHFFFAOYSA-N 415.431 2.924 5 40 HFBB COc1ccc([C@@H]2[C@@H]([N+](=O)[O-])[C@@H]3CCCN3[C@@]23C(=O)Nc2ccccc23)c(OC)c1 19804910 TVNMCLBIALHYCC-ZJDLJICXSA-N 409.442 2.758 5 40 HFBB O=C(NCCN1C(=O)S/C(=C/c2cccnc2)C1=O)c1ccc([N+](=O)[O-])s1 97674649 RZNODEFPKTYGGU-XYOKQWHBSA-N 404.429 2.518 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2ON=C(c3ccccc3Cl)[C@@H]2C1=O 103540529 SZRKLXYKGLFIIP-HOCLYGCPSA-N 401.762 2.549 5 40 HFBB COC(=O)CN(c1cc(Cl)ccc1OC)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113892702 WPOVDZZQGIXKHN-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB C[C@H](C(=O)NCCCc1ccc(F)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220416336 RAGWXGWAGAOVFD-CQSZACIVSA-N 423.466 2.637 5 40 HFBB CSc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 224343336 ODWRIDYVVYZWLP-UHFFFAOYSA-N 409.489 2.884 5 40 HFBB CCOCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C[C@H]1CCCO1 2392939 BGVYWHVBZVPGPI-OAHLLOKOSA-N 407.474 2.900 5 40 HFBB Cc1ccc(C(=O)CN(C(=O)c2ccc([N+](=O)[O-])cc2)N2C(=O)CCC2=O)cc1C 7881749 NNMRFFJQFOFYJH-UHFFFAOYSA-N 409.398 2.601 5 40 HFBB Cc1ccc(CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)cc1F 12556301 DHYNSCOIUOOBRT-UHFFFAOYSA-N 409.439 2.675 5 40 HFBB Cc1ccc(C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@H]2CCCO2)cc1[N+](=O)[O-] 13986709 WNJZMJJPPFTHSQ-MRXNPFEDSA-N 422.441 2.961 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 15534160 QSQVAGLERBUCSO-UHFFFAOYSA-N 420.809 2.884 5 40 HFBB Cc1cccc(C)c1NC(=O)[C@H](c1ccc([N+](=O)[O-])cc1)N1CCN(CCO)CC1 20149787 CWAZCFZARFPIRI-NRFANRHFSA-N 412.490 2.501 5 40 HFBB CC[C@H](C(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 24771427 IFRKMFCTPUGKNU-IBGZPJMESA-N 417.487 2.622 5 40 HFBB COc1ccc(CCNC(=O)COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OC 3485288 FIWJJODNQCYJHP-UHFFFAOYSA-N 422.821 2.781 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)c1 4569674 QJVCNFGSFNTQRT-GOSISDBHSA-N 417.487 2.795 5 40 HFBB COc1ccc(C(=O)NCC(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] 12867590 CJBWVPAYFKSKMU-UHFFFAOYSA-N 414.443 2.602 5 40 HFBB COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1 95116757 BFEASCNGRQZANS-KRWDZBQOSA-N 401.375 2.672 5 40 HFBB COc1ccc(CNC(=O)[C@H](C(=O)c2cccc([N+](=O)[O-])c2)n2ccccc2=O)cc1 199423229 GEWLYCSSQATBIS-FQEVSTJZSA-N 421.409 2.506 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)CCC(=O)c1ccc(F)cc1 3242290 KUCGLCQLHBOPNL-UHFFFAOYSA-N 404.350 2.887 5 40 HFBB COc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1 6911915 DTVOIBQADBMKLL-CQSZACIVSA-N 421.475 2.797 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1cccc([N+](=O)[O-])c1 17087642 ZZORUYFIKZZGIK-OAHLLOKOSA-N 407.382 2.694 5 40 HFBB CCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1ccc(OC)cc1 39985238 PLVDVQCAWLFCLX-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB C[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 57945267 KKBUQYVVXSWZFW-HNNXBMFYSA-N 412.446 2.515 5 40 HFBB CCCn1c(=N)c(S(=O)(=O)c2ccccc2)cc2c(=O)n3cc(C)ccc3nc21 100846643 QTMWHVAQMMAXHS-UHFFFAOYSA-N 408.483 2.680 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 169687364 DXBNEPDFCBIQJD-ZQIUZPCESA-N 409.320 2.699 5 40 HFBB O=C1[C@H]2Cc3c([nH]c4ccccc34)[C@H](c3ccc([N+](=O)[O-])cc3)N2C(=O)CN1C1CC1 1896933 BVZBHTXRLVLMED-KNQAVFIVSA-N 416.437 2.923 5 40 HFBB biogenic COCCCNC(=O)c1c(N)n(-c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3nc12 3311007 UUJMVCYCUWPGRT-UHFFFAOYSA-N 420.429 2.830 5 40 HFBB COCCOC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 7552651 PXXLXTCHPNSSAC-MRXNPFEDSA-N 409.826 2.941 5 40 HFBB C[C@]1(c2ccccc2Cl)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 9662546 RXHVZTPGLFWUHB-GOSISDBHSA-N 420.784 2.793 5 40 HFBB O=C(CSc1nnc2ccc(-c3cccc([N+](=O)[O-])c3)nn12)NCc1ccco1 15391419 KHWVTCMVNMBNLJ-UHFFFAOYSA-N 410.415 2.701 5 40 HFBB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1C 22523052 HVDGUKBFAIZMEW-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 40080551 APMQBLCXLLMRAH-INIZCTEOSA-N 424.501 2.666 5 40 HFBB COc1cc(C)c([C@H](C)NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1OC 40134355 INBUKQUPMNYTDC-LBPRGKRZSA-N 422.459 2.815 5 40 HFBB NC(=O)COc1ccccc1/C=C1/SC(=O)N(Cc2ccccc2[N+](=O)[O-])C1=O 214986518 XQFLGAFWNOPPQS-CXUHLZMHSA-N 413.411 2.695 5 40 HFBB Cc1ccc(CNC(=O)[C@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 220383950 ZUKBOPGPEZWZHL-HNNXBMFYSA-N 405.476 2.683 5 40 HFBB CC1=C(C(N)=O)[C@@H](c2ccccc2[N+](=O)[O-])N2NC(c3ccccc3Cl)=NC2=N1 940683 DDYOFYWKVCEYKY-MRXNPFEDSA-N 410.821 2.685 5 40 HFBB COc1ccc(Cn2c(=O)c3cccnc3n(Cc3ccc([N+](=O)[O-])cc3)c2=O)cc1 2688126 OAZVIHSNFBQTJT-UHFFFAOYSA-N 418.409 2.572 5 40 HFBB O=C(CF)N[C@H](NC(=S)Nc1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl 4558750 CYUYZLQVFDODHO-SECBINFHSA-N 403.650 2.663 5 40 HFBB COc1cc(N2C(=O)[C@H]3ON=C(c4ccccc4Cl)[C@H]3C2=O)c(C)cc1[N+](=O)[O-] 101195541 KJLCGKAQKQPAJY-WBVHZDCISA-N 415.789 2.858 5 40 HFBB Cc1c(N(CC(=O)NCc2ccc(Cl)cc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220026202 QZFBVJJGSUFFIX-UHFFFAOYSA-N 411.867 2.639 5 40 HFBB O=C(CNC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1 408553271 PQBUPUFGMUUEBF-UHFFFAOYSA-N 411.201 2.595 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1Cc1ccccc1)[C@H]1C[C@@H]2[C@@H]2[C@@H]1N=NN2c1ccccc1[N+](=O)[O-] 4581092 IFMAYTGULJHYIV-RHOFUAETSA-N 417.425 2.970 5 40 HFBB Cc1cc(C(=O)O[C@H](C)C(=O)N2CCN(Cc3ccccc3)CC2)ccc1[N+](=O)[O-] 16221188 UWOPBPMUIBMBHM-QGZVFWFLSA-N 411.458 2.793 5 40 HFBB Cc1ccc2c(c1)nnn2C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 1380652 KDMJWGSANJZLKH-UHFFFAOYSA-N 401.448 2.674 5 40 HFBB Cc1cc(NS(=O)(=O)c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)no1 1779633 FNQOFFCCAUEXOB-UHFFFAOYSA-N 402.388 2.944 5 40 HFBB CCNc1nc(NCC)nc(SCC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])n1 8871576 YWNKUQZAVYSCJA-UHFFFAOYSA-N 421.483 2.773 5 40 HFBB CC(C)CN1C[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)CC1=O 59253236 LNOWHJJJIRVSFP-AWEZNQCLSA-N 401.385 2.990 5 40 HFBB Cc1sc(C(=O)Nc2cc(C3CC3)nn2[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-] 78870186 BARDQELHIBRYBP-LLVKDONJSA-N 410.477 2.651 5 40 HFBB COc1ccccc1NC(=O)CN1C(=O)N/C(=C/C=C/c2ccccc2[N+](=O)[O-])C1=O 409242129 MMBJUHFIXFICAE-XOBDNCQPSA-N 422.397 2.691 5 40 HFBB Cc1cc(C(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c(C)n1C[C@@H]1CCCO1 3445573 HBDLOIODVQGDTQ-INIZCTEOSA-N 410.430 2.785 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1nnc2n1CCCCC2 12522462 HHKVDAUNMLYPTA-UHFFFAOYSA-N 401.470 2.789 5 40 HFBB COc1ccc(/C=C/c2nc3s/c(=C\c4ccccc4[N+](=O)[O-])c(=O)n3n2)cc1 27022204 HOSMYJTYEOVVKA-JUBDITTISA-N 406.423 2.786 5 40 HFBB O=C(NC1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)CC1)c1ccc(F)cc1 45432495 TVXXQLFEWCDKPG-UHFFFAOYSA-N 411.393 2.645 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@H](C(=O)c1ccccc1)N1CCC[C@H]21 104117997 QWNBLHFUXGLTON-AFYVEPGGSA-N 419.437 2.738 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3cccnc3Cl)CC2)c([N+](=O)[O-])c1 408572545 JTAHFONYRCHCOM-UHFFFAOYSA-N 418.837 2.782 5 40 HFBB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)c1 408621553 LMSFEQWGKKVCQB-UHFFFAOYSA-N 421.475 2.917 5 40 HFBB O=C(C1=NO[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]12)c1ccc2ccccc2c1 3848917 RXODAPJODQJMQG-FXAWDEMLSA-N 415.361 2.875 5 40 HFBB biogenic O=C(N[C@H]1CCCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 4526162 WZNGSCLDBFLJEE-ROUUACIJSA-N 412.402 2.974 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@H](c2ccccc2F)n2nnnc2N3)c1 10296571 CDJCQUFSPMKPGJ-INIZCTEOSA-N 406.337 2.578 5 40 HFBB O=C(CF)N[C@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl 13571533 VLXRSURXOJXMSQ-SECBINFHSA-N 403.650 2.663 5 40 HFBB COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c([N+](=O)[O-])c1 17082331 LBDRYBSBAGNZSN-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB COc1ccc(C)cc1NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220406406 DXFWVHKOBDGFAN-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(Cl)c([N+](=O)[O-])c1 5656143 VJOLOAHLQIOZLD-UHFFFAOYSA-N 403.822 2.754 5 40 HFBB COc1ccc2c(=O)c3c(oc2c1)C(=O)N(CCN(C)C)[C@H]3c1ccc([N+](=O)[O-])cc1 9041752 ZNWXXNPNQIJFOQ-IBGZPJMESA-N 423.425 2.817 5 40 HFBB CC(=O)c1ccc(N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 57943078 PEXKMYUFUQYMFG-UHFFFAOYSA-N 400.410 2.697 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(O[C@H](C)C(=O)NC(C)C)cc1 408589375 HGOUUTROPRCWEX-CQSZACIVSA-N 421.475 2.996 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C 408601871 CBAJROSNCFWGBE-AWEZNQCLSA-N 421.475 2.916 5 40 HFBB CC[C@H](Sc1nncn1C)C(=O)Nc1nnc(-c2cccc([N+](=O)[O-])c2)s1 11852418 VWLSHYICMDIDFU-NSHDSACASA-N 405.465 2.751 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1ccc(C)c(C)c1)S(C)(=O)=O 106114327 KINMEZCLQDTSGP-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)Nc1cccc([N+](=O)[O-])c1C 408700705 KPJRUESRCFOADI-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCc2ccc(CN3CCOCC3)cc2)c1C 12993033 ZVAYNQMDLWETMO-UHFFFAOYSA-N 419.503 2.522 5 40 HFBB C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(n2c(=O)[nH]c3ccccc32)CC1 32806178 MVJASROCYALTKM-CQSZACIVSA-N 409.446 2.902 5 40 HFBB O=C1CCCN1C[C@@H]1CC[C@@]2(COCCN(Cc3c(Cl)cccc3[N+](=O)[O-])C2)O1 306127712 GFLHNVRLLUGWJJ-MGPUTAFESA-N 423.897 2.621 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 408594302 OJCZVUODFYMARC-ZDUSSCGKSA-N 407.448 2.607 5 40 HFBB Cc1nn(CCC(=O)N2CCC[C@H](n3nccc3C(F)(F)F)C2)c(C)c1[N+](=O)[O-] 95466137 JTWWXLYLEDZJLU-ZDUSSCGKSA-N 414.388 2.877 5 40 HFBB CCCN(CCC)C(=O)CN1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O 409214582 WFJWYBXWAKPCLM-GDNBJRDFSA-N 407.448 2.985 5 40 HFBB O=C(Nc1nnc(CS(=O)(=O)c2ccccc2)s1)c1ccc([N+](=O)[O-])cc1 9426444 NQHSRPUQBFTSNY-UHFFFAOYSA-N 404.429 2.673 5 40 HFBB Cc1cc(C(=O)N2CCC(NS(=O)(=O)c3cccs3)CC2)ccc1[N+](=O)[O-] 11450676 MCIJBMREWINZQJ-UHFFFAOYSA-N 409.489 2.548 5 40 HFBB Cc1cccc(C(=O)N2CCN(Cc3nc(-c4cccs4)no3)CC2)c1[N+](=O)[O-] 12780041 KQYBQZOEUBONSW-UHFFFAOYSA-N 413.459 2.973 5 40 HFBB O=C([C@@H]1Cc2ccccc2CN1Cn1ncc2ccc([N+](=O)[O-])cc21)N1CCCC1 12819325 KZIDBHCJCYJSOX-NRFANRHFSA-N 405.458 2.951 5 40 HFBB CCOP(=O)(OCC)c1nc(-c2ccc([N+](=O)[O-])cc2)oc1N1CCOCC1 16752131 VAARGYWBVUGYDV-UHFFFAOYSA-N 411.351 2.978 5 40 HFBB CCN(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(OC)c(C)c1 19929901 AAIQGUNIAJCWTC-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB O=[N+]([O-])c1ccc(N[C@@H]2CCc3ccccc32)c(S(=O)(=O)N2CCOCC2)c1 32853525 UJABCLCRSVIZGZ-QGZVFWFLSA-N 403.460 2.715 5 40 HFBB COCCNc1nnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)s1 9245336 JQDZABLIBCOPBT-UHFFFAOYSA-N 403.873 2.889 5 40 HFBB CC[C@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3cccc([N+](=O)[O-])c3)N2C1=O 2256770 JETDMZPPGFJUQQ-GDBMZVCRSA-N 419.459 2.823 5 40 HFBB CCn1c(=N)c(C(=O)N[C@@H](C)c2ccccc2)cc2c(=O)n3cc(C)ccc3nc21 16742600 LWBZNMGHJKYTEN-HNNXBMFYSA-N 401.470 2.948 5 40 HFBB Cc1ccc(C)c(N(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)S(=O)(=O)N(C)C)c1 20244857 MKDJAQZVPLLPBT-UHFFFAOYSA-N 420.491 2.772 5 40 HFBB CCOc1cccc(NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)c1 220033956 QFHIJMLLQSYYGD-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB O=C1[C@H]2[C@@H]3C[C@@H]([C@H]4C(c5cccc([N+](=O)[O-])c5)=NO[C@H]34)[C@H]2C(=O)N1c1ccccc1 4744608 NZMQAHHANQBGMI-NJHADGRTSA-N 403.394 2.769 5 40 HFBB O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 13151972 PAAJRBBRLLARCY-UHFFFAOYSA-N 417.399 2.730 5 40 HFBB O=C(COc1cccc(-c2noc(-c3ccc([N+](=O)[O-])cc3)n2)c1)N1CCOCC1 33327495 ONCKPKLZQTVOLO-UHFFFAOYSA-N 410.386 2.549 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OC[C@@H]2CCCO2)[C@@H]1c1cccc([N+](=O)[O-])c1 629100 FVDUPZNDOAARRO-QFBILLFUSA-N 416.430 2.725 5 40 HFBB CCn1ncc(CNC(=O)c2ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)cc2)c1C 2809285 BCWJMESWGSIIMX-UHFFFAOYSA-N 402.842 2.948 5 40 HFBB Cc1ccc(N2C[C@H](NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1 4272594 OSSZYIIOUDINAJ-QGZVFWFLSA-N 423.473 2.540 5 40 HFBB CCOc1ccc(C(=O)NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4562014 HUIWSVDFDQGTJH-UHFFFAOYSA-N 414.487 2.830 5 40 HFBB CCn1/c(=N\C(=O)c2ccccc2S(C)(=O)=O)sc2cc([N+](=O)[O-])ccc21 13286776 NUZCWKCVYOKHLH-ISLYRVAYSA-N 405.457 2.776 5 40 HFBB Cc1cc(C)c2nc3s/c(=C\c4cc([N+](=O)[O-])cc([N+](=O)[O-])c4O)c(=O)n3c2c1 33713778 SEPZUPJULUHRTR-NSIKDUERSA-N 412.383 2.596 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2ccccc2N2CCN(C)CC2)cc1[N+](=O)[O-] 33779673 KRLRRBAHKXSZPI-UHFFFAOYSA-N 413.503 2.782 5 40 HFBB CCOCCCN(CC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC 40123000 VQJKDWRCFVRRAW-UHFFFAOYSA-N 400.375 2.583 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C(=O)c3ccccc3)N3CCC[C@@H]3[C@@H]2C1=O 199036181 QWNBLHFUXGLTON-GTAWCEEGSA-N 419.437 2.738 5 40 HFBB O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)NCCSc1ccc(Cl)cc1 9462395 FNOBLVJTIDMYQO-UHFFFAOYSA-N 418.862 2.867 5 40 HFBB CC(=O)Nc1nnc(SCC(=O)Nc2nc3ccc([N+](=O)[O-])cc3s2)s1 13945454 UTLHGIDMFUJTJR-UHFFFAOYSA-N 410.462 2.745 5 40 HFBB COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC)c(OC)c2)cc1OC 22021338 GLHFSWRKOFNUSC-UHFFFAOYSA-N 406.391 2.898 5 40 HFBB CCOC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224750343 XYSJZVZIHKUWBY-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB CC(C)[C@H](NC(=O)c1ccco1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 2664693 CKOOASHVBQTSNS-INIZCTEOSA-N 404.375 2.552 5 40 HFBB O=C1N[C@H](c2ccccc2[N+](=O)[O-])[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9090197 XHWWAARUXDSGHW-ZOWXZIJZSA-N 415.349 2.760 5 40 HFBB C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ccc([N+](=O)[O-])c4cccnc34)CC2)C1 12735512 LETWNCVSPADLLO-CALCHBBNSA-N 411.506 2.770 5 40 HFBB Cc1cc(N2CCN(CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)nc(C(C)C)n1 12745823 XRMMLZKRXGINMI-UHFFFAOYSA-N 412.494 2.602 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1 28207739 WRBWCMSMHMCHEU-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)c(C)c1 408622249 MZVKATABQJSCNO-UHFFFAOYSA-N 421.475 2.917 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1F)C1CCN(S(=O)(=O)c2cccs2)CC1 3358797 PMEJDGIFDGWVHY-UHFFFAOYSA-N 413.452 2.835 5 40 HFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)C1=NN(c2ccccc2)C(=O)CC1 5788344 XQMITURWAMUHIO-UHFFFAOYSA-N 411.370 2.688 5 40 HFBB COc1ccc(C)cc1S(=O)(=O)N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 6844660 SHMHYUCYSOFNKY-CYBMUJFWSA-N 407.448 2.526 5 40 HFBB O=C(COc1ccc([N+](=O)[O-])cc1)NC(=S)Nc1ccc(Cl)c(C(=O)O)c1 6883523 GEWMJTPLMFMMPV-UHFFFAOYSA-N 409.807 2.838 5 40 HFBB CN1C(=O)C2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@H]2c2ccccc2)C(=O)N(C)C1=S 8997522 RDIJGBGJCJDHKZ-KRWDZBQOSA-N 424.482 2.530 5 40 HFBB COc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 9963357 GPRPRLWENHXDDP-LLVKDONJSA-N 400.420 2.698 5 40 HFBB O=C(NC(=S)Nc1cccnc1Cl)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 21595898 YOKLMCWBBOKSGH-UHFFFAOYSA-N 421.866 2.607 5 40 HFBB COC(=O)Cn1/c(=N/C(=O)c2ccc(OC)cc2)sc2cc([N+](=O)[O-])ccc21 100876519 FVHGFZGYTSNMMO-HNENSFHCSA-N 401.400 2.534 5 40 HFBB COc1ccc(OCCn2c(=O)c(N3CCCC3)nc3ccc([N+](=O)[O-])cc32)cc1 12922461 QJROSJUHERDZRW-UHFFFAOYSA-N 410.430 2.993 5 40 HFBB CCCCOc1ccc(C(=O)NCC(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 5246171 VDXVWBPDFWEFEW-UHFFFAOYSA-N 414.414 2.930 5 40 HFBB COc1ccc(CC(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cc1OC 6424240 CLXGJRLIBZOMPH-UHFFFAOYSA-N 408.794 2.990 5 40 HFBB O=C(COC(=O)Cc1cn2ccsc2n1)Nc1nc2ccc([N+](=O)[O-])cc2s1 9540052 DHWUIYNOWUESPG-UHFFFAOYSA-N 417.428 2.638 5 40 HFBB O=C(O)c1ccc(-c2c([N+](=O)[O-])cc3c4c(cccc24)C(=O)N(CCO)C3=O)cc1 408994811 JLXDBCKEJITAKL-UHFFFAOYSA-N 406.350 2.702 5 40 HFBB C[C@H](NC(=O)c1ccccc1)C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 5231760 IOFOHUJCUMJSNC-NSHDSACASA-N 405.794 2.548 5 40 HFBB C[C@@H](CC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 6787902 YODCZGJRYRMRJT-INIZCTEOSA-N 417.487 2.622 5 40 HFBB C[C@@H](C(=O)NCc1ccccc1Cl)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220410996 XDMQTDLQYZNVRE-LBPRGKRZSA-N 411.867 2.719 5 40 HFBB C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCCO)C(=O)Nc1ccc(Cl)cc1 6465382 AYFGJZLUIYJORQ-LLVKDONJSA-N 407.810 2.836 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3C)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N12 9271778 DXVZRCABYVDXEY-XRXFAXGQSA-N 417.421 2.882 5 40 HFBB CS(=O)(=O)c1ccc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])sc2c1 12042372 RMXTWVMWJUQQDT-UHFFFAOYSA-N 422.400 2.769 5 40 HFBB COC(=O)c1cc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc([N+](=O)[O-])c1 8349370 YQIDTEWUUMDGOQ-CYBMUJFWSA-N 409.402 2.795 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@H](c2ccc(F)cc2)n2nnnc2N3)c1 10296554 MKZWBFQNAFXHFY-INIZCTEOSA-N 406.337 2.578 5 40 HFBB CC1CCN(c2ccc(C(=O)OCC(=O)N3C[C@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])CC1 18085615 YVYRCUMFOXIISJ-IYBDPMFKSA-N 419.478 2.624 5 40 HFBB CCc1ccccc1N1C[C@H](C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)CC1=O 59057115 PPOYASDTDXRCNP-GOSISDBHSA-N 422.485 2.859 5 40 HFBB COc1ccc(-c2noc(CNC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)n2)c(OC)c1 217897273 WGTDESOYQBRGES-BJMVGYQFSA-N 410.386 2.992 5 40 HFBB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl 408555956 YCSSYVSBNWVSPT-SNVBAGLBSA-N 413.839 2.562 5 40 HFBB Nn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccc(Cl)c1 6053032 WFZCYGIQCNXYTJ-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB Cc1nn(CC(=O)NCCNc2ncc(C(F)(F)F)cc2Cl)c(C)c1[N+](=O)[O-] 18215734 IGVHUEHQFQDAJK-UHFFFAOYSA-N 420.779 2.704 5 40 HFBB CCOc1ccccc1NC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 220024049 HNWVCNIQTFHAON-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB Cc1c(NC(=O)[C@@H](C)Oc2ccc(N(C)S(C)(=O)=O)cc2)cccc1[N+](=O)[O-] 223950756 BFICSJBTOMHGEJ-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB CC[N+]1(C[C@@H](O)COc2ccc(Br)cc2Br)CCOCC1 3180172 PUORYIGDPXUYRY-CYBMUJFWSA-N 424.153 2.818 5 40 HFBB CCCCN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 9089982 XDJZZRVSSBETBS-DYESRHJHSA-N 414.462 2.765 5 40 HFBB CC1CCN(S(=O)(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 36392352 JIHYWLPQNOLMGQ-UHFFFAOYSA-N 410.418 2.592 5 40 HFBB O=C([C@H]1C[C@H]1[N+](=O)[O-])N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 40115909 CMFDXNXNBXMTCT-RBUKOAKNSA-N 401.413 2.864 5 40 HFBB COC(=O)C[C@@H](C(=O)OC)[C@H](C[N+](=O)[O-])c1ccc(OC)c(OC2CCCC2)c1 65336762 ANIDZYMNYALTTQ-HZPDHXFCSA-N 409.435 2.729 5 40 HFBB CCCCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccco2)c1=N 101116368 RZMLBUWINONVQH-UHFFFAOYSA-N 405.458 2.608 5 40 HFBB O=C(Nc1ccc(Br)cn1)c1ccc(Cn2cnc([N+](=O)[O-])n2)cc1 2781905 AXIRWXYZXDBPSS-UHFFFAOYSA-N 403.196 2.644 5 40 HFBB O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])Nc1ccc(N2CCOCC2)cc1 3246277 JGBOHIOOEPPJFF-UHFFFAOYSA-N 419.821 2.880 5 40 HFBB CCOC(=O)CN(c1ccc(OCC)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113885789 OLWYYXVXQSUYIA-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB O=C(c1ccc2n[nH]cc2c1)N1CCC[C@H](C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 1116156290 QKZAFHLRULDCEA-INIZCTEOSA-N 419.441 2.866 5 40 HFBB O=C(Cn1cc([N+](=O)[O-])cn1)Nc1sc2c(c1C(=O)N1CCCCC1)CCCC2 2754845 JCMFFOWMAOLWNP-UHFFFAOYSA-N 417.491 2.996 5 40 HFBB CS(=O)(=O)c1ccc(N2CCC(C(=O)Nc3ccccc3)CC2)c([N+](=O)[O-])c1 7366779 NTVRAMLGBBHUQR-UHFFFAOYSA-N 403.460 2.853 5 40 HFBB O=C1N[C@@H](c2cccc([N+](=O)[O-])c2)[C@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9030190 NQSQSODDYSCIEY-XUJVJEKNSA-N 415.349 2.760 5 40 HFBB CC(C)[C@H](NC(=O)c1ccco1)C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 9539438 UXPZGKDWJYEZAZ-INIZCTEOSA-N 423.809 2.778 5 40 HFBB C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 40080425 ZUXDIDREFIMEAG-NSHDSACASA-N 402.432 2.708 5 40 HFBB C[C@@H]1[C@@H](NC(=O)COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)CCC[C@H]1C 107550948 ZNRYCUZZDXKGGX-VYDXJSESSA-N 419.478 2.529 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2cccnc2)n1C 9506846 GHKGYCDPFCOOTM-UHFFFAOYSA-N 400.420 2.525 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(Cn3nnn(Cc4ccccc4)c3=S)CC2)cc1 12538272 CSYSXSSFWUAAQY-UHFFFAOYSA-N 411.491 2.545 5 40 HFBB CN1CCN(C(=O)c2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)CC1 40111497 LKAVLRHBOJZNBW-UHFFFAOYSA-N 416.865 2.566 5 40 HFBB CC[C@H](C(=O)NCc1cccc(C)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222527822 DTOQFQZCMFSJMC-GOSISDBHSA-N 405.476 2.764 5 40 HFBB Cc1c(NS(=O)(=O)c2nnc(NC(=O)c3ccccc3)s2)cccc1[N+](=O)[O-] 225856700 OIIWIWMRSHSHRP-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB O=C(CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)OCc1ccc(Cl)c(Cl)c1 1031597 KLZIYBKLFZOOBB-UHFFFAOYSA-N 419.242 2.923 5 40 HFBB O=C1NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCC[C@@H]32)C(=O)N1C1CCCCC1 8974776 AFNXLSQGTMEUTP-UTKZUKDTSA-N 412.446 2.517 5 40 HFBB COc1ccc(-n2cc3c(c2-c2cccc([N+](=O)[O-])c2)c(=O)n(C)c(=O)n3C)cc1 20443157 PERBTLGZXMTHQW-UHFFFAOYSA-N 406.398 2.612 5 40 HFBB COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCCN(C)CC1 33014514 ZRWFQALMRAKJEK-UHFFFAOYSA-N 420.491 2.546 5 40 HFBB CN1CCN(CCc2nc3cc(NC(=O)c4ccc([N+](=O)[O-])cc4)ccc3n2C)CC1 2232495 PIWVOWCIJVGSDU-UHFFFAOYSA-N 422.489 2.524 5 40 HFBB CC(=O)c1ccc(NC(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8416456 CYBMPVSDPRMKMN-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(OC)c(C(=O)NC(C)C)c1 10009019 XPSMJNHNDHGDSG-UHFFFAOYSA-N 423.447 2.551 5 40 HFBB Cc1ccc(-c2nc3n(n2)[C@H](C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC(=O)N3)cc1 10153416 GHJMAVAQDORWJV-INIZCTEOSA-N 406.402 2.992 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1cccc(F)c1)N(C)C 12565377 XSCYYVIUJGVHBL-LJQANCHMSA-N 404.442 2.825 5 40 HFBB NC(=O)c1ccc(N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)c([N+](=O)[O-])c1 15117211 CTZPKKAWCKWFBB-UHFFFAOYSA-N 409.368 2.824 5 40 HFBB Cc1cc(C(=O)N2CCN(Cc3nc(-c4ccsc4)no3)CC2)ccc1[N+](=O)[O-] 32908592 TZCPMMVYCBLXJS-UHFFFAOYSA-N 413.459 2.973 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225793596 JBJMBMJQVPNHPS-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(O[C@@H](C)C(=O)NC(C)C)cc1 408589371 HGOUUTROPRCWEX-AWEZNQCLSA-N 421.475 2.996 5 40 HFBB COc1ccc2c(c1)c(C(=O)N1C[C@@H]3C[C@H](C1)c1ccc([N+](=O)[O-])c(=O)n1C3)cn2C 524729740 HSKOVTAXVJSGAJ-UONOGXRCSA-N 422.441 2.516 5 40 HFBB biogenic Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4ccc(C)c([N+](=O)[O-])c4)cnc32)cc1C 10252070 GMJUHRDXTWHRHB-UHFFFAOYSA-N 418.413 2.800 5 40 HFBB COc1cc(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc(Cl)c1OCC(N)=O 12777093 GYQUQLNKPUBLEE-LLVKDONJSA-N 421.837 2.954 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)Nc1ccc(Cl)cc1 15278012 USUIBUSVNIIEQC-UHFFFAOYSA-N 419.821 2.880 5 40 HFBB O=C(NN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O)c1ccccc1[N+](=O)[O-] 3015087 JURWDZPRCDPMAO-UHFFFAOYSA-N 406.310 2.597 5 40 HFBB COc1ccc(NC(=O)[C@@H](C)N(C)CC(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])c1 8472371 RKUPFGSZTLNDMG-CQSZACIVSA-N 400.435 2.809 5 40 HFBB CC(=O)c1sc(C2CCN(C(=O)CCCn3cc([N+](=O)[O-])cn3)CC2)nc1C 12186177 YSUIHUZZRCYAEL-UHFFFAOYSA-N 405.480 2.945 5 40 HFBB CCOC(=O)c1ccc(N2CCN(CC)CC2)c(NC(=O)c2ccc([N+](=O)[O-])o2)c1 17090558 DZPZJMUWYHRANL-UHFFFAOYSA-N 416.434 2.759 5 40 HFBB CC(C)OC(=O)CN1C(=O)S/C(=C/c2cc(Cl)cc([N+](=O)[O-])c2O)C1=O 409104471 ZWZRFPHHEDFSDK-NYYWCZLTSA-N 400.796 2.942 5 40 HFBB O=C(c1ccc2n[nH]cc2c1)N1CCC[C@@H](C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 1116156291 QKZAFHLRULDCEA-MRXNPFEDSA-N 419.441 2.866 5 40 HFBB COc1cc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c([N+](=O)[O-])cc1OC 1056051 OMALSVHVGTXRMK-UHFFFAOYSA-N 412.402 2.662 5 40 HFBB COc1cc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])ccc1OCc1ccc(F)cc1 6441298 YZFRJDHZYAYIGC-XBXARRHUSA-N 413.361 2.869 5 40 HFBB CCn1nnc2cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3OC)ccc21 8943720 QNJXPEKPWZQMML-LLVKDONJSA-N 413.390 2.552 5 40 HFBB Cc1ccc(C(=O)NC(=S)Nc2ccc(CN3CCOCC3)cc2)cc1[N+](=O)[O-] 22438205 RKZVUESWEBECKU-UHFFFAOYSA-N 414.487 2.862 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2ON=C(c3ccc(Cl)cc3)[C@H]2C1=O 101314626 GNNCAMFHTUDLJS-ZBFHGGJFSA-N 401.762 2.549 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])OCc1cc(=O)n2c(n1)sc1ccccc12 24757244 NIYHWVVUDQATGY-UHFFFAOYSA-N 411.395 2.940 5 40 HFBB O=C(NCc1ccccc1)C1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 29500441 QCDJUSHHFHRWJA-UHFFFAOYSA-N 420.473 2.839 5 40 HFBB Cc1cc(C)c(NC(=O)CN(C)S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)c(C)c1 45797492 ONOCPWVUNDDAEG-UHFFFAOYSA-N 405.476 2.920 5 40 HFBB CCN(c1ccccc1)S(=O)(=O)c1ccc(NCCc2nc[nH]n2)c([N+](=O)[O-])c1 84779650 MTIGASREYOCALO-UHFFFAOYSA-N 416.463 2.583 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)cc([N+](=O)[O-])c1 6642099 JXMNEBWNEWMBLJ-HPTBWKMGSA-N 406.435 2.868 5 40 HFBB O=C(COC(=O)[C@@H]1CCCN1C(=O)c1cccs1)Nc1ccc(F)cc1[N+](=O)[O-] 12539762 FREIVJPTWBTSMS-ZDUSSCGKSA-N 421.406 2.582 5 40 HFBB C[C@@H](C(=O)N[C@@H]1CCCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220420084 WKNVPKVTVXLQFL-IFXJQAMLSA-N 417.487 2.943 5 40 HFBB CN1C(=O)[C@@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2cc(Br)ccc21 4555006 WWMLKTNABMYNIP-QGZVFWFLSA-N 405.204 2.794 5 40 HFBB CCN1CCN(c2ccc(NC(=S)NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 17089589 RQVYZPHQMAHCIS-UHFFFAOYSA-N 413.503 2.864 5 40 HFBB CCOC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225088720 AXODPOCVPXCQJG-UHFFFAOYSA-N 414.386 2.940 5 40 HFBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc21 408528708 ICDQJYHBYRVWKE-UHFFFAOYSA-N 405.754 2.599 5 40 HFBB O=c1c2cc3c(=O)n(C4CCCCC4)ccc3nc2ccn1CCN1CCOCC1 38829244 ILJQGTZUYNKHID-UHFFFAOYSA-N 408.502 2.549 5 40 HFBB O=C1CCc2cc([N+](=O)[O-])c(N3CCC(NC(=O)Cc4ccccc4)CC3)cc2N1 48300482 BZKAOWJCHGQGPZ-UHFFFAOYSA-N 408.458 2.807 5 40 HFBB CCc1ccc([C@H](C)NC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 58166157 NIQNISOPEHYAKJ-AWEZNQCLSA-N 405.476 2.703 5 40 HFBB Cc1ccccc1CNC(=O)[C@H](C)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 220383774 OPRKKAHEQSGZMJ-HNNXBMFYSA-N 405.476 2.683 5 40 HFBB CC[C@@H](C(=O)Nc1ccc(OC)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222514963 VFLLOTYYJVFQNF-KRWDZBQOSA-N 407.448 2.787 5 40 HFBB COc1ccc(-c2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3C)n2N)cc1 3405942 QEEYDZNLPJHRDB-UHFFFAOYSA-N 414.447 2.615 5 40 HFBB CCN(CCNC(=O)c1cc(N2CCOCC2)ccc1[N+](=O)[O-])c1cccc(C)c1 12596893 CYSUENDTZREKIF-UHFFFAOYSA-N 412.490 2.996 5 40 HFBB C[C@@H](OC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)C(=O)c1ccc(Cl)cc1 21987330 BZYPSYNHJFJBIW-SNVBAGLBSA-N 416.773 2.659 5 40 HFBB Cn1ccnc1C(=O)c1ccc(NCC2(N3CCOCC3)CCCC2)c([N+](=O)[O-])c1 95418157 WHNJIOPRPLDJPA-UHFFFAOYSA-N 413.478 2.616 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)cc1 11001311 VNCNFMKWVLIMMU-UHFFFAOYSA-N 417.487 2.748 5 40 HFBB O=C(NC(=S)Nc1ccc(F)cc1F)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17092956 UKSDOAZUIMOQKD-UHFFFAOYSA-N 422.413 2.836 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(N(CCCO)CC(C)(C)C)c([N+](=O)[O-])c1 84773624 FIAAJSDMMXIOIR-UHFFFAOYSA-N 401.529 2.860 5 40 HFBB NC(=O)COc1ccc(/C=C2\SC(=O)N(Cc3ccccc3[N+](=O)[O-])C2=O)cc1 106727639 NAFVMUMEGRZYCL-SXGWCWSVSA-N 413.411 2.695 5 40 HFBB CC(=O)[C@@H](C(=O)OC(C)C)[C@H](c1cccc([N+](=O)[O-])c1)[C@H](C(C)=O)C(=O)OC(C)C 248265613 DPHUMJWVOASNEI-BWTSREIZSA-N 421.446 2.992 5 40 HFBB COC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(Cc2cc(OC)ccc2OC)CC1 12537913 YRFNXZLOXBENFX-UHFFFAOYSA-N 415.446 2.721 5 40 HFBB C[C@H]1CCc2c(sc3ncn(C[C@@H](O)COc4cccc([N+](=O)[O-])c4)c(=O)c23)C1 24834123 QBMNIJQMUARYLB-GXTWGEPZSA-N 415.471 2.931 5 40 HFBB COC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(SC)cc1 224989989 JYDHKSQZDXMGHA-UHFFFAOYSA-N 410.473 2.993 5 40 HFBB Cc1c(NC(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C 3234730 NNBAALUKDRACBW-AWEZNQCLSA-N 424.413 2.577 5 40 HFBB CCn1/c(=N\C(=O)CS(=O)(=O)c2ccccc2)sc2cc([N+](=O)[O-])ccc21 12237971 HVISBRHBTVQJQQ-ISLYRVAYSA-N 405.457 2.532 5 40 HFBB CCOC(=O)c1c(NC(=O)CCCn2cc([N+](=O)[O-])cn2)sc(C(C)=O)c1C 12413648 JZUGJAODCFFTGC-UHFFFAOYSA-N 408.436 2.959 5 40 HFBB O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)c1ccc([N+](=O)[O-])cc1 12770660 PLYMJANEUWRBDK-UHFFFAOYSA-N 403.460 2.699 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 97111801 KVUJUTLOSRBHAX-PKOBYXMFSA-N 415.421 2.890 5 40 HFBB COc1cc(CCNC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)c([N+](=O)[O-])cc1OC 101112308 QAPSJOGCBHFXCZ-RKOMNEFPSA-N 404.463 2.602 5 40 HFBB COc1ccc2[nH]c(C(=O)O)c(CCN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)c2c1 1514285 RAZWGNXXWOZOQS-UHFFFAOYSA-N 409.354 2.622 5 40 HFBB CCC(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1 6417478 OLZIWDOXNIOZNK-UHFFFAOYSA-N 405.524 2.518 5 40 HFBB CN1CCN(C(=O)CN2c3ccc([N+](=O)[O-])cc3Oc3nc4ccccc4nc32)CC1 8716996 WYMGUEPJCDOCFC-UHFFFAOYSA-N 420.429 2.556 5 40 HFBB CCc1ccc(CN(C)c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)cc1 12554332 HGKKZBDRRRKOCS-UHFFFAOYSA-N 419.503 2.815 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1nc2n(n1)[C@@H](c1ccccc1)CC(=O)N2 17029313 FXRPIVYFTQTTRJ-ZNFPLGDCSA-N 404.386 2.770 5 40 HFBB COc1ccc(C)cc1NC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(C)(=O)=O 220027113 ZDYQVEGGOFLZPK-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB CC[C@@H](C(=O)NCc1ccc(F)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222528617 YBKBTQCVDPXHNG-KRWDZBQOSA-N 409.439 2.595 5 40 HFBB C[C@@H](OC(=O)C[C@H]1Sc2ccccc2NC1=O)C(=O)Nc1cccc([N+](=O)[O-])c1 3504548 XGUVKDOYLCKIAK-BDJLRTHQSA-N 415.427 2.968 5 40 HFBB COc1cc(C(=O)OCC(=O)c2ccc3c(c2)OCCCO3)c([N+](=O)[O-])cc1OC 7732326 ZDOAMCNHYQKHIS-UHFFFAOYSA-N 417.370 2.813 5 40 HFBB Cc1csc2nc(COC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc(=O)n12 24755259 LHKAGKXRGUMKBN-UHFFFAOYSA-N 414.443 2.930 5 40 HFBB NC(=O)c1ccc(SCC(=O)OCC(=O)NC2CCCCCCC2)c([N+](=O)[O-])c1 28830584 GYEONSXFXSJYNR-UHFFFAOYSA-N 423.491 2.558 5 40 HFBB CC[C@@H](C(=O)Nc1cccc(OC)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222514836 ZXXBLLYWWVHSOX-KRWDZBQOSA-N 407.448 2.787 5 40 HFBB CC1=C(C(N)=O)[C@@H](c2ccccc2[N+](=O)[O-])N2NC(c3cccc(Cl)c3)=NC2=N1 4279812 LHOAVKQVKSPCSL-MRXNPFEDSA-N 410.821 2.685 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)O[C@@H](C)C(=O)c2ccccc2)CC1=O 7881649 BBSJUWBSYZBNQA-ZFWWWQNUSA-N 412.398 2.771 5 40 HFBB CCCN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@@H]2c2ccccc2)C1=O 9429711 JPDBFJJDYVWNIZ-XMSQKQJNSA-N 422.441 2.803 5 40 HFBB C[C@H](Nc1ccc(N2CCCS2(=O)=O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 40050826 PINWCGIRQDDPEG-ZDUSSCGKSA-N 404.448 2.574 5 40 HFBB CO[C@@H]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1 97082003 NLIMULGZCVRILZ-HZPDHXFCSA-N 409.483 2.978 5 40 HFBB COCCOc1ccc(NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCOCC2)cn1 225872491 ULNREIWRNMKQJA-UHFFFAOYSA-N 401.419 2.702 5 40 HFBB CC[C@@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3cccc([N+](=O)[O-])c3)N2C1=O 2256769 JETDMZPPGFJUQQ-GOEBONIOSA-N 419.459 2.823 5 40 HFBB CC(=O)Nc1ccc(NC(=O)CNCCNc2ccc([N+](=O)[O-])cc2Cl)cc1 5631923 IBPYOEDGUFJLGR-UHFFFAOYSA-N 405.842 2.847 5 40 HFBB COC(=O)c1c(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)sc2c1CCCCC2 6119882 YWTTXNZLTRZCRU-UHFFFAOYSA-N 405.432 2.512 5 40 HFBB COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCOc3ccccc32)cc1OC 32854570 SXMLZYBJSVSXLM-OAHLLOKOSA-N 402.403 2.882 5 40 HFBB O=[N+]([O-])c1cccc(OCCSc2ccc(S(=O)(=O)N3CCCC3)cn2)c1 40127719 IURBEGBIUXILQH-UHFFFAOYSA-N 409.489 2.945 5 40 HFBB O=[N+]([O-])c1ccccc1CS(=O)(=O)Nc1ccccc1OCCn1ccnc1 95466401 LHTXSQQSLUWYSN-UHFFFAOYSA-N 402.432 2.812 5 40 HFBB CCS(=O)(=O)[C@@](Cl)(I)C(=O)c1ccc([N+](=O)[O-])cc1 96518269 LBANISGBDKDKSI-JTQLQIEISA-N 417.608 2.540 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3cccs3)CC2)c2ccncc12 8419623 QXEKNMRUFPSQSQ-UHFFFAOYSA-N 404.473 2.715 5 40 HFBB COC(=O)CN(c1ccc(OC)c(Cl)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 8729489 BFVCKITZWICHIL-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB O=C(C1CC1)N1CCC(C(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 18042557 SZRXYNJGVOBHRY-UHFFFAOYSA-N 420.897 2.545 5 40 HFBB CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 2247223 QSIBLJMLRZVHSC-UHFFFAOYSA-N 417.472 2.555 5 40 HFBB Cc1ccc([C@H]2c3c(-c4ccc([N+](=O)[O-])cc4)nnc(O)c3Nc3nnnn32)cc1 10296116 BQHNHKDERADGBY-KRWDZBQOSA-N 402.374 2.747 5 40 HFBB O=C(Nc1cccc([N+](=O)[O-])c1)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 19867563 SRHWMZZKFSQOEW-UHFFFAOYSA-N 403.460 2.775 5 40 HFBB CCOC(=O)c1sc(NC[C@@H]2CCCO2)nc1Cn1nc(C)c([N+](=O)[O-])c1C 36613069 YSJVEGUBNBXJAK-LBPRGKRZSA-N 409.468 2.681 5 40 HFBB O=C(c1ccccc1)N1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 36623941 MBHAQJDYEJEHTB-UHFFFAOYSA-N 408.458 2.793 5 40 HFBB Cc1n[nH]c(-n2ccc3nc4ccn(-c5ccccc5Cl)c(=O)c4cc3c2=O)n1 40398588 LVGIDMMHZQINPA-UHFFFAOYSA-N 404.817 2.770 5 40 HFBB CC(C)NS(=O)(=O)c1ccc(NCc2nc(-c3ccccc3)n[nH]2)c([N+](=O)[O-])c1 65587946 HDXLCSGDDUXUJF-UHFFFAOYSA-N 416.463 2.679 5 40 HFBB O=C1[C@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccc([N+](=O)[O-])cc3)N2C(=O)CN1C1CC1 1896931 BVZBHTXRLVLMED-DENIHFKCSA-N 416.437 2.923 5 40 HFBB biogenic O=C(COC(=O)COc1ccccc1[N+](=O)[O-])Nc1cccc(Br)c1 3318959 DDEATMGLBPBDDQ-UHFFFAOYSA-N 409.192 2.918 5 40 HFBB O=C(CCCn1c(=O)oc2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 48305675 UVLJSTAUOMOOGW-UHFFFAOYSA-N 410.430 2.632 5 40 HFBB Cc1nn(C)c(C)c1CNC(=O)c1cnn2c(-c3cccc([N+](=O)[O-])c3)ccnc12 2798150 KUCGSOIEQOMJAI-UHFFFAOYSA-N 405.418 2.585 5 40 HFBB COc1c(I)cc([N+](=O)[O-])cc1I 4529683 LHCXPILOHPAXIN-UHFFFAOYSA-N 404.929 2.813 5 40 HFBB O=C(O)C[C@@H](NS(=O)(=O)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Cl 4690127 CJUGGWRFGKWHLJ-CQSZACIVSA-N 402.787 2.882 5 40 HFBB Cc1cc(C)cc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1 8433884 FIDWZCNLUUJZJZ-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COc1ccc(NC(=O)Cn2c(=O)c3ccccc3n3nc(C)cc23)c([N+](=O)[O-])c1 32909151 CSALMOMUDNAJPI-UHFFFAOYSA-N 407.386 2.513 5 40 HFBB COC(=O)CN(c1ccc(F)c(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225031982 YZGVFWKHAJTJPN-UHFFFAOYSA-N 402.787 2.756 5 40 HFBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC(=O)c3cccc(Br)c3)cc21 408536956 YLLLCVQDILDXQF-UHFFFAOYSA-N 405.208 2.800 5 40 HFBB Cn1c(SCC(=O)Nc2ccc(C(=O)O)cc2)nnc1-c1cccc([N+](=O)[O-])c1 409130168 KODDYUQANNMGMD-UHFFFAOYSA-N 413.415 2.819 5 40 HFBB Nc1nc(N2CCN(Cc3ccccc3)CC2)nc(N2CCCCCC2)c1[N+](=O)[O-] 20357663 HGUCEZYESSCDDH-UHFFFAOYSA-N 411.510 2.670 5 40 HFBB CCCN(CC(=O)Nc1ccccc1C)C(=O)COC(=O)c1ccccc1[N+](=O)[O-] 22139295 XGNHQOFILIHWST-UHFFFAOYSA-N 413.430 2.937 5 40 HFBB Cc1cc(I)cnc1NC(=O)COc1ccccc1[N+](=O)[O-] 32125069 SWQUEZBOMGGXJL-UHFFFAOYSA-N 413.171 2.920 5 40 HFBB O=C1[C@H]2C(c3cccc([N+](=O)[O-])c3)=NO[C@H]2C(=O)N1c1ccc(Br)cc1 101075882 DWXNCTJRXPRHGS-DZGCQCFKSA-N 416.187 2.650 5 40 HFBB CCCCOC(=O)CN1C(=O)S/C(=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)C1=O 409216979 MUNMHMUILMGBGD-MDWZMJQESA-N 410.404 2.689 5 40 HFBB Cc1cc(C(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c(C)n1C[C@H]1CCCO1 3445568 HBDLOIODVQGDTQ-MRXNPFEDSA-N 410.430 2.785 5 40 HFBB O=[N+]([O-])c1cc2c(cc1S(=O)(=O)N1CCC[C@@H](C(F)(F)F)C1)OCCCO2 32895535 OAFGCDABVWTVGD-SNVBAGLBSA-N 410.370 2.719 5 40 HFBB O=C(c1cccc(Cl)c1)N1CCN(c2ccc(-n3cnnc3)cc2[N+](=O)[O-])CC1 70461896 HGCHPIUAJQCKMQ-UHFFFAOYSA-N 412.837 2.791 5 40 HFBB CS(=O)(=O)N(CCCC(=O)NCCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 224819728 UPQFXGPDHFKXML-UHFFFAOYSA-N 423.466 2.639 5 40 HFBB COCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@H]2CCCN2C[C@H]1C 1519068416 VETNXFHDSYWEPO-CRAIPNDOSA-N 400.483 2.563 5 40 HFBB Cc1cccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 8433898 QTMKRARXJDDXNK-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB O=[N+]([O-])c1ccc2c(c1)OCCOCCOc1cc([N+](=O)[O-])ccc1OCCO2 9031740 SJHOCMWBHQCJSX-UHFFFAOYSA-N 406.347 2.749 5 40 HFBB O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)Nc1cccc([N+](=O)[O-])c1 9599827 PQQRXRQKMLUBSN-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB Cc1nc2c(=O)n(CC(=O)Nc3cccc([N+](=O)[O-])c3)nc(-c3ccco3)c2s1 13010508 UVQLNLKBQIEMPC-UHFFFAOYSA-N 411.399 2.968 5 40 HFBB C[C@H](NC(=O)[C@@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(F)cc1 220421021 CPXMHIXHFPNSEM-QWHCGFSZSA-N 409.439 2.766 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OC[C@H]2CCCO2)[C@H]1c1cccc([N+](=O)[O-])c1 629095 FVDUPZNDOAARRO-APWZRJJASA-N 416.430 2.725 5 40 HFBB CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)Oc2cccc([N+](=O)[O-])c2)cc1 6061417 AFWCGFJGHXIECS-CYBMUJFWSA-N 407.448 2.688 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1 8246068 ULOQKVAEWGDGLR-CQSZACIVSA-N 401.394 2.772 5 40 HFBB COc1ccc2c(=O)c3c(oc2c1)C(=O)N(CCN(C)C)[C@@H]3c1cccc([N+](=O)[O-])c1 8772027 RJIJWOYXODVFAL-LJQANCHMSA-N 423.425 2.817 5 40 HFBB COc1cc(OCC(=O)N(C)Cc2nc(-c3cccs3)no2)ccc1[N+](=O)[O-] 219830054 KIXVVKZPDSLRFZ-UHFFFAOYSA-N 404.404 2.752 5 40 HFBB CC[C@@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@@H](c3ccccc3[N+](=O)[O-])N2C1=O 2702873 OEMDJHNEOJSFJP-GOEBONIOSA-N 419.459 2.823 5 40 HFBB CC(=O)N1CCN(c2ccc(C(=O)N[C@@H](C)c3ccc(F)cc3)cc2[N+](=O)[O-])CC1 12556459 ZTMQAZWESVPCDD-AWEZNQCLSA-N 414.437 2.893 5 40 HFBB Cc1ccccc1OCCN(C)C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O 12805455 BYSLDFVISRYIQC-UHFFFAOYSA-N 422.441 2.909 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 33158652 NROSCZVSDZLACA-HNNXBMFYSA-N 403.460 2.943 5 40 HFBB Cc1ccc(CCCNC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 220417242 SNYGCNKELYYOOU-MRXNPFEDSA-N 419.503 2.807 5 40 HFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 7068126 LZFPEJHPIKSNGT-CYBMUJFWSA-N 409.439 2.574 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1-n1nnc2ccccc21 8079442 PBNWVNAHMIBFOF-UHFFFAOYSA-N 401.448 2.893 5 40 HFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCOCC2)cc1 12737085 IUGZHSRXLHWWJC-UHFFFAOYSA-N 400.435 2.742 5 40 HFBB Cc1nc2ccccc2nc1COC(=O)[C@@H](C)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 12904042 BZFAKVSGSYNTEC-GFCCVEGCSA-N 420.381 2.574 5 40 HFBB Cc1cccc(C)c1N1C[C@@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 138802281 VJCOCSMPSQYWMV-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CCOC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224757450 APFQCKFARNYKOZ-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB COc1ccc(CN2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)cc1F 26257170 BGCBKMMLNYHMSJ-UHFFFAOYSA-N 416.453 2.889 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnn(CCCN3CCOCC3)c2N2CCCCC2)cc1 31771789 OKCDOKQULDWQPH-UHFFFAOYSA-N 400.483 2.566 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)O[C@H](C)C(=O)c2ccccc2)CC1=O 7881648 BBSJUWBSYZBNQA-UKRRQHHQSA-N 412.398 2.771 5 40 HFBB COc1ccccc1NC(=O)COC(=O)CCCC(=O)Nc1cccc([N+](=O)[O-])c1 8417313 PTYLNHRVKLDERW-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 16199912 YUNGSKXKDBISSW-UHFFFAOYSA-N 402.366 2.840 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C(=O)c3ccccc3)N3CCC[C@@H]3[C@@H]2C1=O 34847916 QWNBLHFUXGLTON-MDNKFWRPSA-N 419.437 2.738 5 40 HFBB COC(=O)CN(c1cc([N+](=O)[O-])ccc1Cl)S(=O)(=O)c1ccc(F)cc1 113889523 VHQPVUUDMUNAKJ-UHFFFAOYSA-N 402.787 2.756 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 138679705 PTTRALHJPRJYPB-FVCZOJIISA-N 417.421 2.959 5 40 HFBB 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O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)NC1CCCC1 5205820 KREBHMBKRJRBFK-UHFFFAOYSA-N 403.460 2.849 5 40 HFBB COC(=O)c1ccc([C@@H]2[C@@H]3CCCN3[C@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1 408567770 RHYRRVXJDJJTPF-JYLXEMOASA-N 407.426 2.528 5 40 HFBB COc1cc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc(OC)c1OC 9378047 XRIRWZGTAGWFFA-UHFFFAOYSA-N 401.419 2.583 5 40 HFBB Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCNCC2)c([N+](=O)[O-])c1 20154338 QUAWYROFZOCPQY-UHFFFAOYSA-N 404.854 2.984 5 40 HFBB CCOC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113884916 XRXOQUCJBGKFOT-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB Cc1cccc(C)c1NC(=O)COC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 8433867 KSSOZZLDFQBCBZ-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cn1ccnc1C(=O)c1ccc(N2CC[C@@H](OCc3ccccn3)C2)c([N+](=O)[O-])c1 84321900 MUEKLXGCIWAYPA-QGZVFWFLSA-N 407.430 2.750 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)N1CCCN21 100851218 VSDIHQASPCYNQC-KURKYZTESA-N 412.833 2.784 5 40 HFBB COCCCn1c(-c2ccc([N+](=O)[O-])cc2)nc2c(c(=O)c3ccccc3n2C)c1=O 2241289 DQKABBGGSJCTBO-UHFFFAOYSA-N 420.425 2.860 5 40 HFBB CCn1nc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c2ccccc2c1=O 2645716 MCCHBGIRNBMCQY-UHFFFAOYSA-N 411.370 2.548 5 40 HFBB CNc1ccc(C(=O)OCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)cc1[N+](=O)[O-] 6983293 FFFPHSQLUVXEPZ-LBPRGKRZSA-N 412.402 2.557 5 40 HFBB O=C(Cn1c(=O)n(-c2ccccc2)c(=O)c2ccccc21)c1ccc([N+](=O)[O-])cc1 10338750 UVGVAQMTHKBFRI-UHFFFAOYSA-N 401.378 2.944 5 40 HFBB CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2ccccc2c1 12942581 ABHQYWONURPXDY-GOSISDBHSA-N 416.455 2.808 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)c1cccc([N+](=O)[O-])c1C 20105359 UWJSKKLWSIASPI-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB O=c1[nH]c(O)nc(/C=C/c2cc(Br)c(Br)o2)c1[N+](=O)[O-] 34794311 DDTHSZMTPRGUBD-OWOJBTEDSA-N 406.974 2.672 5 40 HFBB C[C@H](C(=O)Nc1ncccn1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 58341800 JTSZDBUTXQZOIU-GFCCVEGCSA-N 424.383 2.553 5 40 HFBB Cc1c(N(CC(=O)N[C@@H](C)CCc2ccccc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220031559 OXBUCQCZYJUGSU-HNNXBMFYSA-N 419.503 2.807 5 40 HFBB COc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2/SC(=O)N(CC(=O)O)C2=O)o1 409147278 VMMAEMCHYHMUQG-VGOFMYFVSA-N 404.356 2.984 5 40 HFBB COc1ccc(CN(C)CC(=O)Nc2cc(OC)c([N+](=O)[O-])cc2C)c(OC)c1 7974326 DFPZVFOHGJFINN-UHFFFAOYSA-N 403.435 3.000 5 40 HFBB CC1(C)C2([N+](=O)[O-])CN3CC1([N+](=O)[O-])CN(C2)C3c1ccc(Cl)cc1Cl 19322224 KHDSXIJLOOFKLH-UHFFFAOYSA-N 401.250 2.694 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 28831849 IIOVDCJJYDRRLW-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCOC(=O)[C@H](Cc1c[nH]c2cc([N+](=O)[O-])ccc12)N1C(=O)c2ccccc2C1=O 1694651 CZNOUVMVFVPJSK-SFHVURJKSA-N 407.382 2.847 5 40 HFBB CC(C)C(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1 6590526 LFXHKKORUOAWIZ-UHFFFAOYSA-N 419.551 2.764 5 40 HFBB COc1ccc(C(=O)[C@@H](C)OC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 7881402 SGKIACVQFCDFER-UKRRQHHQSA-N 412.398 2.771 5 40 HFBB O=C(Nc1ccc2c(c1)OCCO2)c1ccc(=O)n(Cc2cccc([N+](=O)[O-])c2)c1 10187964 RAQSJOIYRHNFRK-UHFFFAOYSA-N 407.382 2.828 5 40 HFBB NC1=Nc2nc3cc4c(cc3n2[C@H](c2cc([N+](=O)[O-])ccc2Cl)N1)OCCCO4 12549550 KQFYMMHPMUHOBE-MRXNPFEDSA-N 414.809 2.856 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@@H]1CCCc2ccccc21)S(C)(=O)=O 22375238 XANAYMBPTAQLJK-GOSISDBHSA-N 417.487 2.863 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1 28831848 IIOVDCJJYDRRLW-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CC(C)(C)c1ccc(NC(=O)COC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 3382113 GTMXHTNHCVYHNL-UHFFFAOYSA-N 413.430 2.804 5 40 HFBB Cc1c(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3Cl)C2=O)cccc1[N+](=O)[O-] 3593515 ODMURRPTRMXAEC-LJQANCHMSA-N 416.821 2.962 5 40 HFBB CCCCS(=O)(=O)c1nnc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)s1 9435254 DTJKUCVEANMSMU-UHFFFAOYSA-N 404.857 2.926 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@@H](c2ccc(F)cc2)n2nnnc2N3)cc1 10296235 YCSVEDZFFOBPPG-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB O=[N+]([O-])c1cccc(-c2nnc(O)c3c2[C@@H](c2ccc(F)cc2)n2nnnc2N3)c1 10296549 MKZWBFQNAFXHFY-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB O=C(CSc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)Nc1ccc([N+](=O)[O-])cc1 10612714 VMGLZKMQEVZUIB-UHFFFAOYSA-N 422.426 2.748 5 40 HFBB O=C(NCc1ccccc1CN1CCOCC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 24379061 ZGSYJHDBMBTTRK-UHFFFAOYSA-N 424.501 2.957 5 40 HFBB O=C(C[C@H](NCc1ccco1)C(=O)O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 65090341 OIWUAYBKSRSULD-AWEZNQCLSA-N 416.415 2.883 5 40 HFBB O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)Nc1ccc(F)c(Cl)c1 5845692 YPOJTKDOGUGOSE-UHFFFAOYSA-N 411.773 2.587 5 40 HFBB Cc1nn(CC(=O)OCC(=O)c2cc(C)n(-c3nccs3)c2C)c(C)c1[N+](=O)[O-] 9125299 NXVWAEGQIYKNCX-UHFFFAOYSA-N 417.447 2.698 5 40 HFBB CCc1ccccc1NC(=O)CNc1ccc(S(=O)(=O)NC(C)C)cc1[N+](=O)[O-] 6831102 SBAPFWYCTXKSID-UHFFFAOYSA-N 420.491 2.895 5 40 HFBB Cn1c(CCN2CCOCC2)nc2cc(NC(=O)c3cccc([N+](=O)[O-])c3)ccc21 20503237 ZXTWOHXAJZAERQ-UHFFFAOYSA-N 409.446 2.609 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1N1CCN(c2ccccc2)CC1 6257943 JUQMABORCGLLIL-UHFFFAOYSA-N 416.503 2.706 5 40 HFBB O=C(Nc1ccccc1Cn1cccn1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40104935 HLIOAPKNTFCFFG-UHFFFAOYSA-N 407.434 2.589 5 40 HFBB COCCCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@H]2CCCN2C[C@@H]1C 1519068420 VETNXFHDSYWEPO-MAUKXSAKSA-N 400.483 2.563 5 40 HFBB CCOC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=S)N[C@H]1c1cccc([N+](=O)[O-])c1 7061884 WCVPDZNCPUDXIK-RDJZCZTQSA-N 405.476 2.842 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1 14022797 OMVYKLHHRXCEMH-HNNXBMFYSA-N 403.460 2.943 5 40 HFBB CC(=O)c1ccc(NC(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8416312 IUTXHANZUPGNBH-UHFFFAOYSA-N 413.386 2.698 5 40 HFBB O=C(Nc1cccc(Cn2cccn2)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 44247688 DOSYLZMIFJIOJN-UHFFFAOYSA-N 407.434 2.589 5 40 HFBB Cc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] 224781878 ZLUPQOIVPGOGQH-UHFFFAOYSA-N 402.787 2.976 5 40 HFBB O=C(COc1ccccc1[N+](=O)[O-])NC(=S)Nc1ccc(Cl)c(C(=O)O)c1 6884692 OASXUPUCGGRIED-UHFFFAOYSA-N 409.807 2.838 5 40 HFBB Cc1ccccc1N1C(=S)N(c2ccc([N+](=O)[O-])cc2)[C@@H]2CS(=O)(=O)C[C@H]21 12421635 KILJAUPCAWJQHD-IAGOWNOFSA-N 403.485 2.680 5 40 HFBB C[C@@H]1CCCN(S(=O)(=O)c2ccc(NC[C@@H](C)Cn3cccn3)c([N+](=O)[O-])c2)C1 36390977 PHSLMBGROQDEAL-HZPDHXFCSA-N 421.523 2.960 5 40 HFBB COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 55842369 IFJNTVVOUKXTMB-UHFFFAOYSA-N 409.402 2.743 5 40 HFBB CC[C@H]1SC2=NC(C)=C(C(=O)OCCOC)[C@H](c3ccccc3[N+](=O)[O-])N2C1=O 2702871 OEMDJHNEOJSFJP-ZBFHGGJFSA-N 419.459 2.823 5 40 HFBB COC(=O)c1cc(C(=O)OCC(=O)Nc2ccccc2OC(F)F)cc([N+](=O)[O-])c1 3271264 PMMRNQYTVMLEMN-UHFFFAOYSA-N 424.312 2.778 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])[C@@H]1C[C@H]2CC[C@H]1C2 108921374 FWBOHCNVWBDEKI-AESZEHBQSA-N 409.508 2.852 5 40 HFBB CC[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222519139 RKJVLXWCRBMUOM-HNNXBMFYSA-N 421.431 2.507 5 40 HFBB Cc1ccc2c(c1)nnn2C1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 4895270 YAVYTTREZJMIEQ-UHFFFAOYSA-N 401.448 2.674 5 40 HFBB COc1ccc(NC(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 8245846 FQOPJDUDJULTBI-CQSZACIVSA-N 401.394 2.772 5 40 HFBB O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCc1ccc(OCC(F)(F)F)cc1 12790646 AXILUKKDRKTIKM-UHFFFAOYSA-N 411.336 2.582 5 40 HFBB Cc1c(N(CC(=O)NCCSc2ccccc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220025884 YNKVMDUXVQSJJU-UHFFFAOYSA-N 423.516 2.578 5 40 HFBB CCN1CCN(c2ccc(C(=O)OC)cc2NC(=O)c2ccccc2[N+](=O)[O-])CC1 4712235 OFBHQIUKAYGLCS-UHFFFAOYSA-N 412.446 2.776 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 408649036 ZERHEZNTJXOWTM-LLVKDONJSA-N 400.347 2.503 5 40 HFBB COc1cc(OC)c([N+](=O)[O-])cc1/C=C1/NC(=O)N(Cc2ccc(F)cc2)C1=O 409011139 MJHWEPICYHTLAK-VGOFMYFVSA-N 401.350 2.844 5 40 HFBB CCN1CCN(c2ccc(NC(=S)NC(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 17089588 WZXYOHGNFKVHRG-UHFFFAOYSA-N 413.503 2.864 5 40 HFBB C[C@H]1C[C@H](C)CN(CCNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1 36397887 SOKHEIFVUHIISD-HOTGVXAUSA-N 410.540 2.769 5 40 HFBB Cc1cccc(CCCNC(=O)[C@@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220417416 LLTOGZHCLKPYRF-MRXNPFEDSA-N 419.503 2.807 5 40 HFBB COC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2)sc2c1CCN(C(C)=O)C2 4281074 KIBBKYKRSROJGQ-UHFFFAOYSA-N 403.416 2.600 5 40 HFBB CS(=O)(=O)c1cccc(-c2nnc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])o2)c1 9707640 HIABKOLNCVIMMQ-UHFFFAOYSA-N 422.806 2.954 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@H](c2ccccc2[N+](=O)[O-])n2nnnc2N3)cc1 10232588 BBRQUXOEQPSWKY-KRWDZBQOSA-N 402.374 2.747 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(OC)c(OC)c1 3472808 LKRJCOISEAVGPO-NSHDSACASA-N 404.375 2.805 5 40 HFBB C[C@@H](C(=O)Nc1ncccn1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 58341799 JTSZDBUTXQZOIU-LBPRGKRZSA-N 424.383 2.553 5 40 HFBB CCOc1cc([N+](=O)[O-])cc(/C=C2/SC(=O)N(CC(=O)OC(C)C)C2=O)c1O 205705975 WAPXUEPKCOICPZ-AWNIVKPZSA-N 410.404 2.687 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)Nc2ccc(NC(C)=O)cc2)CC1=O 408647886 XUZWYRGHYONVMJ-ZDUSSCGKSA-N 412.402 2.553 5 40 HFBB Cc1ccccc1NC(=O)COC(=O)[C@@H]1CC(=O)N(c2ccc(C)c([N+](=O)[O-])c2)C1 8433902 LPLPNZFZBVJVGO-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])C1=O 8942207 RGBBJXLPVNMXSP-HXUWFJFHSA-N 414.393 2.920 5 40 HFBB COc1cc(NC(=O)CSc2nnnn2-c2ccccc2)c(C)cc1[N+](=O)[O-] 9097016 LSXBZALWHSJGHW-UHFFFAOYSA-N 400.420 2.618 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(Cc1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 408678861 DNRWERGCZQGOPY-FVCZOJIISA-N 417.421 2.959 5 40 HFBB CCc1ccccc1NC(=O)CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])ccc2OC)C1=O 409228092 UAXYCJKWZRXIIR-GZTJUZNOSA-N 424.413 2.697 5 40 HFBB Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)n1 2069187 KPDITNBTXIBQPH-UHFFFAOYSA-N 413.415 2.746 5 40 HFBB O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)Nc1ccc([N+](=O)[O-])cc1 9599828 SIUDVTOCKHVHTM-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 38753599 UXZZSCVODXJDGP-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB Cc1nccn1-c1cc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)ccn1 69453964 YCYHKBJGFNHKBQ-UHFFFAOYSA-N 403.402 2.600 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)OCC(=O)c2ccc(F)cc2)CC1=O 408642155 DPJKRLNLBRBWLN-ZDUSSCGKSA-N 416.361 2.522 5 40 HFBB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1ccc([N+](=O)[O-])cc1Cl 6315964 RYUKPRDASYSFIB-UHFFFAOYSA-N 401.762 2.885 5 40 HFBB O=[N+]([O-])c1nn(-c2ccc3c(c2)OCCO3)[n+]([O-])c1NCc1ccc(F)cc1Cl 13574152 VIVCWDIDBBAUIA-UHFFFAOYSA-N 421.772 2.590 5 40 HFBB O=[N+]([O-])c1ccc(CSC2=N[C@@H]3CS(=O)(=O)C[C@@H]3N2c2ccccc2)cc1 32640665 BZEMBVCEVLXDTJ-SJORKVTESA-N 403.485 2.870 5 40 HFBB CC[C@@H](NC(=O)COc1ccc([N+](=O)[O-])c(OC)c1)c1ccc(S(C)(=O)=O)cc1 219828759 LBDBZBSSYYQTHS-MRXNPFEDSA-N 422.459 2.653 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1nnc(NC(=O)c2ccccc2)s1 225332077 FETGWEWGUHDYIX-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB Cc1c(OCC(=O)NCCCN2CCCC2=O)ccc2c1oc(=O)c1ccccc12 5244598 QNHASCVSJCRTQY-UHFFFAOYSA-N 408.454 2.762 5 40 HFBB COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc(OC)c2)cc([N+](=O)[O-])c1 6642071 IGCJEZPYUYDEQC-NSHDSACASA-N 402.359 2.574 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCc1ccccc1Cl)S(C)(=O)=O 10331400 SAUMVKOOYKQFID-UHFFFAOYSA-N 411.867 2.639 5 40 HFBB COC(=O)c1cc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc([N+](=O)[O-])c1 12872253 IPXKKUGKIPROPQ-LBPRGKRZSA-N 420.443 2.618 5 40 HFBB C[C@@H]1Cc2ccccc2N1C1CCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1 40135096 QUKNZOCLANPTRW-CQSZACIVSA-N 416.503 2.662 5 40 HFBB CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 50732269 JXRJXRXBOZOXSJ-HZPDHXFCSA-N 413.478 2.938 5 40 HFBB O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCCCc1nc2ccccc2[nH]1 11486185 ICBRXICIHFJCMY-UHFFFAOYSA-N 423.429 2.908 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]2C)cc1 13632967 PNTBTKZCYNOBSJ-AWEZNQCLSA-N 420.447 2.711 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)c2ncccc12 24759626 RWZASSSNXFXTGH-UHFFFAOYSA-N 412.471 2.795 5 40 HFBB COc1ccc(NC(=O)NCCN2CCN(C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 34863415 DDKSHDYHBQKUCH-FQEVSTJZSA-N 413.478 2.714 5 40 HFBB CCN(c1ccccc1)S(=O)(=O)c1ccc(-n2cc([N+](=O)[O-])cn2)c([N+](=O)[O-])c1 72310930 QDONVPPRUCEZRM-UHFFFAOYSA-N 417.403 2.904 5 40 HFBB Cc1ccc(N2CN=c3s/c(=C\c4cccc([N+](=O)[O-])c4)c(=O)n3C2)cc1Cl 1311682 VWCCINPJTNGYQK-IUXPMGMMSA-N 414.874 2.663 5 40 HFBB COc1cc([N+](=O)[O-])c(C(=O)N[C@H](CO)C[C@@H](O)c2ccccc2)cc1SC 89423815 PLTJKMNEJPRJCX-XJKSGUPXSA-N 406.460 2.540 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)Nc1ccc(F)c(F)c1)S(C)(=O)=O 220390628 RAPCGDZOBQFYKU-LLVKDONJSA-N 413.402 2.975 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c(C)c1 8039068 XGGUMOBCTAOYKM-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CC[C@H](C(=O)N1CCc2ccccc21)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222526456 VWCRFDKSAUUMHC-QGZVFWFLSA-N 403.460 2.729 5 40 HFBB O=C(O)c1ccc(Br)c(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 226354095 NWXMMGOMXHDHGZ-UHFFFAOYSA-N 401.194 2.856 5 40 HFBB O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccc(OC(F)F)c2)CC1 27158196 QCEVXPDGEUUXAJ-UHFFFAOYSA-N 419.384 2.723 5 40 HFBB O=C(CCc1nc(-c2ccc(F)cc2)no1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 40012857 VURGDTREOOVJMX-MRXNPFEDSA-N 400.366 2.566 5 40 HFBB COCc1n[nH]c(-n2ccc3nc4ccn([C@@H]5CCCC[C@@H]5C)c(=O)c4cc3c2=O)n1 40398995 FMCXJQKQHDBTOP-SCLBCKFNSA-N 420.473 2.716 5 40 HFBB CC[C@H](C)n1c(=N)c(C(=O)NCc2cccnc2)cc2c(=O)n3cc(C)ccc3nc21 100628123 PJURUOBAKUUNTA-HNNXBMFYSA-N 416.485 2.733 5 40 HFBB CC[C@H](C(=O)Nc1ccccc1OC)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222516664 XAHANZVGSHTASC-MRXNPFEDSA-N 407.448 2.787 5 40 HFBB CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 408552770 NQOKQVABGQPKNS-CYBMUJFWSA-N 421.475 2.998 5 40 HFBB COc1cc(Cl)c([C@@H]2CN(C)[C@@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408567826 RPAMAYVIJGLZTE-FOPRYUNUSA-N 417.849 2.879 5 40 HFBB O=C(O)CN1C(=O)S/C(=C/c2ccc(Oc3ccc([N+](=O)[O-])cn3)cc2)C1=O 409126622 LRXJMDAWZUUGNH-NTUHNPAUSA-N 401.356 2.903 5 40 HFBB COc1cc(OC)cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 6552057 ANQRPKVCVQOLRX-NSHDSACASA-N 404.375 2.805 5 40 HFBB Cc1cccc(C)c1NC(=O)CN(C)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 24802541 JXKJJVAUMXHJCN-UHFFFAOYSA-N 408.418 2.503 5 40 HFBB CN(C)[C@@H](CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(F)c1 27145237 KMROKBGRBUDZLG-FQEVSTJZSA-N 416.453 2.603 5 40 HFBB O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CN1CCN(c2cccc(Cl)c2)CC1 28940836 ZQKLHYSEGAVSGB-UHFFFAOYSA-N 400.822 2.624 5 40 HFBB O=C(O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225035340 FGYHRUZPBCIDJD-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB CSC[C@H](NC(=O)COc1ccc2c(oc(=O)c3ccccc32)c1C)C(=O)O 2114729 JSBFDBUIYKGMFX-HNNXBMFYSA-N 401.440 2.566 5 40 HFBB biogenic O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCN1CCOCC1)c1ccccc1 6785620 JCJLDFNQQJRTIA-LJQANCHMSA-N 418.881 2.850 5 40 HFBB COc1cc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c([N+](=O)[O-])cc1OC 24980138 NHZZCVHMHYGIIW-UHFFFAOYSA-N 413.430 2.778 5 40 HFBB O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1nc(-c2cccs2)no1 32831873 FVRPNUCXWLICAP-UHFFFAOYSA-N 421.398 2.650 5 40 HFBB Cc1ccc(CNC(=O)c2cc3c(=O)n4ccccc4nc3n(C(C)C)c2=N)cc1 101160257 YPDLFAIXZMJYBB-UHFFFAOYSA-N 401.470 2.948 5 40 HFBB COc1ccc(OC)c(NC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3OC)C2)c1 408641754 MPURAFTWXIXLIS-GFCCVEGCSA-N 415.402 2.612 5 40 HFBB COC(=O)[C@H](C)Oc1cc(O[C@H](C)C(=O)OC)c2c(=O)c3ccccc3oc2c1 4083851 RETDYBOPJHDCOD-NWDGAFQWSA-N 400.383 2.827 5 40 HFBB biogenic Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)NC[C@H]1CCCO1 4698030 RADHFQNRCYBZBY-QGZVFWFLSA-N 419.459 2.613 5 40 HFBB Cc1cc(C(=O)COC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(C)n1C[C@H]1CCCO1 5687547 VNDASWPZFVONGF-OAHLLOKOSA-N 401.419 2.814 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)Nc3ccc(F)cc3[N+](=O)[O-])CC2=O)cc1 5975792 VDZXQHMAJCAELV-ZDUSSCGKSA-N 415.377 2.577 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@@H](C)c1ccc(F)cc1)S(C)(=O)=O 20492936 QTSQGWVNIJOGSI-ZDUSSCGKSA-N 409.439 2.686 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccccc1[N+](=O)[O-])N1C(=O)CCCC1=O 408678847 DMJRPEUFTJRKJA-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)c3ccc(F)cc3)CC2=O)cc1[N+](=O)[O-] 7881672 YYBULHNYLIQOAN-AWEZNQCLSA-N 400.362 2.821 5 40 HFBB CC(=O)[C@H]1[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N21 4311563 RCHZZIMMUJUXMH-ZRNYENFQSA-N 403.394 2.574 5 40 HFBB O=C(CSc1ccc2nnc(-c3ccccn3)n2n1)Nc1cccc([N+](=O)[O-])c1 9599805 PZEKHAFQVRJYKL-UHFFFAOYSA-N 407.415 2.825 5 40 HFBB CO[C@@H]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1 97082002 NLIMULGZCVRILZ-JKSUJKDBSA-N 409.483 2.978 5 40 HFBB COc1cc(OC)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1OC 3371093 VYQRLVPCCVRTJX-UHFFFAOYSA-N 408.338 2.555 5 40 HFBB CCOC(=O)c1sc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)nc1C 9892103 PIKMZSBPLYQNOK-UHFFFAOYSA-N 408.461 2.972 5 40 HFBB CS(=O)(=O)c1ccc(N2CCC(C(=O)Nc3ccccc3O)CC2)c([N+](=O)[O-])c1 12564679 LWROITHJMBILFI-UHFFFAOYSA-N 419.459 2.559 5 40 HFBB O=[N+]([O-])c1ccc(CN2C[C@H](O)C[C@H]2c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 15674853 XZCHWTLSQVOXIB-SJORKVTESA-N 411.374 2.861 5 40 HFBB biogenic,in-vitro CCOC(=O)[C@@H]1CSCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 32902942 RVXGJYVVRIUJBV-IBGZPJMESA-N 410.495 2.662 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccc(Br)cc1 101076360 XLSYZQQQEVRNQE-ZFWWWQNUSA-N 416.187 2.650 5 40 HFBB O=C(COC(=O)c1ccc(N2CCCC2=O)cc1)Nc1ccc(F)cc1[N+](=O)[O-] 6883093 VSLYXHVCBDKPCN-UHFFFAOYSA-N 401.350 2.656 5 40 HFBB Cc1c(NC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cccc1[N+](=O)[O-] 8267072 NMCSJSJHBDMSNH-OAHLLOKOSA-N 419.459 2.613 5 40 HFBB C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cc(Cl)c3c(c2)OCCO3)C1=O 9872992 BVNTWPGIUYSDJO-IBGZPJMESA-N 417.805 2.987 5 40 HFBB CC[C@H](C(=O)NCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 12764651 CKGICXMSJVMIPA-INIZCTEOSA-N 405.476 2.720 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C 408606993 MUEIKHNMENPVSO-AWEZNQCLSA-N 421.475 2.916 5 40 HFBB NC(=O)COc1ccc(/C=C2\SC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1 408966300 ZKLLGKCLVVJUIE-SXGWCWSVSA-N 413.411 2.695 5 40 HFBB CCCCN1c2ccc([N+](=O)[O-])cc2CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]1CCC 5370495 VQCSKHHKZHQIRB-QGZVFWFLSA-N 416.478 2.963 5 40 HFBB CCc1ccccc1NC(=O)COC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 8040073 RSYYNJLHZXQKSV-OAHLLOKOSA-N 411.414 2.692 5 40 HFBB O=C1N[C@H](c2ccccc2[N+](=O)[O-])[C@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 9090195 XHWWAARUXDSGHW-JMSVASOKSA-N 415.349 2.760 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@H]2CCC[C@@H](C)[C@@H]2C)cc([N+](=O)[O-])c1 14086040 JXMNEBWNEWMBLJ-ZHRONYKTSA-N 406.435 2.868 5 40 HFBB COc1ccc(NC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c([N+](=O)[O-])c1 32895479 ZBVQQEGVBGKRBZ-QGZVFWFLSA-N 404.423 2.700 5 40 HFBB O=C(NCC1(O)CCCCC1)c1ccc([N+](=O)[O-])cc1I 72292950 OOOOAZPDJRYNAG-UHFFFAOYSA-N 404.204 2.624 5 40 HFBB COc1cc(C(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])cc1OC 4581204 SLDGHJFHEKLRNA-UHFFFAOYSA-N 418.446 2.854 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1cc(C)cc(C)c1)S(C)(=O)=O 8301055 BUBNGTMUPNCTGW-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB C[C@H](C(=O)NCc1ccccc1Cl)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220411055 XDMQTDLQYZNVRE-GFCCVEGCSA-N 411.867 2.719 5 40 HFBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 2084498 NVMLWVRPOKXNPC-ZETCQYMHSA-N 411.871 2.677 5 40 HFBB COc1ccccc1-n1c(S[C@H](C)C(=O)NC(N)=O)nc2cc([N+](=O)[O-])ccc21 9662677 HBPMUTVPMWMCMZ-SNVBAGLBSA-N 415.431 2.618 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3ccccc3F)CC2)c2ccncc12 12557623 NWBSMRMYMGVCFU-UHFFFAOYSA-N 416.434 2.793 5 40 HFBB Cc1c(O[C@H](C)C(=O)NCCCN2CCOCC2)ccc2c1oc(=O)c1ccccc12 20547630 FOVGOPFABUOGJL-QGZVFWFLSA-N 424.497 2.860 5 40 HFBB C[C@H](Sc1n[nH]c(=O)n1CCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 26335780 QRXSQVNYFGQZGD-ZDUSSCGKSA-N 413.459 2.842 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NC12CC3CC(CC(C3)C1)C2)S(C)(=O)=O 10365307 PYBSQIVNEQXTPJ-UHFFFAOYSA-N 421.519 2.754 5 40 HFBB COc1ccc(N2C[C@@H](C(=O)OCc3cccc([N+](=O)[O-])c3)CC2=O)c(OC)c1 11834103 ARNWWWSRTFJHQH-AWEZNQCLSA-N 400.387 2.708 5 40 HFBB C[C@H]1CCN2c3ccc([N+](=O)[O-])cc3C[C@@]3(C(=O)NC(=O)N(C(C)(C)C)C3=O)[C@@H]2C1 17015243 YEPHOXHJHDAUQS-SAZGQGMLSA-N 414.462 2.619 5 40 HFBB CCOC(=O)[C@H](c1ccc(F)c(F)c1)N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 58244963 PUMKZDMIADUMJF-INIZCTEOSA-N 414.386 2.798 5 40 HFBB CC(C)OC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc([N+](=O)[O-])cc1 13154458 AQIDWBRXCNUVNG-WKRCXCSHSA-N 421.446 2.538 5 40 HFBB COCCNC(=O)C1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 32829443 FXKJMGZALAKQHB-UHFFFAOYSA-N 420.344 2.501 5 40 HFBB COc1ccc(Cl)cc1N(CC(=O)O)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113893768 CVVCHCCMRDKBFR-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB CCOc1ccccc1NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220401266 PNHWBFVKXCVGAS-ZDUSSCGKSA-N 407.448 2.787 5 40 HFBB C[C@@H](CCc1ccccc1)NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220413790 KYSLIEMQBVEPFP-HOTGVXAUSA-N 419.503 2.887 5 40 HFBB O=C(CSCc1ccc([N+](=O)[O-])cc1)NCc1ccc(CN2CCOCC2)cc1 224541114 YPCBNBSLAQHFFL-UHFFFAOYSA-N 415.515 2.977 5 40 HFBB O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)Nc1cccnc1 5338466 RFYJTHZRLRJUQF-UHFFFAOYSA-N 412.427 2.824 5 40 HFBB Cc1ccc(Sc2ccc(C(=O)O[C@H](C)C(=O)NC(N)=O)cc2[N+](=O)[O-])cc1 8229942 HTFOAANAAZTBFA-LLVKDONJSA-N 403.416 2.795 5 40 HFBB Cc1cccc(C(=O)NC(=S)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 20410890 JSKIFUXNURSWRB-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB CCc1cccc(N2C[C@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)c1 24864496 HTDFAWDQPCYOLA-GOSISDBHSA-N 422.485 2.859 5 40 HFBB CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1 15173463 OTAZSWWCMQTMSB-UHFFFAOYSA-N 404.492 2.562 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 44332348 TUEFRCOHPIAZRP-UHFFFAOYSA-N 400.366 2.860 5 40 HFBB CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)n2)CC1 89954526 INYMSYUTUHJRSS-UHFFFAOYSA-N 417.853 2.560 5 40 HFBB CCOc1ccccc1N1C[C@@H](C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)CC1=O 408641835 DCBIKPSDIJKTMV-HNNXBMFYSA-N 412.398 2.773 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(Cc3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@@H]32)c1 10272615 KZDKFWHEEZXGDZ-OALUTQOASA-N 415.471 2.819 5 40 HFBB Cc1ccccc1NC(=S)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17081870 FKINJCZAOLUUMO-UHFFFAOYSA-N 400.460 2.867 5 40 HFBB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3596261 FEGHIMNENHEMOR-HXUWFJFHSA-N 414.393 2.920 5 40 HFBB C[C@@H](c1ccccc1)N1C[C@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 7232519 OOEANLOYLASTTJ-GOEBONIOSA-N 411.414 2.686 5 40 HFBB CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 50732271 JXRJXRXBOZOXSJ-CVEARBPZSA-N 413.478 2.938 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 408612738 YOGQCIMXFANOEV-UHFFFAOYSA-N 421.475 2.951 5 40 HFBB CNS(=O)(=O)c1ccc(Nc2ccc(F)c(N3CCCC3=O)c2)c([N+](=O)[O-])c1 40153644 MLQHZMVJEYOXRH-UHFFFAOYSA-N 408.411 2.512 5 40 HFBB CC(C)COC(=O)CN1C(=O)S/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)C1=O 409358641 MVFLGFXJVZVQCE-CPSFFCFKSA-N 408.388 2.559 5 40 HFBB COc1ccc(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2Cl)cc1F 4619161 PVPXMQHEWVWMOD-UHFFFAOYSA-N 403.819 2.786 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccc([N+](=O)[O-])cc1 7343696 LVWSNYAMJUCWSN-HNNXBMFYSA-N 407.382 2.694 5 40 HFBB COCCNc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 9255513 KKHNYROSMJTFFE-UHFFFAOYSA-N 403.873 2.889 5 40 HFBB Cc1cccc(N2CCN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)CC2)c1C 12536467 QOFRCCSRYKSIJI-UHFFFAOYSA-N 406.446 2.755 5 40 HFBB CCOC(=O)c1c(NC(=O)CCCn2cnc([N+](=O)[O-])n2)sc2c1CC[C@H](C)C2 12845970 XAGLPXBDARMYCT-NSHDSACASA-N 421.479 2.968 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 33158651 NROSCZVSDZLACA-OAHLLOKOSA-N 403.460 2.943 5 40 HFBB O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1 45797771 VACGQGZCOZKRFB-UHFFFAOYSA-N 409.895 2.896 5 40 HFBB CC[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CSc1nc2ccccc2c2nc(=O)c(C)nn12 102581831 ZYPSJPLZINNVOK-XLPNERPQSA-N 423.542 2.979 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OC)c(F)c1 225111359 VBBIFUOQHJUGBL-UHFFFAOYSA-N 412.395 2.501 5 40 HFBB O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2ccccc2[N+](=O)[O-])CC1 10633832 KMODSMUXCFSFFB-UHFFFAOYSA-N 420.809 2.884 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(NCc3cccc(Cl)c3)c([N+](=O)[O-])c2)CC1 12564809 VWWDZHWOBSPDIO-UHFFFAOYSA-N 424.910 2.796 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 13631947 WLVGOVHEVWNSNE-UHFFFAOYSA-N 423.878 2.703 5 40 HFBB CCc1n[nH]c(-n2ccc3nc4ccn(CCc5ccccc5)c(=O)c4cc3c2=O)n1 40399147 UDNZDTDVFSARMR-UHFFFAOYSA-N 412.453 2.624 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CCCN(c1ccccc1)S(C)(=O)=O 13847416 VTKZCRNSQKDZCM-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)N[C@H](C)c1ccc(C)cc1)S(C)(=O)=O 20041029 AEIRXEGQQLBOFC-CQSZACIVSA-N 421.475 2.555 5 40 HFBB Cc1noc(C)c1S(=O)(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 7907835 DYQBBYZOUDPUQE-UHFFFAOYSA-N 408.358 2.609 5 40 HFBB CCOC(=O)C1CCN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CC1 10272045 BFVVJNHKNGZYIQ-UHFFFAOYSA-N 410.370 2.668 5 40 HFBB Cc1nn(CC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)c(C)c1[N+](=O)[O-] 12990316 DJTNHFQWYIDVFC-UHFFFAOYSA-N 414.249 2.812 5 40 HFBB COC(=O)c1cc(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)cc([N+](=O)[O-])c1 72303151 FHZWQEWOEBQEAX-SFHVURJKSA-N 408.414 2.829 5 40 HFBB CCCC[C@@H](CC)CNC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O 223881648 FAVACMYYOSKKNF-CQSZACIVSA-N 415.512 2.702 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)C(Cl)(Cl)Cl)CC2)c([N+](=O)[O-])c1 408573217 MZODPNCRSJUVSJ-UHFFFAOYSA-N 424.668 2.790 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCC(=O)Nc2ccccc2C)c1 8416013 GZGLIRQMOXQGLF-UHFFFAOYSA-N 415.402 2.812 5 40 HFBB CCN(CC)S(=O)(=O)c1cc(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)n(C)c1 25834009 QAKBIASUTUHZFW-CQSZACIVSA-N 422.507 2.797 5 40 HFBB O=C(COC(=O)COc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Br 4979369 ZKGMPCISPZKIRD-UHFFFAOYSA-N 409.192 2.918 5 40 HFBB O=C(NC1CCCC1)c1cc2c(=O)n3ccccc3nc2nc1NC[C@@H]1CCCO1 26456959 QEPPDHSXTZECMU-HNNXBMFYSA-N 407.474 2.506 5 40 HFBB O=C(CNC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)Nc1ccc([N+](=O)[O-])cc1 408555255 WEQIGVRHCBCLNL-UHFFFAOYSA-N 411.201 2.595 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)N(CCc1ccccc1)[C@H]1CCS(=O)(=O)C1 4749887 YMBMSFFFHOUING-XTXLJPNXSA-N 414.483 2.866 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4cc(Cl)ccc4[N+](=O)[O-])cnc32)cc1 10251506 WMRISWUPYMMVKA-UHFFFAOYSA-N 424.804 2.836 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 32760486 YVGGAFCSBJINBI-CYBMUJFWSA-N 412.489 2.688 5 40 HFBB O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 32926069 ZNBUNGHKWNORQE-UHFFFAOYSA-N 422.401 2.651 5 40 HFBB Cn1ccnc1-c1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C(F)(F)F)[nH]n1 95444303 CUFAJTUFWHNFFJ-UHFFFAOYSA-N 416.341 2.538 5 40 HFBB CCOC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225009439 XBIACJXEWUMRFC-UHFFFAOYSA-N 423.403 2.570 5 40 HFBB O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccc([N+](=O)[O-])cc1Br 6566197 UDOAMWGIGZCSPH-UHFFFAOYSA-N 403.196 2.650 5 40 HFBB CO[C@H]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1 97082004 NLIMULGZCVRILZ-HOTGVXAUSA-N 409.483 2.978 5 40 HFBB CC(=O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@H]2C(=O)N(c3cccc(Cl)c3)C(=O)[C@@H]12 104496993 GGXKNQVEPWEXPE-DOTOQJQBSA-N 412.789 2.571 5 40 HFBB COc1ccc(CCNc2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1OC 16227453 NCUMPILSNYJYEO-UHFFFAOYSA-N 419.825 2.739 5 40 HFBB O=C(O)CN(c1cccc(Br)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225020615 JHJPSBJRANNVTM-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)N(C(=O)c1cccc([N+](=O)[O-])c1)C1=NCCS1 2223767 BPTWOKGZGQXNNP-UHFFFAOYSA-N 400.372 2.888 5 40 HFBB COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 21595828 BJRAANYUTSOAJO-UHFFFAOYSA-N 412.446 2.694 5 40 HFBB CCc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3CCC(O)CC3)c(O)n2n1 22855187 QUGCLOXBAXGPLU-HNNXBMFYSA-N 403.464 2.513 5 40 HFBB COc1cc(OC)c(C(=O)OCC(=O)Nc2ccc(F)cc2[N+](=O)[O-])cc1OC 4870242 SWJASSVTEVKZJI-UHFFFAOYSA-N 408.338 2.555 5 40 HFBB COc1cc(NC(=O)COC(=O)c2cncc(Br)c2)c(C)cc1[N+](=O)[O-] 9438653 YEEVREKIZJRFBQ-UHFFFAOYSA-N 424.207 2.865 5 40 HFBB CCOC(=O)c1c(NC(=O)CCCn2cnc([N+](=O)[O-])n2)sc2c1CCCC2 9673319 DGADLBQQILBJHC-UHFFFAOYSA-N 407.452 2.722 5 40 HFBB CS(=O)(=O)c1ccc(NCCNC(=O)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 12769388 RJYOHIBRHVMMFI-KRWDZBQOSA-N 417.487 2.647 5 40 HFBB CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCn1c(=O)n(C)c2ccccc21 14369578 BQAFNMKHUOKVIQ-UHFFFAOYSA-N 402.838 2.950 5 40 HFBB O=C1[C@@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@@H](c1ccc(Cl)cc1)N1CCCN21 19168833 BNSAJMZXAPGHAE-KURKYZTESA-N 412.833 2.784 5 40 HFBB CC(C)(C)NS(=O)(=O)c1ccc(NCc2ccc(OCCO)cc2)c([N+](=O)[O-])c1 58062471 JVRVIURHEZOMGY-UHFFFAOYSA-N 423.491 2.655 5 40 HFBB CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 30257165 TWXNQWGRBMUHCQ-UHFFFAOYSA-N 415.425 2.790 5 40 HFBB CC[C@H](NC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O)c1ccccc1 44948345 ZRCGNBJMBCKOHC-INIZCTEOSA-N 421.475 2.637 5 40 HFBB CCNC(=O)c1cc2c(=O)n3ccccc3nc2n(Cc2ccc(Cl)cc2)c1=N 101161433 HEVAPNJCKLANHP-UHFFFAOYSA-N 407.861 2.580 5 40 HFBB COC(=O)c1cc(C(=O)OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)cc([N+](=O)[O-])c1 3587776 HBCXUIGLMSNEFH-UHFFFAOYSA-N 402.359 2.569 5 40 HFBB CCn1c(COc2ccc([N+](=O)[O-])cc2)nc2cc(S(=O)(=O)N(C)C)ccc21 6975838 FUEUOKKWIOALSP-UHFFFAOYSA-N 404.448 2.794 5 40 HFBB CNc1ccc(C(=O)OCC(=O)N2c3ccccc3NC(=O)C[C@H]2C)cc1[N+](=O)[O-] 6983291 FFFPHSQLUVXEPZ-GFCCVEGCSA-N 412.402 2.557 5 40 HFBB O=C1[C@@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@H]2C(=O)N1c1ccc(Br)cc1 15974844 DWXNCTJRXPRHGS-UKRRQHHQSA-N 416.187 2.650 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)NNC2=Nc3ccccc3[C@@H](c3ccccc3)N2)cc1 16478527 BRDDDRQNXCTRKQ-LJQANCHMSA-N 423.454 2.758 5 40 HFBB Cc1ccc2nc3nc(NC[C@H]4CCCO4)c(C(=O)NC4CCCC4)cc3c(=O)n2c1 19234378 OELHHNUKKORPEZ-MRXNPFEDSA-N 421.501 2.814 5 40 HFBB CS(=O)(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccc(F)cc1 218264496 LDOTWWDWLONJJH-UHFFFAOYSA-N 401.803 2.792 5 40 HFBB C[C@H](OC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 10214170 AYSXHUYNBIREAK-JTQLQIEISA-N 423.784 2.688 5 40 HFBB CN(Cc1ccc(Cl)cc1)C(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 20488088 BOROYVSQYZGFHQ-UHFFFAOYSA-N 411.867 2.673 5 40 HFBB CCOC(=O)c1ccc(N2N=C(N)[C@H](Sc3ccc([N+](=O)[O-])cc3)C2=O)cc1 100998438 HEHABBDFCRJDDA-HNNXBMFYSA-N 400.416 2.551 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)OCC(=O)c2ccc(C)cc2)CC1=O 408654777 QUJUPQCJFSOQLE-HNNXBMFYSA-N 412.398 2.691 5 40 HFBB CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)COc2ccccc2[N+](=O)[O-])c1 5109105 ZYCCZYBKVBHPOB-UHFFFAOYSA-N 413.839 2.516 5 40 HFBB CN1C(=O)C(=C2C[C@H](c3c4ccccc4cc4ccccc34)NN2)C(=O)N(C)C1=O 5423570 VKYJCWSLJHRWKF-QGZVFWFLSA-N 400.438 2.837 5 40 HFBB Cc1cc(C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)c(C)n1[C@H](C)c1ccccc1 27054163 YIRPWSLNBSDTRI-CQSZACIVSA-N 422.441 2.766 5 40 HFBB COc1ccc(CCNC(=O)COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 1939395 RZUIAZFMEJCJKH-UHFFFAOYSA-N 422.821 2.781 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)/C=C/c1ccc2c(c1)OCO2 3247192 AQKRDMRRODQSEB-WNPFHQFXSA-N 414.370 2.916 5 40 HFBB C[C@H]1CCCN(c2ccc(C(=O)OCC(=O)NCC(F)(F)F)cc2[N+](=O)[O-])C1 7739670 HAWQBSUTFDTVRB-NSHDSACASA-N 403.357 2.666 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCc1nnc2n1CCCCC2 24987656 OOXHDDDQPDFISV-UHFFFAOYSA-N 415.497 2.832 5 40 HFBB COc1ccc(Cl)cc1S(=O)(=O)N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 408610940 VFBQQTDRWPLGGD-JTQLQIEISA-N 413.839 2.562 5 40 HFBB Cc1cccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)c1C 4393628 PPNGIYAGNYOUGD-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 14139645 SKKPYKSSRYOHPX-AWEZNQCLSA-N 409.446 2.902 5 40 HFBB COc1ccc(OC)c(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 7987547 MNGITZVWABKTSS-UHFFFAOYSA-N 402.403 2.806 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@@H]2[C@H]2C=Cc3ccccc3N12 8974650 WPYHZQLSBWADGA-CWJKEVGVSA-N 417.421 2.882 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NC[C@H](CO)Cc1ccco1 24205783 ZIMNPOUYPRRUAT-OAHLLOKOSA-N 423.491 2.626 5 40 HFBB O=C(Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 24335298 VSNSSCGZUQKSKX-UHFFFAOYSA-N 403.338 2.688 5 40 HFBB CCS(=O)(=O)[C@](Cl)(I)C(=O)c1cccc([N+](=O)[O-])c1 96518276 SVJINGMOAGVZTR-SNVBAGLBSA-N 417.608 2.540 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 97111798 KVUJUTLOSRBHAX-HKUYNNGSSA-N 415.421 2.890 5 40 HFBB COc1cc([C@@H]2N[C@@H](C(=O)O)CS2)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 4554633 OSIXKNMNHWPRQP-CZUORRHYSA-N 404.400 2.611 5 40 HFBB COc1cccc(NC(=O)CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 6639686 LBEHZPZAGNXVQF-UHFFFAOYSA-N 406.826 2.766 5 40 HFBB O=[N+]([O-])c1ccc(NCCNCCOc2nonc2-c2ccccc2)c([N+](=O)[O-])c1 8398611 FNHPKKONZJVYMT-UHFFFAOYSA-N 414.378 2.634 5 40 HFBB C[C@@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10415430 ZWAXXKSIAGVNNU-HWPZZCPQSA-N 418.789 2.900 5 40 HFBB O=C1CCCN1C[C@H]1CC[C@@]2(COCCN(Cc3c(Cl)cccc3[N+](=O)[O-])C2)O1 306127711 GFLHNVRLLUGWJJ-FOIQADDNSA-N 423.897 2.621 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(-n3cccn3)nc2)cc1Br 40146687 UZGXECHDYRXAML-UHFFFAOYSA-N 424.236 2.739 5 40 HFBB COc1ccc([C@H]2CC(c3cccc([N+](=O)[O-])c3)=NN2C(=O)CN2CCOCC2)cc1 58268777 HPXYDTCQORNNFE-OAQYLSRUSA-N 424.457 2.613 5 40 HFBB CN1[C@@H]2CC[C@@H]1CC(NC(=O)c1ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)cc1)C2 102014967 YPXFTSYWWSEUIR-HZPDHXFCSA-N 403.870 2.848 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@H](C)C(=O)N1CCc2ccccc21)S(C)(=O)=O 220392667 ACGSREKVZBYSPW-CQSZACIVSA-N 403.460 2.647 5 40 HFBB CCOC(=O)CN(c1cccc(OCC)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224759551 RSYIGYIEBBYJSP-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB COCCN1C(=O)S/C(=C/c2cc(Br)c(O)c([N+](=O)[O-])c2)C1=O 409143124 ZDAAHCDVAQZOTN-UXBLZVDNSA-N 403.210 2.746 5 40 HFBB CCOc1ccc(-n2c(S)nnc2Cn2ncc3ccccc3c2=O)c([N+](=O)[O-])c1 2219202 LUQVOUHREUSCOP-UHFFFAOYSA-N 424.442 2.621 5 40 HFBB CC(C)NC(=O)NC(=O)COC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 8945740 IOOVPASSJPHOCP-UHFFFAOYSA-N 409.782 2.899 5 40 HFBB CC1CCN(CCCNc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])CC1 18063052 OUZTXUKXNQRGGS-UHFFFAOYSA-N 410.540 2.913 5 40 HFBB COc1ccc(NC(=O)NC(=O)Cn2cnc3cc4ccccc4cc3c2=O)cc1 24324616 VBGCVJAGWKWNKG-UHFFFAOYSA-N 402.410 2.907 5 40 HFBB O=C(Cn1c(=O)oc2cc(Cl)ccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 39984215 IOYILFOVDSGTTB-UHFFFAOYSA-N 416.821 2.505 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)/c1=N\C(=O)C(C)(C)C 101176422 CPBRKEWAQYKPBP-MOHJPFBDSA-N 410.474 2.880 5 40 HFBB Cc1nc(S(=O)(=O)c2ccccc2)c(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)o1 138202826 XDFPSJACMOWAIU-UHFFFAOYSA-N 422.440 2.698 5 40 HFBB O=[N+]([O-])c1ccc(-n2cccc2[C@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)cc1 223589392 YHPFMXHILZVEKZ-MOPGFXCFSA-N 409.471 2.745 5 40 HFBB C[C@@H](C(=O)NCCSC1CCCC1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 224074056 SLUZKZPEVFUGEO-ZDUSSCGKSA-N 415.537 2.541 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1 224609046 KKTBBDCGRWVCOH-UHFFFAOYSA-N 414.823 2.927 5 40 HFBB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C 408553147 OGLUVHJOJVHCOE-ZDUSSCGKSA-N 407.448 2.526 5 40 HFBB C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2=O 3336261 XNPSWGZYKSTYKE-JEOXALJRSA-N 406.414 2.809 5 40 HFBB C[C@@H]1CN(C(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 17328227 FCSRCIBGGROFED-ZIAGYGMSSA-N 419.459 2.645 5 40 HFBB CN(C)c1ccc(C(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)cc1[N+](=O)[O-] 24135596 KSYZMQMYUKZSOX-UHFFFAOYSA-N 410.474 2.554 5 40 HFBB CCSc1n[nH]c(-n2ccc3nc4ccn(Cc5ccco5)c(=O)c4cc3c2=O)n1 40398931 SWTZMCDSUOSCFO-UHFFFAOYSA-N 420.454 2.572 5 40 HFBB CCc1nnc(S/C(=C\c2cc([N+](=O)[O-])ccc2N2CCOCC2)C(=O)O)o1 408631911 NEHGBLWTRIUMRZ-UVTDQMKNSA-N 406.420 2.595 5 40 HFBB C[C@@H](Sc1nnc(-c2ccco2)n1N)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8923959 WRAOWRUBRUGPSC-MRVPVSSYSA-N 408.827 2.933 5 40 HFBB O=[N+]([O-])c1ccc(NCc2ccc(Cl)cc2)c(S(=O)(=O)N2CCOCC2)c1 9157535 XATPRNMQIBBKKY-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CCC(=O)Nc1cccc([N+](=O)[O-])c1 29782315 SCMFKVOPHAQDGT-NRFANRHFSA-N 408.414 2.922 5 40 HFBB COc1cc(NC(=O)CN2CCN(c3ccccc3F)CC2)c(C)cc1[N+](=O)[O-] 57352213 IWSHUCGXXFMAEQ-UHFFFAOYSA-N 402.426 2.812 5 40 HFBB O=c1c2c3nc4ccccc4nc3n(C[C@@H]3CCCO3)c2ncn1C[C@@H]1CCCO1 2220725 DJUCCVCQOMVAJM-GJZGRUSLSA-N 405.458 2.652 5 40 HFBB O=C(C1=NO[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]12)c1ccc2ccccc2c1 3848919 RXODAPJODQJMQG-XLIONFOSSA-N 415.361 2.875 5 40 HFBB biogenic Cc1c(C(=O)N2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)cccc1[N+](=O)[O-] 4578433 VSZBKAFTCOYDBA-UHFFFAOYSA-N 412.402 2.718 5 40 HFBB O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 2134452 IFJNBTSLUHNFGX-QZTJIDSGSA-N 412.402 2.974 5 40 HFBB O=C(O)c1cc(-c2ccc(/C=C/c3[nH]c(=O)[nH]c(=O)c3[N+](=O)[O-])o2)ccc1Cl 6480352 JLYPAIQSUYMBRQ-GORDUTHDSA-N 403.734 2.753 5 40 HFBB Cc1cc(C)cc(N2C[C@@H](C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1 8037829 FZKFOCPTDJFGSS-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3CCCN3[C@H](C(=O)c3ccccc3)[C@@H]2C1=O 9331981 QWNBLHFUXGLTON-FFGOWVMKSA-N 419.437 2.738 5 40 HFBB CCn1nnc2cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3OC)ccc21 8943713 QNJXPEKPWZQMML-NSHDSACASA-N 413.390 2.552 5 40 HFBB Cc1cc(C)cc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 12421640 BZNXDXZWQSANHX-MSOLQXFVSA-N 417.512 2.989 5 40 HFBB CC1CCN(S(=O)(=O)c2ccc(NCCCn3ccnc3)c([N+](=O)[O-])c2)CC1 15206578 LRENWNIUAVJCFM-UHFFFAOYSA-N 407.496 2.714 5 40 HFBB O=c1c2cnn(-c3ccccc3[N+](=O)[O-])c2ncn1Cc1cc(-c2ccco2)on1 32831860 YBSMMEBKQMAFLH-UHFFFAOYSA-N 404.342 2.787 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(OCc2ccc(C(=O)OC)o2)c([N+](=O)[O-])c1 13135143 QPBFBCKBLMKRQE-UHFFFAOYSA-N 412.420 2.584 5 40 HFBB O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 40115907 CMFDXNXNBXMTCT-RTBURBONSA-N 401.413 2.864 5 40 HFBB COC(=O)CN(c1ccc(F)c(Cl)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113885824 FLXXDEBTFOOQNI-UHFFFAOYSA-N 402.787 2.756 5 40 HFBB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C 408601873 CBAJROSNCFWGBE-CQSZACIVSA-N 421.475 2.916 5 40 HFBB Cc1cc(S(=O)(=O)NC(C)C)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1C 409391339 NGBXBTVLOIRHKV-UHFFFAOYSA-N 421.475 2.916 5 40 HFBB COc1ccc(N([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 6478248 OWVGAUVCZBKWDW-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB CCOC(=O)c1nn(-c2ccc([N+](=O)[O-])cc2)cc1OCC(=O)Nc1ccccc1 40127949 YSDCTXDUONQNLX-UHFFFAOYSA-N 410.386 2.975 5 40 HFBB O=C(Nc1cc2nc(O)[nH]c2cc1N1CCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 408530870 JSHQJCPWJOMPIS-UHFFFAOYSA-N 412.362 2.937 5 40 HFBB CC(=O)Nc1ccc(C(=O)NCCCN(C)C)c([N+](=O)[O-])c1OCc1ccccc1 669369564 AJJMLFLPHYQYHB-UHFFFAOYSA-N 414.462 2.814 5 40 HFBB COCc1cc(C(C)=O)ccc1Oc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] 6186573 CVQJRIZCUZKUDU-UHFFFAOYSA-N 408.432 2.986 5 40 HFBB Cc1c(NC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cccc1[N+](=O)[O-] 8267069 NMCSJSJHBDMSNH-HNNXBMFYSA-N 419.459 2.613 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCN(C(=O)C(C)(C)c2ccccc2)CC1 29693053 QFONHOUYAUMHEA-UHFFFAOYSA-N 424.501 2.964 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@@H]2C=Cc3ccccc3N21 138261544 RCHZZIMMUJUXMH-MTQWCTHYSA-N 403.394 2.574 5 40 HFBB O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc(I)cc2)cc1 4666286 ZYSLZNPXTBUCPS-UHFFFAOYSA-N 405.169 2.967 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(CC(=O)Nc4ccc([N+](=O)[O-])cc4)cnc32)cc1C 11758436 OEESFNQWUQPKRZ-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB COC(=O)COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1Cl 408585298 YOFLADCPFXLIOY-UHFFFAOYSA-N 414.823 2.909 5 40 HFBB COc1cc(C(=O)OCC(=O)N2c3ccccc3C[C@H]2C)c([N+](=O)[O-])cc1OC 3450099 HMVGDIOGMYHTSS-GFCCVEGCSA-N 400.387 2.747 5 40 HFBB COc1ccc(NC(=O)COC(=O)/C=C/c2ccc(O)c(OC)c2)c([N+](=O)[O-])c1 7015669 CUHGJRHFVDWLIS-XBXARRHUSA-N 402.359 2.513 5 40 HFBB CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 7077807 VRWMZDPXBNDTAM-AWEZNQCLSA-N 421.475 2.998 5 40 HFBB Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 31555833 UBPDLXMIRPEOMY-UHFFFAOYSA-N 402.432 2.502 5 40 HFBB CCOC(=O)NN1C(=O)c2ccccc2N[C@H]1c1cc(OC)c(OC)cc1[N+](=O)[O-] 1441621 VUOOUFLIWJMSLU-QGZVFWFLSA-N 416.390 2.840 5 40 HFBB O=C(CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCN(c2ccccc2)CC1 2685192 RPTBRDUEGFQSTE-UHFFFAOYSA-N 402.432 2.944 5 40 HFBB CCOC(=O)c1cnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc1N 25135673 YIMZETCIDWKJPM-UHFFFAOYSA-N 411.827 2.528 5 40 HFBB COc1cc(CCNC(=O)CCc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC 10764841 QLWQFXSYPXMVAO-UHFFFAOYSA-N 402.403 2.632 5 40 HFBB Cn1/c(=N/C(=O)/C=C/c2cccc([N+](=O)[O-])c2)sc2cc(S(C)(=O)=O)ccc21 100859753 RTYSSMGOLXPPGW-QLQXKJDESA-N 417.468 2.692 5 40 HFBB CCOc1ccc(-c2noc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 223591194 PNPCKWPIMMXILV-UHFFFAOYSA-N 404.404 2.522 5 40 HFBB CCc1nnc(SCC(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)n1N 409165520 YZEHKZSOIGOLNB-UHFFFAOYSA-N 419.492 2.625 5 40 HFBB O=C1c2cccc3c(N4CCNCC4)ccc(c23)C(=O)N1c1cccc([N+](=O)[O-])c1 16399905 ZPCSVUGDRNHQKD-UHFFFAOYSA-N 402.410 2.958 5 40 HFBB O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 32769116 VMCMRLXAJNQLMR-IEBWSBKVSA-N 400.431 2.943 5 40 HFBB CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1cc(OCC)c(O)c([N+](=O)[O-])c1 35867434 XYMPFOQMYKNUCE-UHFFFAOYSA-N 420.418 2.622 5 40 HFBB Cc1cc(NC(=O)CSc2nnc3ccc(-c4cccc([N+](=O)[O-])c4)nn23)on1 36662681 AMVVRPICHUDLMC-UHFFFAOYSA-N 411.403 2.727 5 40 HFBB Nn1c(Cc2ccccc2F)nnc1SCc1cc([N+](=O)[O-])cc2c1OCOC2 3519725 OGGZISUGNHSHHY-UHFFFAOYSA-N 417.422 2.789 5 40 HFBB Cc1c(NC(=S)NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cccc1C(=O)O 17082815 RJACBCCXCSYHBT-UHFFFAOYSA-N 404.360 2.636 5 40 HFBB O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)N1CCC(Cc2ccccc2)CC1 33731189 RKVDGUYWFDCEKK-UHFFFAOYSA-N 406.442 2.786 5 40 HFBB CC[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1cccc(OC)c1)S(C)(=O)=O 220619760 QNYNNBHREULRDY-KRWDZBQOSA-N 407.448 2.787 5 40 HFBB CS(=O)(=O)N(CCCC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 222363113 FJFBLGYTBIGPRT-UHFFFAOYSA-N 422.419 2.688 5 40 HFBB O=C(c1ccc2c(c1)OCCO2)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 408628551 UTCLQEPANQLPLK-UHFFFAOYSA-N 403.822 2.982 5 40 HFBB C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(c3ccc([N+](=O)[O-])c4cccnc34)CC2)C1 12735514 LETWNCVSPADLLO-IRXDYDNUSA-N 411.506 2.770 5 40 HFBB CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)c1ccc(C(N)=O)cc1[N+](=O)[O-] 29531079 ICFMJHVYAJENAA-UHFFFAOYSA-N 410.352 2.622 5 40 HFBB Cc1cc2ncn(-c3ccc(S(=O)(=O)N4CCOCC4)cc3[N+](=O)[O-])c2cc1C 5262143 PMPKULMCWLENJO-UHFFFAOYSA-N 416.459 2.571 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)Nc1ccc(F)c(F)c1)S(C)(=O)=O 220390550 RAPCGDZOBQFYKU-NSHDSACASA-N 413.402 2.975 5 40 HFBB COc1cc(/C=C2/NC(=O)N(C)C2=O)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 409188098 AIPUUVISROLREM-KPKJPENVSA-N 414.330 2.826 5 40 HFBB Cc1ccc(NC(=O)CS[C@H](C)C(=O)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 22061546 SVLFGNFBPUFFQD-KDOFPFPSSA-N 417.487 2.813 5 40 HFBB COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 32151385 ZYUIZDZFYPAAQD-UHFFFAOYSA-N 400.796 2.844 5 40 HFBB CCn1cc([N+](=O)[O-])c(-c2nc(-c3cnn4c(C(F)(F)F)cc(C)nc34)no2)n1 36614778 GDBBHLULFDIRMW-UHFFFAOYSA-N 408.300 2.898 5 40 HFBB CCCC[C@H](CC)CNC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O 223881708 FAVACMYYOSKKNF-AWEZNQCLSA-N 415.512 2.702 5 40 HFBB O=C(Nc1c2c(nn1-c1ccc(F)cc1)C[S@](=O)C2)c1ccccc1[N+](=O)[O-] 2456821 WWNOFPXJUBCKMA-NDEPHWFRSA-N 400.391 2.934 5 40 HFBB O=C(CF)N[C@@H](NC(=S)Nc1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl 4558749 CYUYZLQVFDODHO-VIFPVBQESA-N 403.650 2.663 5 40 HFBB CC1CCN(c2ccc(C(=O)OCC(=O)NCc3ccco3)cc2[N+](=O)[O-])CC1 4835446 POLFMEPHVCEIGS-UHFFFAOYSA-N 401.419 2.897 5 40 HFBB CN1CCN(S(=O)(=O)c2ccc(NCCC3=CCCCC3)c([N+](=O)[O-])c2)CC1 35593278 PNZQOUKBUFFOCC-UHFFFAOYSA-N 408.524 2.833 5 40 HFBB C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCOc2ccccc21 42616021 VMCWJKCFCYKMHD-GOEBONIOSA-N 413.430 2.969 5 40 HFBB O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc([N+](=O)[O-])cc1Br 4577088 VUJHBDWSZIZDJH-UHFFFAOYSA-N 404.176 2.592 5 40 HFBB COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1N1CCCCC1=O 5330203 WFAJJLQCJLZXIX-UHFFFAOYSA-N 405.432 2.921 5 40 HFBB CCc1ccc(N([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)S(C)(=O)=O)cc1 220275219 VLBSECKWTDNCET-CYBMUJFWSA-N 421.475 2.959 5 40 HFBB COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 3411974 WBUDBFFWKWNHJD-LBPRGKRZSA-N 417.418 2.862 5 40 HFBB CN(CCc1ccccc1)C(=O)[C@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 8952488 YYHMTADYAPAZLY-NRFANRHFSA-N 419.437 2.882 5 40 HFBB COc1cc([N+](=O)[O-])cc2sc(NC(=O)c3ccccc3S(C)(=O)=O)nc12 9712651 AWMAMZKXUFRFKR-UHFFFAOYSA-N 407.429 2.869 5 40 HFBB Nn1c(SCc2ccc(Cl)cc2)nnc(Nc2ccc([N+](=O)[O-])cc2)c1=O 28536291 LAXCPSSMKGWURD-UHFFFAOYSA-N 404.839 2.950 5 40 HFBB CCOc1ccc(S(=O)(=O)N(CC(=O)OC)c2cc([N+](=O)[O-])ccc2C)cc1 224600610 YLLTXASCJYGULS-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1ccc([C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])N(C)C)cc1OC 5638112 FCAZPQZPJLFFSQ-QGZVFWFLSA-N 423.491 2.730 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@H](C(=O)O[C@@H](C)C(=O)c2ccccc2)CC1=O 7881647 BBSJUWBSYZBNQA-DZGCQCFKSA-N 412.398 2.771 5 40 HFBB O=C(COC(=O)COc1ccc(Br)cc1)Nc1ccc([N+](=O)[O-])cc1 8009489 BSDBXRJILIBLSX-UHFFFAOYSA-N 409.192 2.918 5 40 HFBB COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)CNc1ccc([N+](=O)[O-])cc1 8386379 VNCQBXVISIGWED-GFCCVEGCSA-N 417.422 2.808 5 40 HFBB O=C(Nc1cc(C2CC2)nn1-c1nc(=O)c2c([nH]1)CCCC2)c1cccc([N+](=O)[O-])c1 12130395 VDHBXCSSDUBGGN-UHFFFAOYSA-N 420.429 2.872 5 40 HFBB COc1ccc(N2C(=O)c3cccc4c(NCCO)c([N+](=O)[O-])cc(c34)C2=O)cc1 95470831 UCIMWYGUHWJUAJ-UHFFFAOYSA-N 407.382 2.961 5 40 HFBB CC(=O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@H]2C(=O)N(c3cccc(Cl)c3)C(=O)[C@H]12 104496983 GGXKNQVEPWEXPE-NVXWUHKLSA-N 412.789 2.571 5 40 HFBB Cc1ccccc1CNC(=O)[C@@H](C)N(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 220383704 OPRKKAHEQSGZMJ-OAHLLOKOSA-N 405.476 2.683 5 40 HFBB O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 541338407 UWAIIUZXFZFUIF-SJLPKXTDSA-N 409.446 2.957 5 40 HFBB O=C(O)[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)cc1 547878603 USXBYGJUVAFPMT-AWEZNQCLSA-N 412.851 2.611 5 40 HFBB Cc1ccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 12421620 WNSAESYGWOVYOB-DLBZAZTESA-N 403.485 2.680 5 40 HFBB C[C@H](OC(=O)C[C@H]1Sc2ccccc2NC1=O)C(=O)Nc1cccc([N+](=O)[O-])c1 3504546 XGUVKDOYLCKIAK-MEDUHNTESA-N 415.427 2.968 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCc1ccc(Cl)cc1)S(C)(=O)=O 10330106 LDEQDYLIYHDAHV-UHFFFAOYSA-N 411.867 2.639 5 40 HFBB C[C@@H]1CCCN(c2nc(N3CCN(Cc4ccccc4)CC3)nc(N)c2[N+](=O)[O-])C1 20393046 GTUAUSUZZXTNQS-MRXNPFEDSA-N 411.510 2.526 5 40 HFBB O=C(CSc1nc2cc([N+](=O)[O-])ccc2o1)NC[C@H]1COc2ccccc2O1 32777394 BAXQPTDKHJAZHM-LBPRGKRZSA-N 401.400 2.784 5 40 HFBB O=C(OCC(=O)N1CCOCC1)c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1 3502106 YLOLSVKYZFBZPX-UHFFFAOYSA-N 402.428 2.762 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(CCO)CC2)cc1NCCOc1ccc(Cl)cc1 19537074 OVHPUJQKOYXOCV-UHFFFAOYSA-N 420.897 2.853 5 40 HFBB CC(C)CNS(=O)(=O)c1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 40080397 DONYXOLMWZDDGU-UHFFFAOYSA-N 403.460 2.732 5 40 HFBB CCOC(=O)CC[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N2CCOCC2)C1 95989288 UNYQACRPYSVLMI-INIZCTEOSA-N 419.478 2.627 5 40 HFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc2[nH]c(O)nc2cc1Br 408527139 FCXKSKPQJGYHPZ-UHFFFAOYSA-N 413.209 2.740 5 40 HFBB CCOc1cc(NCCc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])cc1OCC 9220536 MDPKVQISWRPFMR-UHFFFAOYSA-N 409.464 2.694 5 40 HFBB COc1cc(OC)cc([C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])c2nccn2C)c1 24021508 MOWCKVBVNCAMMB-FQEVSTJZSA-N 410.430 2.794 5 40 HFBB COC(=O)c1cc(C(=O)NCc2ccc(-n3nc(C)cc3C)nc2)cc([N+](=O)[O-])c1 40145595 UERCKLZQILKANE-UHFFFAOYSA-N 409.402 2.509 5 40 HFBB COc1cc(N2C(=O)[C@H]3C(c4ccccc4Cl)=NO[C@H]3C2=O)c(C)cc1[N+](=O)[O-] 103540291 KJLCGKAQKQPAJY-DOTOQJQBSA-N 415.789 2.858 5 40 HFBB Cn1c(COc2ccc([N+](=O)[O-])cc2)nnc1SCC(=O)NC1CCCCC1 887633 VUISJPOFPZLSHM-UHFFFAOYSA-N 405.480 2.843 5 40 HFBB O=C(COC(=O)COc1ccc(Br)cc1)Nc1cccc([N+](=O)[O-])c1 3484124 PNVIQSZSRHUOOD-UHFFFAOYSA-N 409.192 2.918 5 40 HFBB C[C@@H](OC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)C(=O)Nc1ccccc1[N+](=O)[O-] 8760522 JLKPTUHKOONACC-GDBMZVCRSA-N 411.414 2.514 5 40 HFBB Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)OCCOc1ccccc1 13128271 UIABHBFMUHCUMS-UHFFFAOYSA-N 401.404 2.505 5 40 HFBB O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCN(CCc2ccccc2)CC1 32845865 JJTBGDAUSNBDLY-UHFFFAOYSA-N 405.458 2.781 5 40 HFBB COC(=O)c1cc(C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cc([N+](=O)[O-])c1 40080130 QVRKFZYTUZXGNU-INIZCTEOSA-N 413.434 2.677 5 40 HFBB CCOC(=O)C1CCN(c2ncnc(Nc3ccccc3OC)c2[N+](=O)[O-])CC1 40618787 HMWRBNFHOJXPAJ-UHFFFAOYSA-N 401.423 2.917 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(-n2ccc(C(=O)O)n2)cc1 48373959 XXNVEPDXATUOQG-UHFFFAOYSA-N 402.388 2.588 5 40 HFBB COc1ccc(OC)c([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 6052538 LUZZITRFTONOBV-GOSISDBHSA-N 412.402 2.879 5 40 HFBB Cc1cccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1C 7718546 YHYACIYGZHMSTF-MSOLQXFVSA-N 401.444 2.824 5 40 HFBB COc1ccc(C)cc1NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 10336679 KTPKHGLZCNSPRP-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB C[C@@H](OC(=O)c1ccc(NCCO)c([N+](=O)[O-])c1)C(=O)N1CCCc2ccccc21 5895135 LTETVOLGPPBCPZ-CQSZACIVSA-N 413.430 2.524 5 40 HFBB CCOc1ccc(Nc2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])cc1 8056108 WMRHMUGJESZPDT-UHFFFAOYSA-N 407.448 2.758 5 40 HFBB CCC(=O)NC(=S)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 17091017 VWGMMDLKWJKQFU-UHFFFAOYSA-N 417.403 2.978 5 40 HFBB COCC(=O)N1CCC(Nc2c([N+](=O)[O-])cnc3ccc(Br)cc23)CC1 40151391 NRHGDFNWMIDNST-UHFFFAOYSA-N 423.267 2.955 5 40 HFBB COC(=O)[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(C)(C)C 79063828 WSSALQLEVYWZDN-MRXNPFEDSA-N 413.496 2.769 5 40 HFBB O=C(OCc1cccc([N+](=O)[O-])c1)C1CCN(S(=O)(=O)c2cccs2)CC1 2624683 RZWDITDTYDHPCJ-UHFFFAOYSA-N 410.473 2.800 5 40 HFBB CCn1nnc2cc(C(=O)O[C@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)ccc21 5805182 WRUQDPJMCZLFFO-SNVBAGLBSA-N 401.354 2.683 5 40 HFBB Cc1cccc(N2C[C@@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)c1C 7802881 CXMLVLDLXKNKLA-SFHVURJKSA-N 422.485 2.913 5 40 HFBB CC1=C(NC(=O)CSc2[nH]nc(C)c2[N+](=O)[O-])[C@H](C)NN1Cc1ccccc1C 20418464 FZEILRPCUILUFX-LBPRGKRZSA-N 416.507 2.783 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)ccc1-n1cncn1 24042106 ZVMSTKIFPVFVIZ-UHFFFAOYSA-N 414.809 2.588 5 40 HFBB Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)cc1 32238639 LIEMATUOCHRIIZ-LJQANCHMSA-N 409.446 2.583 5 40 HFBB COC(=O)C(=C1/CCCN1C)/C(=C\c1nc2ccc([N+](=O)[O-])cc2s1)C(=O)OC 104265505 COICVVAABJJKEZ-CZGIYDROSA-N 417.443 2.914 5 40 HFBB COc1cccc(NC(=O)[C@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220380203 HGYJZRFWVPEWQI-ZDUSSCGKSA-N 407.448 2.705 5 40 HFBB Cc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] 224790307 SBAYYSBAQIMCIH-UHFFFAOYSA-N 408.432 2.970 5 40 HFBB CCOC(=O)CN(c1ccc(OCC)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225022231 LROJJKGJMLJTBI-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB COc1cccc(/C=C2\SC(=O)N(NC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1O 408753808 KLUDPBLFWARUJD-ZROIWOOFSA-N 415.383 2.690 5 40 HFBB Cc1ccc(NC(=O)COCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 3231094 QWYXSGCCPZBYLG-UHFFFAOYSA-N 402.363 2.714 5 40 HFBB CNS(=O)(=O)c1ccc(N[C@H](c2ccc(F)cc2)c2nccn2C)c([N+](=O)[O-])c1 12559683 FJNXMQLXDWKCJJ-QGZVFWFLSA-N 419.438 2.577 5 40 HFBB COC(=O)c1cc(OC)c(OC)cc1NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 16154487 ZTBPWQJJRZNUDO-UHFFFAOYSA-N 410.404 2.508 5 40 HFBB CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 16691847 NLSLQWVWJLZQAX-UHFFFAOYSA-N 407.448 2.561 5 40 HFBB CCc1c(C(=O)Nc2ccc(N3CCOCC3)cn2)cnn1-c1ccc([N+](=O)[O-])cc1 30728325 NPFVKYSKBQQCCW-UHFFFAOYSA-N 422.445 2.827 5 40 HFBB CCCn1c(=O)[nH]c(=O)c2c(C(=O)Nc3cccc([N+](=O)[O-])c3)cc(C(C)C)nc21 36390909 APINPTIEDRZACX-UHFFFAOYSA-N 411.418 2.779 5 40 HFBB Cc1cccc(C)c1NC(=O)CN1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 39969535 VAYXYHONTNKBTL-UHFFFAOYSA-N 422.489 2.775 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OC[C@H]2CCCO2)[C@@H]1c1ccccc1[N+](=O)[O-] 100101351 GGVUNNUOJDGCBK-AUUYWEPGSA-N 416.430 2.725 5 40 HFBB investigational CC[C@H](C(=O)NCc1ccc(C)cc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222518311 FTDPBVSAZFSZKR-GOSISDBHSA-N 405.476 2.764 5 40 HFBB COCCCn1c2nc3ccccc3nc2c2c(=O)n(C[C@H]3CCCO3)c(C)nc21 2249823 NGRXCAJWAWSPDQ-OAHLLOKOSA-N 407.474 2.818 5 40 HFBB COc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 3563207 ILXJEXAUSWRHOB-LLVKDONJSA-N 400.420 2.698 5 40 HFBB CCOC(=O)Cn1/c(=N/C(=O)COc2ccccc2)sc2cc([N+](=O)[O-])ccc21 100877349 YOAJKHQZMITWOG-VXPUYCOJSA-N 415.427 2.680 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 408685145 OULAJMANMABAGB-RAUXBKROSA-N 417.421 2.959 5 40 HFBB CCOc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4393692 CXVXYZHGNMMEJP-ZWKOTPCHSA-N 417.443 2.606 5 40 HFBB CN1C(=O)[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2cc(Br)ccc21 4554971 WOPIWOWQZLKLDI-KRWDZBQOSA-N 405.204 2.794 5 40 HFBB O=C(O)CN(c1ccc(C(F)(F)F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224756847 PCLVKACMQSHBNB-UHFFFAOYSA-N 404.322 2.894 5 40 HFBB CN1C(=O)C2(Cc3cc([N+](=O)[O-])ccc3N(C)[C@@H]2c2ccccc2)C(=O)N(C)C1=S 8997523 RDIJGBGJCJDHKZ-QGZVFWFLSA-N 424.482 2.530 5 40 HFBB Cn1ccnc1[C@@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 12575521 PHVWSEUZQFCCJJ-INIZCTEOSA-N 421.866 2.831 5 40 HFBB CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 15647311 OEYIIPSJFPFVFB-NYYWCZLTSA-N 424.457 2.542 5 40 HFBB COc1ccc(OC)c(CNc2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])c1 4923681 GSUGDCMACOAQFG-UHFFFAOYSA-N 405.798 2.697 5 40 HFBB Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CCC(c3nncn3C3CC3)CC2)c1C 95461624 JPJPHQWTLZVROQ-UHFFFAOYSA-N 405.480 2.706 5 40 HFBB Cc1cccc(CN2C(=O)N/C(=C\c3cc([N+](=O)[O-])ccc3N3CCOCC3)C2=O)c1 409243478 WQMCCHPJPAIGPZ-UYRXBGFRSA-N 422.441 2.833 5 40 HFBB CC1=C(C(N)=O)[C@@H](c2cccc([N+](=O)[O-])c2)N2NC(c3ccccc3Cl)=NC2=N1 940681 QAKWKRDJZDSCMU-MRXNPFEDSA-N 410.821 2.685 5 40 HFBB CN1C(=O)C(=C2C[C@@H](c3c4ccccc4cc4ccccc34)NN2)C(=O)N(C)C1=O 5423571 VKYJCWSLJHRWKF-KRWDZBQOSA-N 400.438 2.837 5 40 HFBB Cc1ccc(C(=O)NCC(=O)NCc2c(C)nn(-c3ccccc3)c2C)cc1[N+](=O)[O-] 10229385 PEZAHCUMTJMNTQ-UHFFFAOYSA-N 421.457 2.752 5 40 HFBB C[C@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10411985 RYWQUIGZYVYWBO-QFYYESIMSA-N 418.789 2.900 5 40 HFBB COC(=O)CCSc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] 15210503 LFXKRVLUHNQHGB-UHFFFAOYSA-N 402.494 2.815 5 40 HFBB COc1nn(Cc2nc3c4sc5nc(C)cc(C)c5c4ncn3n2)cc1[N+](=O)[O-] 17088441 UAXSJWNHNOARSZ-UHFFFAOYSA-N 410.419 2.666 5 40 HFBB CC1CCN(S(=O)(=O)c2ccc(NC[C@H](C)Cn3cccn3)c([N+](=O)[O-])c2)CC1 32935545 SIAQRGCRIVFQBG-INIZCTEOSA-N 421.523 2.960 5 40 HFBB C[C@@H](OC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1 21128949 STTQBJGMBDPSMP-GFCCVEGCSA-N 419.821 2.939 5 40 HFBB CC(=O)C1=NN(c2cccc(Cl)c2)[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]12 100942619 FQULRKZWCCGDQF-RDJZCZTQSA-N 412.789 2.571 5 40 HFBB CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 6212262 VVKITVWATCQQQJ-UHFFFAOYSA-N 413.430 2.804 5 40 HFBB CC(C)NS(=O)(=O)c1ccc(NCCc2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 7984486 WHTJHWDZXSZZMD-UHFFFAOYSA-N 421.475 2.707 5 40 HFBB Cc1ccsc1CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 8917340 XAMHCTINARWLOG-CQSZACIVSA-N 424.500 2.559 5 40 HFBB CCNC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 24625180 PTEVYWQOQSLNRA-UHFFFAOYSA-N 412.446 2.962 5 40 HFBB CC(C)N(C(=O)CN1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O)C(C)C 409201466 NHDAEQANWOOGFV-NVNXTCNLSA-N 407.448 2.982 5 40 HFBB Cc1nn(CC(=O)OCC(=O)NC(c2ccccc2)c2ccccc2)c(C)c1[N+](=O)[O-] 2662059 VBUUPIXLZLFWDT-UHFFFAOYSA-N 422.441 2.857 5 40 HFBB COc1cc(/C=C2/N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc(OC)c1OC(C)=O 5283679 JIRIIPWRKRMFON-OVCLIPMQSA-N 412.354 2.882 5 40 HFBB CCN(Cc1cccc(F)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 8705752 TXYFIEGIZNZVKZ-UHFFFAOYSA-N 423.466 2.781 5 40 HFBB COC(=O)C(C(=O)OC)[C@H](c1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)[N+](=O)[O-] 1722458 BGUMLHXQINGZKB-RDJZCZTQSA-N 402.359 2.659 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(NC[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 5693964 ORHCLFQJXKDVGL-CQSZACIVSA-N 421.475 2.877 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(CC(=O)Nc4ccc([N+](=O)[O-])cc4)cnc32)c(C)c1 15391362 YABJVJUJJHUSFR-UHFFFAOYSA-N 418.413 2.746 5 40 HFBB CCOc1ccc(C(=O)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 20410777 OGUJKMGIKKOPEV-UHFFFAOYSA-N 416.390 2.991 5 40 HFBB Cc1ccc(CN(C)C(=O)CN(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 44899797 KWHSPQFDGWZZOW-UHFFFAOYSA-N 405.476 2.636 5 40 HFBB CN(Cc1ccccc1)C(=O)[C@@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 199425437 VUWIPJUQAMYPEY-HXUWFJFHSA-N 405.410 2.839 5 40 HFBB COc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(=O)O[C@H](C)C(=O)c2ccccc2)CC1=O 7881650 BBSJUWBSYZBNQA-HIFRSBDPSA-N 412.398 2.771 5 40 HFBB O=C(NC(=S)Nc1ccccc1F)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17082825 OIGSKZPWHROIFD-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB C[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1S(=O)(=O)Cc1ccccc1 17092152 RNIBJLDMNUFDGN-AWEZNQCLSA-N 420.447 2.544 5 40 HFBB C[C@H]1CCCN(c2nc(N3CCN(Cc4ccccc4)CC3)nc(N)c2[N+](=O)[O-])C1 20393050 GTUAUSUZZXTNQS-INIZCTEOSA-N 411.510 2.526 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1C 224661136 XHMORTDGCMTFAZ-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 10542630 CNWKIIKRZVBQAK-UHFFFAOYSA-N 409.851 2.701 5 40 HFBB O=C(NC(=S)Nc1ccc(CN2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 20267782 VPSPIGPJZMEBAB-UHFFFAOYSA-N 400.460 2.554 5 40 HFBB O=C(O)c1c([N+](=O)[O-])cc([N+](=O)[O-])c(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1[N+](=O)[O-] 104261763 DYLMBVDUFDHKHA-UHFFFAOYSA-N 423.206 2.593 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3ccc(OC)cc3)CC2)c([N+](=O)[O-])c1 408572510 IYDUDVAPKXUBAH-UHFFFAOYSA-N 413.430 2.743 5 40 HFBB CCc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 4393632 BOQZMORDPYBFTJ-QZTJIDSGSA-N 401.444 2.769 5 40 HFBB O=C(C[C@@]1(O)C(=O)N(CN2CCCCC2)c2ccccc21)c1cccc([N+](=O)[O-])c1 4784444 SUBZYTKBROJBEU-QFIPXVFZSA-N 409.442 2.845 5 40 HFBB COc1cc(C=O)ccc1Oc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-] 6170159 LMXHYCCIMAROQU-UHFFFAOYSA-N 406.416 2.993 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCC(=O)Nc2ccc(F)cc2)c1 408663400 SESBQBFOPHJWBH-UHFFFAOYSA-N 419.365 2.643 5 40 HFBB CC(C)(C)n1nc2c(c1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CS(=O)(=O)C2 3008418 OOXHIXCROWAHPW-UHFFFAOYSA-N 412.855 2.880 5 40 HFBB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1[N+](=O)[O-] 5710747 ZJTSKXDJYOZXCY-UHFFFAOYSA-N 403.822 2.754 5 40 HFBB CN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 9694898 UZYSOCWLPSHIJB-UHFFFAOYSA-N 412.855 2.743 5 40 HFBB O=C(OCc1ccc([N+](=O)[O-])cc1)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 11244757 VNWMUYKNVMMUHU-UHFFFAOYSA-N 422.434 2.878 5 40 HFBB O=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 12745338 GRXARUUFXRLPIM-UHFFFAOYSA-N 415.471 2.840 5 40 HFBB CCc1nc(S/C(=C\c2cc(Br)cc([N+](=O)[O-])c2O)C(=O)O)n[nH]1 408631233 GQJJADJYRAJPQH-WTKPLQERSA-N 415.225 2.961 5 40 HFBB O=C1N[C@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4263336 KCHCKPCXEDFKQB-JJRVBVJISA-N 409.320 2.699 5 40 HFBB C[C@@H](OC(=O)CNC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5781288 IOCDAHJXKKGJBH-LLVKDONJSA-N 405.794 2.548 5 40 HFBB O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1[N+](=O)[O-] 12771091 NTBZOBRPDDXPLW-UHFFFAOYSA-N 403.460 2.699 5 40 HFBB O=C(Nc1ccc([N+](=O)[O-])cc1N1CCOCC1)c1cncc(Br)c1 20611809 VKHXXGQPJFRSTA-UHFFFAOYSA-N 407.224 2.841 5 40 HFBB CCN(c1cc(OC)c(OC)cc1C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 22252101 OPSPHFVFCNQSNM-UHFFFAOYSA-N 423.447 2.650 5 40 HFBB C[C@@H](C(=O)NCCSc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220404276 AXFQEHDCMOZLQN-AWEZNQCLSA-N 423.516 2.658 5 40 HFBB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])C1=O 409015176 ARUPSQLJYQGLDJ-DUJAKZANSA-N 410.404 2.600 5 40 HFBB Nc1nc(SCc2cccc([N+](=O)[O-])c2)[nH]c(=O)c1NC(=O)c1ccc(F)cc1 9518072 ZCWUKGJVQZKQBN-UHFFFAOYSA-N 415.406 2.944 5 40 HFBB NC(=O)COc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 12728150 WEMKOYVKGRPWLD-UHFFFAOYSA-N 401.422 2.658 5 40 HFBB Cc1sc2nc3c4ccccc4c(NCCN4CCOCC4)nn3c(=O)c2c1C 21540064 JERGGDHAQHBACB-UHFFFAOYSA-N 409.515 2.818 5 40 HFBB Cc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c(C)c1 22348292 LSIFPJGYLVUKPM-HNNXBMFYSA-N 405.476 2.855 5 40 HFBB O=[N+]([O-])c1ccc(-c2ncn(CN3CCN(Cc4ccc5c(c4)CCO5)CC3)n2)cc1 29500586 YKVONTOJYXRPHE-UHFFFAOYSA-N 420.473 2.564 5 40 HFBB C[C@@H]1CCC[C@@H](C(=O)NS(=O)(=O)c2cc([N+](=O)[O-])c(N)cc2Br)C1 72310844 DJCOUONVKQPQFP-RKDXNWHRSA-N 420.285 2.571 5 40 HFBB COC(=O)[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])C(C)(C)C 79063836 WSSALQLEVYWZDN-INIZCTEOSA-N 413.496 2.769 5 40 HFBB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](c1c(C)nn(C)c1C)C(F)(F)F 95408815 RAKCUBOVBDCEGH-CQSZACIVSA-N 406.386 2.835 5 40 HFBB CCOCCCn1c(=N)c(C(=O)NC2CCCC2)cc2c(=O)n3cc(C)ccc3nc21 100628084 FTURSBFTFULHBO-UHFFFAOYSA-N 423.517 2.536 5 40 HFBB CC(C)OP(=O)(OC(C)C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(N)=O 1828092 ZSUUSHAIDMEULO-OAHLLOKOSA-N 421.774 2.833 5 40 HFBB Cc1ccc(NC(=O)N2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)c(C)c1 40095444 XJLKUVWVCPTAPN-UHFFFAOYSA-N 418.475 2.750 5 40 HFBB O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@H]2C(=O)N1c1ccccc1C(F)(F)F 103582663 MDEYYKNAFIBUDY-UKRRQHHQSA-N 405.288 2.906 5 40 HFBB COc1cc2c(cc1OC)CN(S(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C)CC2 15327261 RVILKKIBWBZQPQ-UHFFFAOYSA-N 406.460 2.976 5 40 HFBB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)C1=O 107966842 PHYZFWWJPMBQPR-NTUHNPAUSA-N 405.750 2.574 5 40 HFBB Cc1cc([N+](=O)[O-])nn1CCCC(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 2601674 OFMVFPYIPLXWTQ-JTQLQIEISA-N 405.480 2.804 5 40 HFBB C[C@H](NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(F)cc1 220421157 CPXMHIXHFPNSEM-STQMWFEESA-N 409.439 2.766 5 40 HFBB CC(=O)N1CCC(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 10736269 FKCKJJWASVWSFV-UHFFFAOYSA-N 402.373 2.543 5 40 HFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1 20484857 SOKGAMOEGUOBNU-UHFFFAOYSA-N 412.427 2.972 5 40 HFBB CCNC(=O)C1(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)CCCCC1 40135462 NBSPWGOFXNJYSZ-UHFFFAOYSA-N 403.888 2.674 5 40 HFBB Cn1c(SCC(=O)Nc2cccc(C(=O)O)c2)nnc1-c1cccc([N+](=O)[O-])c1 409128011 KLSYKKUIAYVGHG-UHFFFAOYSA-N 413.415 2.819 5 40 HFBB CSc1ccc(S(=O)(=O)CC(=O)Nc2cccc(NC(C)=O)c2)c([N+](=O)[O-])c1 2685304 JIQOVRNKTFTQQP-UHFFFAOYSA-N 423.472 2.688 5 40 HFBB NC(=O)COc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 12523166 JPLOCDOLHMDFOR-UHFFFAOYSA-N 401.422 2.658 5 40 HFBB CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)c1 36396997 DUZXMHPNTQSLSO-UHFFFAOYSA-N 417.447 2.800 5 40 HFBB O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)s3)CC2)c1 48333986 HYHLPXFDZMKDBL-UHFFFAOYSA-N 401.897 2.816 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(c1ccccc1F)S(C)(=O)=O 220306059 WZJIXPQELFUJLU-LLVKDONJSA-N 411.411 2.536 5 40 HFBB CS(=O)(=O)c1cccc(-c2nnc(NC(=O)/C=C/c3cccc([N+](=O)[O-])c3)o2)c1 9707630 WCJXMZGAMQLIMS-CMDGGOBGSA-N 414.399 2.700 5 40 HFBB CCCCn1c(COc2cccc([N+](=O)[O-])c2)nc2cc(S(N)(=O)=O)ccc21 12581667 UZQBTJFEHCXAIZ-UHFFFAOYSA-N 404.448 2.971 5 40 HFBB O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H](c1ccccc1Cl)N1CCOCC1 29805070 HCFWORHUXRLLOT-LJQANCHMSA-N 403.866 2.980 5 40 HFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCN1C(=O)S/C(=C/c2cccnc2)C1=O 96544301 SFANWPUQNDZBNG-FIVAMUJUSA-N 424.438 2.856 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1ccc(OC)cc1 224865681 DJTVMJSPEUJLKY-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 17082333 ZVRRWUFBZVDKKL-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 102949568 JRPSUKYENLATSN-MBZVMHRFSA-N 419.393 2.864 5 40 HFBB CCc1nc(S/C(=C\c2cc([N+](=O)[O-])cc(Br)c2O)C(=O)O)n[nH]1 408631163 FOGMOEYYLXXWFJ-WTKPLQERSA-N 415.225 2.961 5 40 HFBB CS(=O)(=O)c1ccc(SCC(=O)OCC(F)(F)C(F)F)c([N+](=O)[O-])c1 2684868 XAALQDFHACZPTR-UHFFFAOYSA-N 405.347 2.534 5 40 HFBB O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])Nc1ccccc1C(=O)NC1CC1 3485354 PYZUSIPLHIWEGL-UHFFFAOYSA-N 417.805 2.936 5 40 HFBB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)c(OC)c1 6052639 YIKZEOLZCHGFDY-SFHVURJKSA-N 412.402 2.879 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)OCc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] 7253951 ZUHHVFZCSIHKPT-UHFFFAOYSA-N 401.400 2.541 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)[C@@H](C(=O)N1CCCCC1)n1cc(Cl)ccc1=O 12467413 NZHVCMRHUXWWGW-KRWDZBQOSA-N 403.822 2.846 5 40 HFBB O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCN(C(=O)c2cccs2)CC1 30787100 HHXJEUYMWIJTIP-UHFFFAOYSA-N 414.487 2.855 5 40 HFBB COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C)(C)c1ccc2c(c1)OCCO2 58289439 VIBAWVYHUXCHTK-UHFFFAOYSA-N 408.432 2.588 5 40 HFBB O=C1[C@H]2C(c3ccc([N+](=O)[O-])cc3)=NO[C@H]2C(=O)N1c1ccccc1C(F)(F)F 103582657 MDEYYKNAFIBUDY-DZGCQCFKSA-N 405.288 2.906 5 40 HFBB Cc1ccc(-n2nc3c(c2NC(=O)c2ccc([N+](=O)[O-])cc2)CS(=O)(=O)C3)cc1 3008544 FUKKFDQSVCUTDW-UHFFFAOYSA-N 412.427 2.770 5 40 HFBB COc1ccc(OCC(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 3530318 JINDGUNHUXKTSE-LBPRGKRZSA-N 404.375 2.561 5 40 HFBB CCOCCCNS(=O)(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 4834631 UVZSXNQIDMJCLI-UHFFFAOYSA-N 407.448 2.552 5 40 HFBB Cc1ccc(C(=O)[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2)N2C(=O)CCC2=O)cc1 7881745 LUGGQCTXBWNAGK-AWEZNQCLSA-N 409.398 2.681 5 40 HFBB COc1ccccc1N1CCN(c2c([N+](=O)[O-])cc(C(=O)O)cc2[N+](=O)[O-])CC1 8443517 WLGWGOUWOMGWIA-UHFFFAOYSA-N 402.363 2.536 5 40 HFBB CN1CCN(CCCNC(=O)/C(=C/c2cccc([N+](=O)[O-])c2)c2ccccc2)CC1 13668824 OHSNESOGNLOSMR-RELWKKBWSA-N 408.502 2.889 5 40 HFBB CCCS(=O)(=O)c1ncc(Cl)c(-c2nnc(-c3ccccc3[N+](=O)[O-])o2)n1 28289432 QGFRVEUSMYAHRV-UHFFFAOYSA-N 409.811 2.939 5 40 HFBB Cc1cc[n+](C2=NC(=O)S/C2=C/NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 38191547 AOUHNYZWTCGOFB-UHFFFAOYSA-O 401.384 2.670 5 40 HFBB COC(=O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113886206 RQBIABNSTHAQOG-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB CCOc1cc(/C=C2/SC(=O)N(CC(=O)OC(C)C)C2=O)cc([N+](=O)[O-])c1O 205731203 NFLLVGYPGCXWQE-NTUHNPAUSA-N 410.404 2.687 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)cc1 220035840 JZCYQKXZBYYQJX-OAHLLOKOSA-N 405.476 2.855 5 40 HFBB COc1ccccc1[C@H](C)NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 260816699 ZNNJNJLWFGYHNA-KBPBESRZSA-N 421.475 2.635 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1cccc(Cl)c1 408669824 OXSNDYPHQHVZLV-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB Cn1ccnc1[C@H](Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 12575526 PHVWSEUZQFCCJJ-MRXNPFEDSA-N 421.866 2.831 5 40 HFBB COC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224782219 KYUGOZMKIYFYCK-UHFFFAOYSA-N 400.359 2.550 5 40 HFBB CC(C)[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCc1ccccn1 6831921 JWCSFGNSEPMRMQ-QGZVFWFLSA-N 404.854 2.757 5 40 HFBB C[C@H]1CCCN(S(=O)(=O)c2ccc(-n3nnc4ccccc43)c([N+](=O)[O-])c2)C1 8079473 BAMLOPJCEBPLTR-ZDUSSCGKSA-N 401.448 2.749 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H](C)c2ccc(-n3cncn3)cc2)c1C 15334260 AQGWOGBOZFIYQL-CQSZACIVSA-N 401.448 2.832 5 40 HFBB C[C@H]1CCCN(S(=O)(=O)c2ccc(NC[C@H](C)Cn3cccn3)c([N+](=O)[O-])c2)C1 105628666 PHSLMBGROQDEAL-HOTGVXAUSA-N 421.523 2.960 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1C 408701521 ZEEFXNUCKADOHC-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB O=C(CN1C(=O)S/C(=C\c2ccc([N+](=O)[O-])o2)C1=O)N1CCc2ccccc2C1 409370026 JPTQBQFMBHJZLS-DHDCSXOGSA-N 413.411 2.809 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(N2CCCCS2(=O)=O)c1 5099852 GFGJKRDRTLOJOS-UHFFFAOYSA-N 405.432 2.786 5 40 HFBB CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)Oc2cccc([N+](=O)[O-])c2)cc1 6061420 AFWCGFJGHXIECS-ZDUSSCGKSA-N 407.448 2.688 5 40 HFBB Cc1ccc(C)c(NC(=O)CN(C)C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 13010980 ANPDRNUJUDYZED-UHFFFAOYSA-N 408.418 2.503 5 40 HFBB Cc1c(N(CC(=O)NCCCc2ccc(F)cc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220033150 YJONRTKJYXEVDW-UHFFFAOYSA-N 423.466 2.557 5 40 HFBB COc1ccc(NC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 222684654 GHWVDEJGNCVBFN-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CCCC(=O)NC2CCCCC2)c1 7939890 GDHJKRFOTFDMFR-UHFFFAOYSA-N 421.450 2.704 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(Cc2ncoc2C(C)C)CC1 95458181 ZNQCCNDHAKMSSE-UHFFFAOYSA-N 408.480 2.521 5 40 HFBB O=C(O)CN(c1ccccc1Br)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225024770 GCRYYCODEQQPRS-UHFFFAOYSA-N 415.221 2.637 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N(Cc1ccc([N+](=O)[O-])cc1)N1C(=O)CCCC1=O 408683755 LZQWQRYDBDGRBT-UHFFFAOYSA-N 412.358 2.600 5 40 HFBB Cc1ccc(NC(=O)Cn2nnc(-c3ccc([N+](=O)[O-])cc3)n2)c(Br)c1 869943 KKHCZNMFTMJGJS-UHFFFAOYSA-N 417.223 2.958 5 40 HFBB CC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 5557522 CFLGCXYDGLMNCD-LLVKDONJSA-N 403.888 2.564 5 40 HFBB O=[N+]([O-])c1ccc(NCc2ccccc2Cl)c(S(=O)(=O)N2CCOCC2)c1 6923229 PKWSXKOEZARBCH-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB CCCC(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1 107678672 WIQCFNUZRMIEKY-UHFFFAOYSA-N 419.551 2.908 5 40 HFBB O=C1C[C@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 3193754 IKZBGIQAPPMHCZ-HFTRVMKXSA-N 408.332 2.948 5 40 HFBB O=C1N[C@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4263337 KCHCKPCXEDFKQB-CKEIUWERSA-N 409.320 2.699 5 40 HFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCN(c3ccccc3OC)CC2)c([N+](=O)[O-])c1 8443520 VPYASOQXUJAKPA-UHFFFAOYSA-N 416.390 2.625 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@@H](c2cccc(F)c2)n2nnnc2N3)cc1 10296245 MADLLPATANQMHU-MRXNPFEDSA-N 406.337 2.578 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1cccc([N+](=O)[O-])c1 17087641 ZZORUYFIKZZGIK-HNNXBMFYSA-N 407.382 2.694 5 40 HFBB CC(=O)c1cccc(NC(=O)[C@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220389311 GUAWIYSBSVOUNO-ZDUSSCGKSA-N 419.459 2.899 5 40 HFBB CCc1nc(S/C(=C\c2cc(Br)c(O)c([N+](=O)[O-])c2)C(=O)O)n[nH]1 408631946 NMSZWPLIBXIOJQ-UITAMQMPSA-N 415.225 2.961 5 40 HFBB O=C(CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])ccc2Cl)C1=O)Nc1ccccc1F 409215524 ALNVMTYPMMVGIS-OVCLIPMQSA-N 418.768 2.919 5 40 HFBB O=C(Nc1ccn(Cc2ccccc2)n1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 69894656 NTFYJQCALONZOY-UHFFFAOYSA-N 407.434 2.589 5 40 HFBB O=c1ccn(Cc2cccc(Br)c2)c(=O)n1Cc1ccc([N+](=O)[O-])cc1 95448416 DVPQJRKVKDLCII-UHFFFAOYSA-N 416.231 2.777 5 40 HFBB CC(=O)c1cccc(NC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)c1 220030128 VYGXIVZNHTYLTI-UHFFFAOYSA-N 405.432 2.511 5 40 HFBB COc1ccccc1[C@@H](C)NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 225453169 SZKNTDZTVYASPS-CQSZACIVSA-N 421.475 2.555 5 40 HFBB CCOc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 4393693 CXVXYZHGNMMEJP-ROUUACIJSA-N 417.443 2.606 5 40 HFBB COc1ccc(OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])c1 5050767 WZQLNBZDEKPXDK-UHFFFAOYSA-N 403.435 2.777 5 40 HFBB CCCCn1c(CNC(=O)c2ccc([N+](=O)[O-])cc2)nnc1SCC(=O)OCC 9427670 LLEQZLHLDOMXOY-UHFFFAOYSA-N 421.479 2.572 5 40 HFBB CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 32873590 OODMDBKFABBHAY-UHFFFAOYSA-N 409.851 2.701 5 40 HFBB COc1ccc(NC(=O)COC(=O)CCCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 8417309 KMMKOYZCWBRAAS-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB CC(C)Cn1nnc(NC(=S)NC(=O)c2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 17090265 IMGDZPFCXJRIAW-UHFFFAOYSA-N 415.435 2.624 5 40 HFBB Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 24776417 AJRMJJKVVCRLGH-SNVBAGLBSA-N 413.839 2.610 5 40 HFBB CN(C)CCNC(=O)c1cccc(CNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 58305048 DMCSMSDMJUCBFM-UHFFFAOYSA-N 419.869 2.861 5 40 HFBB CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 67286289 DXUIZLXWTAXJHR-GOSISDBHSA-N 402.451 2.642 5 40 HFBB Nn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 4288106 JGHPJXMSSVGANV-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB COc1ccc(CN(C)CC(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC)c1OC 13073286 JIJYLSWSJOTEMI-UHFFFAOYSA-N 403.435 3.000 5 40 HFBB O=C(c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)N1CCN(c2ccccc2F)CC1 33746498 KJWVCACTUBUEHF-UHFFFAOYSA-N 414.437 2.533 5 40 HFBB Cc1cccn2c(=O)c3cc(C(=O)NCc4ccccc4Cl)c(=N)n(C)c3nc12 101158768 DQROYSHZLGDNFW-UHFFFAOYSA-N 407.861 2.557 5 40 HFBB Cc1ccc(NC(=O)CS[C@@H](C)C(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 22061543 SVLFGNFBPUFFQD-KBXCAEBGSA-N 417.487 2.813 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N[C@@H]1CCN(C2CC2)C1 48345068 FPUDHOJMTCQBRF-OAHLLOKOSA-N 408.524 2.808 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@H]3CS(=O)(=O)C[C@H]32)c1 4393681 ZFCSVHCGHLXAAN-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB COC(=O)c1ccc(NC(=O)c2cccn(Cc3cccc([N+](=O)[O-])c3)c2=O)cc1 5270724 WGYYRUKDFRQGEU-UHFFFAOYSA-N 407.382 2.844 5 40 HFBB Cc1cccc(C)c1NC(=O)COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 8038712 FRWSJJSMDBSTOK-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1ccccc1OCCN(C)C(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1 12527335 IKULMKZYXJAJMP-UHFFFAOYSA-N 412.490 2.806 5 40 HFBB O=C(O)c1ccc(CN2C[C@H](O)C[C@H]2c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 15675069 OVVJYEMUKWNENC-SJORKVTESA-N 410.386 2.651 5 40 HFBB biogenic,in-vitro Cc1ccnc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)c1 40149823 OZCDVMVSAIPPST-UHFFFAOYSA-N 418.475 2.646 5 40 HFBB COc1ccc(NC(=O)[C@@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 220380308 JRWNSRPSBMKHOO-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB COCCCNc1nc(N)c([N+](=O)[O-])c(N2CCC(Cc3ccccc3)CC2)n1 5218283 KLCMHLNZKDICRY-UHFFFAOYSA-N 400.483 2.875 5 40 HFBB CCOc1ccc(N2C[C@@H](C(=O)OCC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 7881408 GAKFNCUFDQGUIW-HNNXBMFYSA-N 412.398 2.773 5 40 HFBB O=C(Oc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 33856450 FARNEWLNUWEGII-XCVCLJGOSA-N 424.325 2.682 5 40 HFBB CC(C)Oc1ccc(NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 408604865 IRNZTXXSNUNJEA-UHFFFAOYSA-N 407.448 2.787 5 40 HFBB CC(C)(C)n1nc2c(c1NC(=O)c1cc([N+](=O)[O-])ccc1Cl)CS(=O)(=O)C2 3008414 RWRRWICJOOQGCR-UHFFFAOYSA-N 412.855 2.880 5 40 HFBB CCNc1ccc(C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 5947826 LAQZDTWNMIVBCT-UHFFFAOYSA-N 406.326 2.869 5 40 HFBB O=C(NC1CCCC1)C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 6788432 XYJGMTLLHOROKB-UHFFFAOYSA-N 415.899 2.708 5 40 HFBB CCOC(=O)c1c(NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])oc(C)c1C(C)=O 9506783 OAGNVTGGPGWQAN-UHFFFAOYSA-N 418.358 2.671 5 40 HFBB COc1ccccc1-n1c(S[C@@H](C)C(=O)NC(N)=O)nc2cc([N+](=O)[O-])ccc21 9662676 HBPMUTVPMWMCMZ-JTQLQIEISA-N 415.431 2.618 5 40 HFBB CCC(=O)N1CCc2cc(S(=O)(=O)Nc3cc([N+](=O)[O-])ccc3OC)ccc21 223975341 DGHQVOWWLVCXGD-UHFFFAOYSA-N 405.432 2.703 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)Nc1cccc([N+](=O)[O-])c1 408653217 DOCPVPJNYXEJSH-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB COc1cc(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc32)c([N+](=O)[O-])cc1OC 3544892 ANFBNTNQKQZPSP-LBPRGKRZSA-N 400.387 2.747 5 40 HFBB C[C@@H](Nc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 8190635 SSIMKTUJZWDHSS-CQSZACIVSA-N 418.475 2.818 5 40 HFBB COc1ccccc1NC(=O)COC(=O)CCCC(=O)Nc1ccc([N+](=O)[O-])cc1 8413043 MVFUYUALMOTDSR-UHFFFAOYSA-N 415.402 2.894 5 40 HFBB Cc1ccc([C@@H]2c3c(-c4cccc([N+](=O)[O-])c4)nnc(O)c3Nc3nnnn32)cc1 10296452 UDZZKCOTHLFAPP-QGZVFWFLSA-N 402.374 2.747 5 40 HFBB O=C(O)c1ccc(Cl)c(NC(=S)NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 17094117 RHGXSCSXCFPGGG-UHFFFAOYSA-N 424.778 2.981 5 40 HFBB C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCOc2ccccc21 42616030 VMCWJKCFCYKMHD-ZBFHGGJFSA-N 413.430 2.969 5 40 HFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@]2(CCCC[C@@H]2NCc2cccnc2)C1 306133261 MGUIUDHIGPYTFL-RBBKRZOGSA-N 410.474 2.933 5 40 HFBB CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccc([N+](=O)[O-])cc1 7343697 LVWSNYAMJUCWSN-OAHLLOKOSA-N 407.382 2.694 5 40 HFBB Cc1ccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 12421618 WNSAESYGWOVYOB-IRXDYDNUSA-N 403.485 2.680 5 40 HFBB CN(CC(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 13005795 IEYZBMWDBIBKCE-UHFFFAOYSA-N 414.809 2.540 5 40 HFBB O=C(CNS(=O)(=O)c1cc(Cl)ccc1Cl)OCc1ccc([N+](=O)[O-])cc1 16401647 FQXTXAGTNWGSIB-UHFFFAOYSA-N 419.242 2.923 5 40 HFBB Cc1cccc(CCCNC(=O)CN(c2cccc([N+](=O)[O-])c2C)S(C)(=O)=O)c1 220033873 YQMKSRUREUNWSV-UHFFFAOYSA-N 419.503 2.727 5 40 HFBB C[C@@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 3302825 WQBNDGJCLICCGD-LLVKDONJSA-N 414.399 2.536 5 40 HFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 7068120 LZFPEJHPIKSNGT-ZDUSSCGKSA-N 409.439 2.574 5 40 HFBB Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1C[C@@H]1COc2ccccc2O1 25254710 FZRYUWVBTSPSSV-QGZVFWFLSA-N 423.425 2.898 5 40 HFBB CCS(=O)(=O)C(Br)(Br)[C@@H](O)c1cccc([N+](=O)[O-])c1 96520890 WOEAICCVSBURES-VIFPVBQESA-N 417.075 2.507 5 40 HFBB COc1ccc([N+](=O)[O-])cc1/C=C1/SC(=O)N(CC(=O)N2CCCCC2)C1=O 205911340 ZHEOGHPNVONQIH-XNTDXEJSSA-N 405.432 2.652 5 40 HFBB O=C(NN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O)c1ccccc1[N+](=O)[O-] 3044900 UAOPSQHQLMIKSE-UHFFFAOYSA-N 406.310 2.597 5 40 HFBB CN(C)c1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1[N+](=O)[O-] 12527742 ZGEDVCSKKGGAJN-KRWDZBQOSA-N 404.492 2.526 5 40 HFBB O=C1N/C(=C\c2cc([N+](=O)[O-])ccc2N2CCOCC2)C(=O)N1Cc1ccccc1 409196971 YMWVTNCXCVHQGV-AQTBWJFISA-N 408.414 2.524 5 40 HFBB CCOc1ccc(OCCNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2C)cc1 8154503 QXRLSNRRBBTNCT-UHFFFAOYSA-N 402.403 2.654 5 40 HFBB COc1cccc(-n2ccc3nc4ccn(CCCN(C)C)c(=O)c4cc3c2=O)c1 38829033 FZELXOOYFIHJHQ-UHFFFAOYSA-N 404.470 2.661 5 40 HFBB CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2ccc(-n3cncn3)nc2)CC1 48290227 DTCVMVFDDXIKKK-UHFFFAOYSA-N 421.461 2.737 5 40 HFBB NC(=O)COc1ccccc1/C=C1/SC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O 205702610 BIXOCIPOWWGLLL-CXUHLZMHSA-N 413.411 2.695 5 40 HFBB CCOC(=O)C1=C(c2ccc([N+](=O)[O-])cc2)Nc2ncnn2[C@@H]1c1cccc(O)c1 7987500 AEGOYKBFRRBTII-GOSISDBHSA-N 407.386 2.881 5 40 HFBB CC(=O)c1cccc(NC(=O)[C@@H](C)N(c2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220389240 GUAWIYSBSVOUNO-CYBMUJFWSA-N 419.459 2.899 5 40 HFBB CC(=O)[C@@H](C[C@](C(C)=O)(C(=O)OC(C)C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)C 227144384 IWLSTPVDTVMQDS-WIYYLYMNSA-N 421.446 2.920 5 40 HFBB O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1ccccc1Br 3228171 WETBGIKIPUDPML-UHFFFAOYSA-N 404.176 2.592 5 40 HFBB Cc1c(CS(=O)(=O)[C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] 48252008 HLTQUPKRUUOXIG-ZDUSSCGKSA-N 420.443 2.616 5 40 HFBB COc1ccc(NC(=O)CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 58161249 YOSKNAWAMHDMAM-UHFFFAOYSA-N 406.826 2.766 5 40 HFBB O=C(Nc1ccc(F)c(F)c1)c1cccn(OCc2cccc([N+](=O)[O-])c2)c1=O 5054889 ZLLVMQMFMVWSBE-UHFFFAOYSA-N 401.325 2.916 5 40 HFBB CC[C@@H](C(=O)N(C)Cc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222512880 QCIAHUHSYFSUTI-SFHVURJKSA-N 405.476 2.798 5 40 HFBB Cc1cc(C(=O)COC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(C)n1C[C@@H]1CCCO1 5687546 VNDASWPZFVONGF-HNNXBMFYSA-N 401.419 2.814 5 40 HFBB Cc1ccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 12421619 WNSAESYGWOVYOB-IAGOWNOFSA-N 403.485 2.680 5 40 HFBB Cn1c2ccccc2c(=O)c2c(=O)n(Cc3ccco3)c(CN3CCCCC3)nc21 49640930 JSHKNHPVOJMBLU-UHFFFAOYSA-N 404.470 2.876 5 40 HFBB Cc1ccc(NS(=O)(=O)c2ccc(NCCc3nc[nH]n3)c([N+](=O)[O-])c2)c(C)c1 84133523 YXKURQHXJFCVTE-UHFFFAOYSA-N 416.463 2.785 5 40 HFBB N=c1c(C(=O)NC2CCCC2)cc2c(=O)n3ccccc3nc2n1Cc1ccccc1 100861111 XMGFOLDYCLKCBD-UHFFFAOYSA-N 413.481 2.849 5 40 HFBB COc1ccc(CCNC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 3352038 ZXPFXYSWYNPTAG-UHFFFAOYSA-N 413.459 2.856 5 40 HFBB O=C(C1=NO[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12)c1cccc2ccccc12 100355321 PRJIOQNROJDCJD-YLJYHZDGSA-N 415.361 2.875 5 40 HFBB CC(=O)NC(=S)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 16320826 BSGWCZCYMWWEEX-UHFFFAOYSA-N 403.376 2.588 5 40 HFBB Cc1nc2sc([C@H](c3ccc([N+](=O)[O-])cc3)N3C[C@@H](C)O[C@H](C)C3)c(O)n2n1 23157611 ICPNSURZCLNRLC-HFAKWTLXSA-N 403.464 2.912 5 40 HFBB CCOc1ccc([C@@H]2CC(=O)N(Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2=O)cc1 9042584 FHLIDJUQFANQQG-AWEZNQCLSA-N 400.347 2.771 5 40 HFBB O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(Cc3cccc4cccnc34)CC2)c1 24207332 WGIBZFPKYVIEQG-UHFFFAOYSA-N 412.471 2.650 5 40 HFBB Cc1ccc([N+](=O)[O-])c(OC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1 40130998 YQVQJUISIRWMTQ-UHFFFAOYSA-N 418.203 2.981 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N[C@@H](c1nccs1)C1CC1 78903350 ZTYCMDOKNBJLLA-MRXNPFEDSA-N 424.504 2.635 5 40 HFBB CCS(=O)(=O)[C@@](Cl)(I)C(=O)c1cccc([N+](=O)[O-])c1 96518275 SVJINGMOAGVZTR-JTQLQIEISA-N 417.608 2.540 5 40 HFBB Cc1ccc(C(=O)Nc2nnc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3)s2)cc1 225747351 OPXXCGJCBKJAIN-UHFFFAOYSA-N 419.444 2.808 5 40 HFBB O=C1CCCN1C[C@@H]1CC[C@]2(COCCN(Cc3c(Cl)cccc3[N+](=O)[O-])C2)O1 306127714 GFLHNVRLLUGWJJ-YWZLYKJASA-N 423.897 2.621 5 40 HFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)C1CCN(S(=O)(=O)c2cccs2)CC1 3266740 KSYITFINXULQCP-UHFFFAOYSA-N 413.452 2.835 5 40 HFBB CCC(=O)N1CCN(c2ccccc2NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1 9504303 PNACGTKSZYNWGL-UHFFFAOYSA-N 412.446 2.914 5 40 HFBB O=C(NC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ncc2c(n1)C[C@H](c1ccco1)CC2=O 10076069 HNRCINSXKOFSHN-LBPRGKRZSA-N 421.369 2.852 5 40 HFBB O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CN(Cc1cccs1)C[C@@H]1CCCO1 14230830 AKJZTRMTLIIOAZ-ZDUSSCGKSA-N 401.444 2.891 5 40 HFBB CC[C@@H](C(=O)NCc1cccc(C)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222527765 DTOQFQZCMFSJMC-SFHVURJKSA-N 405.476 2.764 5 40 HFBB COC(=O)CSc1nnc(NC(=O)CSCc2ccc([N+](=O)[O-])cc2)s1 223473073 OQPRZWDSMLAWMP-UHFFFAOYSA-N 414.490 2.583 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(C(=O)O)(c2ccccc2)CC1 408545911 BJBPGXSKXAPVIM-UHFFFAOYSA-N 413.430 2.660 5 40 HFBB NC(=O)c1ccc(SCC(=O)N[C@H](c2nccs2)C(F)(F)F)c([N+](=O)[O-])c1 507590745 WXJPJWIRMFRPBH-LLVKDONJSA-N 420.394 2.662 5 40 HFBB COc1cc(C(=O)OCC(=O)Nc2ccc(F)c(F)c2F)c([N+](=O)[O-])cc1OC 3428340 TUKGGIWATIEYJG-UHFFFAOYSA-N 414.292 2.825 5 40 HFBB CC(C)CN(CC(C)C)C(=O)COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 5708581 CYQHNXMATVFRCK-UHFFFAOYSA-N 421.494 2.729 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCN(c2nccs2)CC1 12536951 YOLUBIKTYHANSD-UHFFFAOYSA-N 404.495 2.960 5 40 HFBB COc1ccc(C(=O)C2CCN(S(=O)(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 12737806 RPELXPZDYVBGRR-UHFFFAOYSA-N 404.444 2.887 5 40 HFBB COc1ccc(C)cc1CN1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)CC1 32236519 QSADOQONMDZYLW-UHFFFAOYSA-N 409.446 2.746 5 40 HFBB CN(CCOc1cccc([N+](=O)[O-])c1)[C@@H](C(N)=O)c1cccc(Br)c1 95459175 PUQRYJZXROPOJS-MRXNPFEDSA-N 408.252 2.895 5 40 HFBB CCOC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224770051 OFFANVOQZNNHKD-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=C(Nc1ccccc1)C1CCN(C(=O)COc2cc(F)ccc2[N+](=O)[O-])CC1 11453658 OBKTZWHGJWOMSL-UHFFFAOYSA-N 401.394 2.990 5 40 HFBB O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccccc1C(F)(F)F 103582651 MDEYYKNAFIBUDY-ZFWWWQNUSA-N 405.288 2.906 5 40 HFBB COC(=O)C1=C(O)[C@H](C(=O)OC)[C@H]2c3ccccc3[C@H]1[C@]2(c1ccccc1)[N+](=O)[O-] 106601736 WPDBGDWRNAAKCD-UVLLPENVSA-N 409.394 2.828 5 40 HFBB COc1cc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)c([N+](=O)[O-])cc1OC 111435073 LPAJKVXYMXMCMB-VGOFMYFVSA-N 401.350 2.844 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)CSCc1c(C)noc1C 3324877 GOQULQFPEXLRLO-UHFFFAOYSA-N 409.420 2.623 5 40 HFBB CC[C@@H](C)N1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 8995958 MBRANFPVIJLCSR-QKAVXHIFSA-N 414.462 2.763 5 40 HFBB C[C@H](OC(=O)C[C@H]1Sc2ccccc2NC1=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 12425363 NROHRHZEKCTYGD-MEDUHNTESA-N 415.427 2.968 5 40 HFBB CC(=O)C1=NN(c2cccc(Cl)c2)[C@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]12 100942611 FQULRKZWCCGDQF-NVXWUHKLSA-N 412.789 2.571 5 40 HFBB O=C(O)CCCCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1 4891522 GCVUFYXILCKPQJ-SSZFMOIBSA-N 415.402 2.720 5 40 HFBB COc1ccc(C(=O)NCC(=O)OCc2nc3ccccc3s2)cc1[N+](=O)[O-] 6174592 CDZURFSXEVCHDM-UHFFFAOYSA-N 401.400 2.686 5 40 HFBB O=C(CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1)NCc1ccccc1 12562657 XKQSTJIACJZDRI-UHFFFAOYSA-N 405.458 2.581 5 40 HFBB CC(C)n1ncc2cc(NC(=O)N3CCN(c4ccc([N+](=O)[O-])nc4)CC3)cnc21 40120832 VTVISMAATGLFDW-UHFFFAOYSA-N 410.438 2.670 5 40 HFBB Nc1c(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc(F)cc1[N+](=O)[O-] 40152795 YKSPDMICHCQUDE-UHFFFAOYSA-N 401.398 2.742 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)N1CCCN1[C@H]2c1ccc(Cl)cc1 100759169 BNSAJMZXAPGHAE-BZSNNMDCSA-N 412.833 2.784 5 40 HFBB O=C(CCCN1C(=O)c2ccccc2S1(=O)=O)Nc1cc([N+](=O)[O-])ccc1Cl 219440188 ODPMPYIRSKZUJX-UHFFFAOYSA-N 423.834 2.812 5 40 HFBB Cc1ccc(OCCNc2cc(N3CCN(CCO)CC3)ccc2[N+](=O)[O-])cc1C 19904369 BVEFSTQVPQOIQV-UHFFFAOYSA-N 414.506 2.817 5 40 HFBB COC(=O)c1ccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 5560634 GDSLDIYQWPCEBM-QGZVFWFLSA-N 410.386 2.648 5 40 HFBB O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)OCCCn1c(=O)[nH]c2ccccc21 6648696 QDHOKTXJWCFPIV-VOTSOKGWSA-N 411.370 2.613 5 40 HFBB NS(=O)(=O)Cc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 10706814 VJLZVRWGEKGXQG-UHFFFAOYSA-N 405.457 2.528 5 40 HFBB CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 10901997 OBWAWZUOUWIXIP-UHFFFAOYSA-N 423.878 2.843 5 40 HFBB CCN1CCC(N(C)c2ccc(S(=O)(=O)N3CCC(C)CC3)cc2[N+](=O)[O-])CC1 12522824 DAFXSWOLDHNLAF-UHFFFAOYSA-N 424.567 2.936 5 40 HFBB Cc1ccc(C)c(N(CC(=O)Nc2cccc([N+](=O)[O-])c2C)S(=O)(=O)N(C)C)c1 20244861 SQEYDDMOZMSONQ-UHFFFAOYSA-N 420.491 2.772 5 40 HFBB O=c1[nH]c(/C=C/c2cccc(OCc3ccccc3[N+](=O)[O-])c2)c([N+](=O)[O-])c(=O)[nH]1 108057807 KUTFBPKMAMJEQW-CMDGGOBGSA-N 410.342 2.629 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N([C@@H](C)C(=O)NCc1ccc(F)cc1)S(C)(=O)=O 220395017 VSLZVLCSHZGEDB-ZDUSSCGKSA-N 409.439 2.513 5 40 HFBB CCOC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225028420 KSEUPYHZHLTIPV-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(OC)c(OC)c1 3472811 LKRJCOISEAVGPO-LLVKDONJSA-N 404.375 2.805 5 40 HFBB CCOc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 4393695 CXVXYZHGNMMEJP-QZTJIDSGSA-N 417.443 2.606 5 40 HFBB COc1cc([C@H]2N[C@@H](C(=O)O)CS2)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 4554634 OSIXKNMNHWPRQP-CJNGLKHVSA-N 404.400 2.611 5 40 HFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(c2nnnn2-c2ccccc2)CC1 9119843 PJPCCKODMGZULU-UHFFFAOYSA-N 419.367 2.916 5 40 HFBB Cc1c(Cn2cnc3c(cnn3-c3ccccc3[N+](=O)[O-])c2=O)cccc1[N+](=O)[O-] 40116962 UFFXCQRCGCFBJB-UHFFFAOYSA-N 406.358 2.755 5 40 HFBB COc1ccc(CCNC(=O)c2cccn3c(=O)c4ccccc4nc23)cc1OC 51317286 HYBGUDJFCWFMAF-UHFFFAOYSA-N 403.438 2.837 5 40 HFBB CC[C@H](C)n1c(=N)c(C(=O)NCc2ccco2)cc2c(=O)n3cc(C)ccc3nc21 100811500 RRIIJPSQOUXHFG-AWEZNQCLSA-N 405.458 2.931 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C)C(=O)[C@H]2[C@H]2C=Cc3ccccc3N12 104158440 WPYHZQLSBWADGA-GFOJFJKKSA-N 417.421 2.882 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cc([N+](=O)[O-])ccc2C)cc1Cl 224964870 DEZWEDGNAKXGNF-UHFFFAOYSA-N 414.823 2.845 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 10287767 GOWMNAXTFWUMSR-UHFFFAOYSA-N 423.878 2.703 5 40 HFBB O=C(CN1CCOCC1)Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 25323433 ILNUPFGDLXCUIT-UHFFFAOYSA-N 418.837 2.771 5 40 HFBB O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)C1=NN(c2ccccc2)C(=O)CC1 32848153 KXVORPFVBWSIRS-UHFFFAOYSA-N 410.386 2.878 5 40 HFBB C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCOc2ccccc21 42616024 VMCWJKCFCYKMHD-GDBMZVCRSA-N 413.430 2.969 5 40 HFBB COC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(Cc2ccccc2Cl)c1=N 101132494 DZNAUBNRKAKNQL-UHFFFAOYSA-N 408.845 2.925 5 40 HFBB Cc1c(N(CC(=O)N2CCCc3ccccc32)S(C)(=O)=O)cccc1[N+](=O)[O-] 220032361 AUWFUXPZAKVEKF-UHFFFAOYSA-N 403.460 2.649 5 40 HFBB CS(=O)(=O)N(CC(=O)NCc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1 222764951 IZNGBKSGWOWXBO-UHFFFAOYSA-N 413.455 2.830 5 40 HFBB Cc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c(C)c1 22348288 LSIFPJGYLVUKPM-OAHLLOKOSA-N 405.476 2.855 5 40 HFBB Cc1cc(NC(=O)COc2ccccc2C(=O)N2CCOCC2)c([N+](=O)[O-])cc1C 25057505 KIUXWSVZXBGRPP-UHFFFAOYSA-N 413.430 2.702 5 40 HFBB CN(C)CCCn1ccc2nc3ccn(CCc4ccccc4)c(=O)c3cc2c1=O 40398827 DHPXASDHEQTFOA-UHFFFAOYSA-N 402.498 2.906 5 40 HFBB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1F 225119123 YFMDCZBVWOUEBS-UHFFFAOYSA-N 418.786 2.676 5 40 HFBB O=C1N[C@]2(CCCc3ccccc32)C(=O)N1Cc1cc([N+](=O)[O-])cc2c1OCOC2 2646926 UTUJOOOCXUGXST-NRFANRHFSA-N 409.398 2.745 5 40 HFBB Cn1c(=O)c2c(SC3CCCC3)nc(-c3ccc([N+](=O)[O-])cc3)nc2n(C)c1=O 4139150 DQGCNROJTZDRQG-UHFFFAOYSA-N 413.459 2.637 5 40 HFBB O=C(CSc1nnc(CNC(=O)c2ccccc2)o1)Nc1cccc([N+](=O)[O-])c1 9518560 JNVHJVUKKCFRSM-UHFFFAOYSA-N 413.415 2.639 5 40 HFBB O=C(NC[C@H]1CCCO1)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1ccccc12 11692087 IIIVCWUKQHMSIY-CYBMUJFWSA-N 413.437 2.786 5 40 HFBB Cc1nc2sc([C@@H](c3ccc([N+](=O)[O-])cc3)N3C[C@@H](C)O[C@H](C)C3)c(O)n2n1 23157617 ICPNSURZCLNRLC-UEKVPHQBSA-N 403.464 2.912 5 40 HFBB COc1ccc([C@@H]2CC(c3cccc([N+](=O)[O-])c3)=NN2C(=O)CN2CCOCC2)cc1 58268776 HPXYDTCQORNNFE-NRFANRHFSA-N 424.457 2.613 5 40 HFBB CCOC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225032433 RKCJFILGHLLWNA-UHFFFAOYSA-N 400.359 2.631 5 40 HFBB CCOC(=O)C[C@H](NS(=O)(=O)c1ccc(OC)c(C)c1)c1cccc([N+](=O)[O-])c1 3623158 TWROGONYHCNKRT-KRWDZBQOSA-N 422.459 2.885 5 40 HFBB CCc1nnc(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)s1 6860940 GAUACVQTTQEHQP-UHFFFAOYSA-N 405.465 2.535 5 40 HFBB Cc1c(NCC(=O)N(c2ccccc2)[C@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-] 11260142 JWNHJVQFUHLVTA-INIZCTEOSA-N 403.460 2.535 5 40 HFBB CCNc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 12522989 YQVCKCUTIZKNRT-UHFFFAOYSA-N 406.464 2.838 5 40 HFBB CCOC(=O)c1sc(NC[C@H]2CCCO2)nc1Cn1nc(C)c([N+](=O)[O-])c1C 36613070 YSJVEGUBNBXJAK-GFCCVEGCSA-N 409.468 2.681 5 40 HFBB COCCn1c(C)cc(C(=O)COC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1C 3450404 DQZLCDNUWFJCAT-UHFFFAOYSA-N 420.418 2.716 5 40 HFBB COc1cc(CC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc(OC)c1OC 6048523 DSGHYYNANFDKGA-UHFFFAOYSA-N 419.386 2.773 5 40 HFBB CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)c1ccc([N+](=O)[O-])s1 6560463 OBOSWGQNSOCFOR-UHFFFAOYSA-N 411.823 2.564 5 40 HFBB O=C(Nc1ncc([N+](=O)[O-])s1)c1cccc(C(=O)Nc2ncc([N+](=O)[O-])s2)c1 17092134 VEDPHVRNHLNHCV-UHFFFAOYSA-N 420.388 2.921 5 40 HFBB COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)c1cccc([N+](=O)[O-])c1 44903394 SZOJLCVBEPODDK-UHFFFAOYSA-N 405.432 2.640 5 40 HFBB COc1ccc(NC(=O)[C@@H]2CCCN2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 48302969 RPQWCAFHJSOLBD-IBGZPJMESA-N 412.446 2.669 5 40 HFBB CCn1c(=N)c(S(=O)(=O)c2ccc(C)c(C)c2)cc2c(=O)n3cccc(C)c3nc21 100942194 IYPYJOJJSSBYBW-UHFFFAOYSA-N 422.510 2.907 5 40 HFBB O=C(OCC(=O)c1c[nH]c2ccccc12)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4839248 NTDDDOZGCYLHBY-UHFFFAOYSA-N 409.398 2.952 5 40 HFBB Cc1nn(C(=O)c2cccc([N+](=O)[O-])c2C)c(C)c1S(=O)(=O)N1CCCCC1 16991459 VYXAXLBJGHYCJI-UHFFFAOYSA-N 406.464 2.580 5 40 HFBB CCC(=O)N1CCN(c2ccccc2NC(=O)COc2ccccc2[N+](=O)[O-])CC1 17089128 JSWUAGQUICMIBU-UHFFFAOYSA-N 412.446 2.671 5 40 HFBB CCc1ccc(C(=O)N2CCN(c3ccc(-n4cnnc4)cc3[N+](=O)[O-])CC2)cc1 70461906 CMRABOCBCJLVPF-UHFFFAOYSA-N 406.446 2.700 5 40 HFBB CNS(=O)(=O)c1ccc(NC[C@@H]2CCCN2CC2CCCCC2)c([N+](=O)[O-])c1 72273518 FPBMTYIIUCTFCY-INIZCTEOSA-N 410.540 2.960 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(=O)NC[C@H]1CCCO1 7363396 XAOVNVMAWVUOIB-OAHLLOKOSA-N 419.459 2.613 5 40 HFBB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 216478133 QWPWMTMSAZGWEF-UHFFFAOYSA-N 407.448 2.851 5 40 HFBB CCNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 223541389 LFFNTIGUXRXWNJ-HNNXBMFYSA-N 415.446 2.536 5 40 HFBB COc1cc(-c2nnc(COC(=O)c3ccc([N+](=O)[O-])o3)o2)cc(OC)c1OC 9284649 YVLRCBXUCAPBRL-UHFFFAOYSA-N 405.319 2.621 5 40 HFBB Cc1ccccc1-c1noc(CN2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)n1 32371746 JUJKIZPZWPQOBC-UHFFFAOYSA-N 421.457 2.840 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1NC[C@@H]1COc2ccccc2O1 5693687 ITPBITUWORIACO-CQSZACIVSA-N 419.459 2.631 5 40 HFBB O=C(OCC(=O)N1CCc2ccccc2C1)c1cc([N+](=O)[O-])ccc1N1CCCC1 5972269 SVJWHXJAVHMJSM-UHFFFAOYSA-N 409.442 2.937 5 40 HFBB COc1ccc(C)cc1NC(=O)CNC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] 24952941 YCOZYZSVQYVMJC-UHFFFAOYSA-N 407.810 2.699 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(c1ccccc1F)S(C)(=O)=O 220306117 WZJIXPQELFUJLU-NSHDSACASA-N 411.411 2.536 5 40 HFBB CNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 4509186 SAHRQXSKFMEJGA-NSHDSACASA-N 401.375 2.592 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(-c2ccccc2O)n[nH]1 12482557 GMFKRMAGWPEOEL-UHFFFAOYSA-N 401.404 2.825 5 40 HFBB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1 14022784 PASQRSICPFHWQQ-OAHLLOKOSA-N 403.460 2.943 5 40 HFBB O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 33097669 HAEBKBLSTOAFFT-CQSZACIVSA-N 412.233 2.728 5 40 HFBB O=C(NCCNc1ccccc1[N+](=O)[O-])c1nc(N2CCCCC2)ncc1Cl 47536288 XCLIVASVQVYLDS-UHFFFAOYSA-N 404.858 2.870 5 40 HFBB COc1ccc(NC(=O)c2cc3c(=O)n4cc(C)ccc4nc3n2C)cc1[N+](=O)[O-] 96347341 KXXIEMSGPFNOKR-UHFFFAOYSA-N 407.386 2.664 5 40 HFBB Cc1cc(Nc2cc(N3CCN(C)CC3)nc(Nc3ccc([N+](=O)[O-])cc3)n2)n[nH]1 169312485 UNKOUVAYOLLXER-UHFFFAOYSA-N 409.454 2.655 5 40 HFBB Cc1c(N(CC(=O)N[C@H](C)CCc2ccccc2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220031639 OXBUCQCZYJUGSU-OAHLLOKOSA-N 419.503 2.807 5 40 HFBB C[C@@H]1CCC[C@@H](NC(=O)COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)[C@@H]1C 4839492 ZNRYCUZZDXKGGX-BFYDXBDKSA-N 419.478 2.529 5 40 HFBB CCNc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 7777955 CPQHPJOKNCXNOY-GFCCVEGCSA-N 415.402 2.617 5 40 HFBB CCc1c(C(=O)Nc2ccc(-n3cncn3)nc2)cnn1-c1ccc([N+](=O)[O-])cc1 33008320 KQTJFTSZOQOMFY-UHFFFAOYSA-N 404.390 2.571 5 40 HFBB C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCC(=O)Nc2ccc(F)cc2)C1=O 40122853 WZSRYFBSLSKQAL-IBGZPJMESA-N 400.366 2.530 5 40 HFBB CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(CC(C)C)/c1=N\C(=O)C(C)C 101176589 MYNUOWKSDYWYBR-CLCOLTQESA-N 410.474 2.565 5 40 HFBB COC(=O)c1cc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc([N+](=O)[O-])c1 7985814 CNLDZKMMINXDOM-VIFPVBQESA-N 417.443 2.919 5 40 HFBB CCOC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224786115 YYXRONDSSVGPLP-UHFFFAOYSA-N 414.386 2.940 5 40 HFBB O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCCCC(=O)c1ccc(F)cc1 3284807 SNGFRBCSIXWEJI-UHFFFAOYSA-N 414.345 2.536 5 40 HFBB Cc1ccc2nc3c(cc(C(=O)NCCc4ccccc4)c(=N)n3C(C)C)c(=O)n2c1 100630673 GYTRHSWZHSWTTM-UHFFFAOYSA-N 415.497 2.990 5 40 HFBB COc1ccc(CCn2c(C)nc3c(c(=O)c4ccccc4n3C)c2=O)cc1OC 2439765 BQZXRQAJBGQOSS-UHFFFAOYSA-N 405.454 2.817 5 40 HFBB Cn1c(=O)c2c(SCc3cccc([N+](=O)[O-])c3)nc(C(C)(C)C)nc2n(C)c1=O 6552238 VFHQBZOHHCZIOD-UHFFFAOYSA-N 415.475 2.525 5 40 HFBB Cc1ccc([N+](=O)[O-])c(NC(=O)COc2ccccc2C(=O)N2CCOCC2)c1C 12749696 SYPHKGKHMIHDDP-UHFFFAOYSA-N 413.430 2.702 5 40 HFBB Cc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)CNC(=O)c2ccc(Cl)cc2)c1C 13074517 YBWMVKBGKSOJTI-UHFFFAOYSA-N 419.821 2.777 5 40 HFBB O=C(CCN1CCOCC1)N1N=C(c2ccccc2)C[C@@H]1c1ccc([N+](=O)[O-])cc1 20624538 ASEZCMLGCJGZJK-OAQYLSRUSA-N 408.458 2.995 5 40 HFBB CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@H]3C[C@@H]3[N+](=O)[O-])ccc2C)cc1 40143709 YDVFWTYSIQIQLG-IRXDYDNUSA-N 419.459 2.798 5 40 HFBB CC(C)[C@H](C)NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 225188458 PNSAHBNGRLIYQA-HNNXBMFYSA-N 405.476 2.951 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)/C=C/c1ccc2c(c1)OCO2 3247188 AQKRDMRRODQSEB-GXWOQWCDSA-N 414.370 2.916 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C(=O)N1CCCC1 7361394 ZBRWNYIIEPXZCB-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB CCc1c(C)[nH]c(-n2nc(C)cc2NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)nc1=O 7422241 JDQRZWDNJGRCNF-JXMROGBWSA-N 408.418 2.695 5 40 HFBB CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])ccc2C)cc1 40143711 YDVFWTYSIQIQLG-IAGOWNOFSA-N 419.459 2.798 5 40 HFBB Cc1n[nH]c(C)c1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 14404460 OUDFMYKNOVWARZ-UHFFFAOYSA-N 415.431 2.988 5 40 HFBB O=C(Nc1cccc(Oc2ncccn2)c1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40104912 QBBZQTHGJQHJLJ-UHFFFAOYSA-N 421.417 2.926 5 40 HFBB Cc1n[nH]c(-n2ccc3nc4ccn(-c5cccc(Cl)c5)c(=O)c4cc3c2=O)n1 40398589 JPMGEXXIMLGMLM-UHFFFAOYSA-N 404.817 2.770 5 40 HFBB COc1ccc([N+](=O)[O-])cc1N(CC(=O)Nc1cccc(C)c1C)S(C)(=O)=O 113936645 NOPVOVDLIWJSQX-UHFFFAOYSA-N 407.448 2.625 5 40 HFBB COc1cc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1O 3245332 PJGDTEKXRGOWCS-LHXVZLOVSA-N 416.386 2.901 5 40 HFBB Cc1csc(=O)n1CCC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 28689480 GPMFDRKKRFFHQE-UHFFFAOYSA-N 418.397 2.764 5 40 HFBB CCN(CC(=O)Nc1cccc([N+](=O)[O-])c1C)S(=O)(=O)c1cc(C)ccc1OC 33763754 BKYPDKNTKMHSME-UHFFFAOYSA-N 421.475 2.870 5 40 HFBB CC(C)c1[nH]nc(C(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c1[N+](=O)[O-] 84622404 KSCDIKTZTLLPSE-HNNXBMFYSA-N 421.885 2.898 5 40 HFBB Cc1c(NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cccc1[N+](=O)[O-] 220412001 IVOHEKHJPYVPCQ-LBPRGKRZSA-N 422.419 2.605 5 40 HFBB COc1ccc([N+](=O)[O-])c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C2)c1 408642555 OVRNROQZKBKGSX-GFCCVEGCSA-N 414.374 2.812 5 40 HFBB O=C(NCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1)c1cccc([N+](=O)[O-])c1 2790505 QTLQARGDTYPYJF-UHFFFAOYSA-N 412.402 2.785 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(CN(C3CCCC3)S(=O)(=O)N3CCCC3)o2)cc1 13007522 XETNYZVWYAJGNC-UHFFFAOYSA-N 421.479 2.730 5 40 HFBB COCc1n[nH]c(-n2ccc3nc4ccn([C@H]5CCCC[C@H]5C)c(=O)c4cc3c2=O)n1 40398992 FMCXJQKQHDBTOP-ACJLOTCBSA-N 420.473 2.716 5 40 HFBB CCOc1ccc([C@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 216388831 PUKICVDBSNXNGL-AWEZNQCLSA-N 421.475 2.637 5 40 HFBB CNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)CSCc1ccc([N+](=O)[O-])cc1 225184281 CVVNCZZQUXBXBV-HNNXBMFYSA-N 401.488 2.991 5 40 HFBB COc1cc(OC)c(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 2631796 IDUJJMFFYBZRRM-NSHDSACASA-N 404.375 2.805 5 40 HFBB CC(C)CCNC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 6325703 LARVLGBKAFJZEV-UHFFFAOYSA-N 405.476 2.952 5 40 HFBB CC[C@H](c1nnnn1Cc1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 35290760 MVGPZGRUWWCVPN-GOSISDBHSA-N 413.507 2.964 5 40 HFBB COC(=O)C1=C(C[S@@](=O)c2ccccc2[N+](=O)[O-])ON(C)[C@H]1c1ccccc1 5813120 BOHJGMFFFQLPIO-JMQGSBJISA-N 402.428 2.748 5 40 HFBB COc1cc(OC)cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 6552059 ANQRPKVCVQOLRX-LLVKDONJSA-N 404.375 2.805 5 40 HFBB CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)N1C[C@H](C)O[C@H](c2ccccc2)C1 72289339 BQGTWXFEMJVWKM-JQFCIGGWSA-N 401.467 2.816 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 6084135 WBIRURRMIWFGRV-LJQANCHMSA-N 416.821 2.962 5 40 HFBB Cc1cccc(C)c1NC(=O)COC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 8433866 KSSOZZLDFQBCBZ-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB COc1ccc(C(=O)NC(=S)Nc2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 8902607 JWNRNILFBFISTK-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB C[C@H]1Cc2ccccc2N1C1CCN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])CC1 40135097 QUKNZOCLANPTRW-AWEZNQCLSA-N 416.503 2.662 5 40 HFBB C[C@@H]1CCCN(c2nc(N)c([N+](=O)[O-])c(N3CCN(Cc4ccccc4)CC3)n2)C1 54147648 WDNKTSCSAZDHDZ-MRXNPFEDSA-N 411.510 2.526 5 40 HFBB Cc1ccccc1C(=O)/C=c1/[nH]c(=O)/c(=C/c2cc([N+](=O)[O-])ccc2Cl)s1 105630947 RNXLGOFIULBRBK-XFQWXJFMSA-N 400.843 2.799 5 40 HFBB Cc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1C 4393613 OGZOITFFPLASDZ-ZWKOTPCHSA-N 401.444 2.824 5 40 HFBB O=C(C[C@@H]1SC(=O)N(CC(=O)c2ccccc2)C1=O)Nc1ccc([N+](=O)[O-])cc1 4785182 IQFMOTUOULVWGL-INIZCTEOSA-N 413.411 2.870 5 40 HFBB CCOC(=O)C1=C(C(N)=O)NC2=C(C(=N)CC(C)(C)C2)[C@@H]1c1ccc([N+](=O)[O-])cc1 5790024 ILDRLZWDHOHVOV-HNNXBMFYSA-N 412.446 2.678 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1C 8433887 SITKZMIOQMYLCT-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CCNc1nc2nc3ccc(C)cn3c(=O)c2cc1C(=O)NCCc1ccccc1 20051759 BYTVJKRYPLXRKK-UHFFFAOYSA-N 401.470 2.955 5 40 HFBB CCOc1cccc(N(CC(=O)OC)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 225090421 NXTWZESBBPJHTJ-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB O=c1c2ccccc2nc2n1CC/C2=C\N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 49589378 RZQUNOANALSKFV-FOCLMDBBSA-N 403.442 2.872 5 40 HFBB CC(=O)[C@@H](C[C@@](C(C)=O)(C(=O)OC(C)C)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)C 227144372 IWLSTPVDTVMQDS-NQIIRXRSSA-N 421.446 2.920 5 40 HFBB O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1nnc(Cc2ccccc2)s1 8389550 MBUDVRAWFRIDKB-UHFFFAOYSA-N 411.443 2.796 5 40 HFBB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])c(OC)cc2OC)C1=O 409018716 YOXOAEBRNULIQX-CULDGANSSA-N 410.404 2.600 5 40 HFBB C[C@@H]1CCC[C@H](NC(=O)COC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)[C@@H]1C 4839485 ZNRYCUZZDXKGGX-INMHGKMJSA-N 419.478 2.529 5 40 HFBB CCOc1ccc(CCNC(=O)COC(=O)c2cccc([N+](=O)[O-])c2)cc1OCC 7737208 CVPVFMWFFQOJDQ-UHFFFAOYSA-N 416.430 2.908 5 40 HFBB NC1=Nc2nc3cc4c(cc3n2[C@@H](c2cc([N+](=O)[O-])ccc2Cl)N1)OCCCO4 12549548 KQFYMMHPMUHOBE-INIZCTEOSA-N 414.809 2.856 5 40 HFBB CC1=C(C(N)=O)[C@H](c2ccccc2[N+](=O)[O-])N2NC(SCc3ccccc3)=NC2=N1 9833267 IMIXPSPRJLYPBV-KRWDZBQOSA-N 422.470 2.874 5 40 HFBB CNS(=O)(=O)c1ccc(N[C@@H](c2ccccc2F)c2nccn2C)c([N+](=O)[O-])c1 12604243 ZKQXMRWLXMBACQ-KRWDZBQOSA-N 419.438 2.577 5 40 HFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 25619286 HCGYRHZVQRKUGF-UHFFFAOYSA-N 416.381 2.520 5 40 HFBB C[C@H](C(=O)Nc1ccc2c(c1)OCCO2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 57945273 KKBUQYVVXSWZFW-OAHLLOKOSA-N 412.446 2.515 5 40 HFBB O=C(CC(F)(F)F)NCCN1C(=O)S/C(=C/c2ccc([N+](=O)[O-])cc2)C1=O 98004841 KLSPTMKVJDVXRE-YRNVUSSQSA-N 403.338 2.700 5 40 HFBB COc1ccc(N(CCCC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 222602010 ZFDAZHITVJMINJ-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB Cc1cccc(C(=O)N2CCCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1 32771385 XONDBYNPISWKNH-UHFFFAOYSA-N 417.487 2.748 5 40 HFBB CCCCCCn1ccc2nc3ccn(-c4nc(COC)n[nH]4)c(=O)c3cc2c1=O 40398981 QJARQRGKXWOJLS-UHFFFAOYSA-N 408.462 2.545 5 40 HFBB CC[C@@H](C(=O)NCCSC(C)(C)C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222520959 WXODCIUQZDAOEB-HNNXBMFYSA-N 417.553 2.787 5 40 HFBB O=C(COC(=O)c1ccc(NC(=O)C(F)(F)F)cc1)Nc1cccc([N+](=O)[O-])c1 408648620 ZUNASLKRIPEOME-UHFFFAOYSA-N 411.292 2.891 5 40 HFBB COc1cc(OCC(=O)N(C)Cc2nc(-c3cccc(C)c3)no2)ccc1[N+](=O)[O-] 219829551 QRIMCKLGRBGYPE-UHFFFAOYSA-N 412.402 2.999 5 40 HFBB CCOc1c(Br)cc(/C=C\c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)cc1OC 33411744 BRINKUJMMMLXAS-PLNGDYQASA-N 412.196 2.724 5 40 HFBB CC(C)CNC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408589097 DPTMDTPNFDXOFE-CQSZACIVSA-N 421.475 2.935 5 40 HFBB Cc1cc(S(=O)(=O)N2CCCC2)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 409393074 VEYWTBJELBYDHB-UHFFFAOYSA-N 419.459 2.705 5 40 HFBB O=[N+]([O-])c1ccc(N2C(=S)N(c3ccc(F)cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 12421626 YHAQKJMTFXCZJQ-HOTGVXAUSA-N 407.448 2.511 5 40 HFBB C[C@@H]1CCC[C@H](C(=O)NS(=O)(=O)c2cc([N+](=O)[O-])c(N)cc2Br)C1 72310842 DJCOUONVKQPQFP-BDAKNGLRSA-N 420.285 2.571 5 40 HFBB CSCC[C@@H](NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C)c1nc2ccccc2[nH]1 8216854 WZZDTKAADNFBMA-OAHLLOKOSA-N 402.480 2.895 5 40 HFBB O=C(NC[C@@H]1CCCO1)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1ccccc12 11692086 IIIVCWUKQHMSIY-ZDUSSCGKSA-N 413.437 2.786 5 40 HFBB O=C(NC(=S)Nc1ccc(Cl)c(C(=O)O)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 17094116 SSNVICPLOQNCGX-UHFFFAOYSA-N 424.778 2.981 5 40 HFBB COc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)c(N(C)S(C)(=O)=O)cc1OC 22251405 GJWPCRUUYYTJJH-UHFFFAOYSA-N 423.447 2.569 5 40 HFBB O=C1Nc2ccc([N+](=O)[O-])cc2O[C@H]1CCN1CCN(c2ccccc2F)CC1 63110731 AGBMABXDVFVTEF-SFHVURJKSA-N 400.410 2.646 5 40 HFBB CCNC(=S)NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(C)cc1C 9137207 WYNHYKSUACWYRV-UHFFFAOYSA-N 423.520 2.823 5 40 HFBB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 32057999 MCSQKGLKTJOPCM-UHFFFAOYSA-N 419.441 2.947 5 40 HFBB C[C@H](C(=O)NCCSc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 220404337 AXFQEHDCMOZLQN-CQSZACIVSA-N 423.516 2.658 5 40 HFBB CC[C@@H](C(=O)N1CCc2ccccc2C1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222517346 JTGAJULDPXBGPK-IBGZPJMESA-N 417.487 2.724 5 40 HFBB CCOC(=O)COc1cc(OCC(=O)OCC)c2c(c1)oc(=O)c1ccccc12 627727 HJNFKPLDJYSARQ-UHFFFAOYSA-N 400.383 2.830 5 40 HFBB COC(=O)C(C(=O)OC)[C@@H](c1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)[N+](=O)[O-] 1722455 BGUMLHXQINGZKB-NVXWUHKLSA-N 402.359 2.659 5 40 HFBB COc1ccccc1NC(=O)COC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 8416437 ZMJGXFPHMZOIMD-UHFFFAOYSA-N 401.375 2.504 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 14019435 BCZFTCLRXOTBDQ-CQSZACIVSA-N 419.459 2.643 5 40 HFBB CCOc1ccc([C@@H](C)NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 216388785 PUKICVDBSNXNGL-CQSZACIVSA-N 421.475 2.637 5 40 HFBB COc1ccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 408620578 HLCUXGKXTRJTQX-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB O=C(O)C[C@@H](NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 7787326 SHPCUINDVWZRJA-CYBMUJFWSA-N 402.787 2.882 5 40 HFBB C[C@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1 9843042 IDTBIJMXKCCQFR-ZDUSSCGKSA-N 413.386 2.853 5 40 HFBB Cc1cc(C)c(CN2CCOCC2)c(OS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 20218682 WVRCWXOEYOJIQL-UHFFFAOYSA-N 406.460 2.812 5 40 HFBB Cc1ccc(S(=O)(=O)CCC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 408648618 ZQTNCHAAWNDNOC-UHFFFAOYSA-N 420.443 2.557 5 40 HFBB COc1ccc2c(c1)c(C(=O)N1C[C@@H]3C[C@H](C1)Cn1c3ccc([N+](=O)[O-])c1=O)cn2C 888089101 HSKOVTAXVJSGAJ-KGLIPLIRSA-N 422.441 2.516 5 40 HFBB Cc1ccc(CCCC(=O)NCCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 44367203 QGIPNIBISFKYBS-UHFFFAOYSA-N 419.503 2.858 5 40 HFBB Cc1cc(C(=O)N(C)CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)ccc1[N+](=O)[O-] 12764971 IBFCVFIKUATALL-AWEZNQCLSA-N 410.430 2.739 5 40 HFBB Cc1nn(Cc2ccccc2)c(C)c1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 12791367 ADLRZLRWAROGIS-UHFFFAOYSA-N 400.460 2.935 5 40 HFBB CNc1ccc([C@@H]2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC(C)C)cc1[N+](=O)[O-] 57464785 VBHKHBFJDXHFAU-GOSISDBHSA-N 403.435 2.996 5 40 HFBB COc1cc([C@@H]2N[C@H](C(=O)O)CS2)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 4554631 OSIXKNMNHWPRQP-XJKSGUPXSA-N 404.400 2.611 5 40 HFBB O=C(c1cccc([N+](=O)[O-])c1)[C@@H](C(=O)N1CCc2ccccc2C1)n1ccccc1=O 4679737 NEFXFJMHICOTJW-NRFANRHFSA-N 417.421 2.765 5 40 HFBB COC(=O)c1cc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc([N+](=O)[O-])c1 7985813 CNLDZKMMINXDOM-SECBINFHSA-N 417.443 2.919 5 40 HFBB Cc1ccccc1CN(C)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1 12554490 HVHVADSYHBHFCJ-UHFFFAOYSA-N 405.476 2.561 5 40 HFBB C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 72289460 OXAFCBMYWYBLBH-AWEZNQCLSA-N 415.425 2.911 5 40 HFBB COC(=O)CN(c1ccc(F)c(Cl)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113886203 DDQCIMNRUXWXMV-UHFFFAOYSA-N 402.787 2.756 5 40 HFBB CS(=O)(=O)N(CCCC(=O)N1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 222686182 PHWGBIZXZTUANY-UHFFFAOYSA-N 417.487 2.726 5 40 HFBB CCCc1nc(S/C(=C\c2cc([N+](=O)[O-])ccc2N2CCOCC2)C(=O)O)n[nH]1 408632863 UJLXMEMPEJRFTQ-PTNGSMBKSA-N 419.463 2.720 5 40 HFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](C(=O)O)c1ccc(O)cc1 6719371 JCHMGKNOWRPJPA-OAQYLSRUSA-N 402.406 2.802 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2=O)cc1C 7452551 IKDCQSMMZKFFFS-GOSISDBHSA-N 422.485 2.913 5 40 HFBB COC(=O)CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 8729492 YKQDPRGQBLLSPS-UHFFFAOYSA-N 418.349 2.982 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1C 15248175 CYIOOQDQFMDKFQ-LJQANCHMSA-N 419.503 2.563 5 40 HFBB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc([N+](=O)[O-])cc1)C(C(=O)OC)=C(C)N2 100821687 HKKZFSTZVIXJDN-ZDUSSCGKSA-N 402.432 2.795 5 40 HFBB O=C1[C@@H]2[C@@H](N=NN2c2ccc([N+](=O)[O-])cc2)C(=O)N1c1ccc(Br)cc1 100928893 WJSXHOGEHAKEBW-KGLIPLIRSA-N 416.191 2.855 5 40 HFBB Cn1cc(CCC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3ccc([N+](=O)[O-])c2=O)c2ccccc21 888089565 NYGBFXZMBFEPAN-WBVHZDCISA-N 420.469 2.827 5 40 HFBB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC 6052635 DGBOFCPPFRIZFX-SFHVURJKSA-N 412.402 2.879 5 40 HFBB O=C1NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCC[C@@H]32)C(=O)N1C1CCCCC1 8974775 AFNXLSQGTMEUTP-DYESRHJHSA-N 412.446 2.517 5 40 HFBB O=C(c1ccccc1NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)N1CCCCC1 12507969 MKSAEYMKMIYLDL-UHFFFAOYSA-N 405.432 2.727 5 40 HFBB C[C@H](NC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 12938736 PBFVBUHHPCTHTK-NSHDSACASA-N 419.821 2.627 5 40 HFBB COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCOc3ccccc32)cc1OC 32854571 SXMLZYBJSVSXLM-HNNXBMFYSA-N 402.403 2.882 5 40 HFBB O=[N+]([O-])c1ccc(N2CCC[C@@H](c3ccncn3)C2)c(S(=O)(=O)N2CCCC2)c1 69388257 SCVVHNKUPQXNLS-OAHLLOKOSA-N 417.491 2.553 5 40 HFBB COc1ccc(N(CC(=O)O)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl 225030405 RPBKARDXQGAAIJ-UHFFFAOYSA-N 400.796 2.537 5 40 HFBB COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 260816701 ZNNJNJLWFGYHNA-KGLIPLIRSA-N 421.475 2.635 5 40 HFBB O=C(CN1C(=O)S/C(=C/c2cc(Cl)cc([N+](=O)[O-])c2O)C1=O)N1CCCC1 408552820 VSEHTHVBSIJEKC-WUXMJOGZSA-N 411.823 2.613 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1ccc(Cl)cc1 408659666 MNCXEDPTJBYTSX-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB CCN(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)C1CCCCC1 4889935 RSZXSICAAHSRPQ-UHFFFAOYSA-N 419.478 2.769 5 40 HFBB Cc1cc(C)cc(N2C(=O)N(Cc3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@H]32)c1 10272617 KZDKFWHEEZXGDZ-RTBURBONSA-N 415.471 2.819 5 40 HFBB Cc1cccc(N2C(=S)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@H]32)c1 12421629 XUNJDXMAHMHPNL-DLBZAZTESA-N 403.485 2.680 5 40 HFBB CN(C)c1ccc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 30258011 VKFVOONRSKPQRV-UHFFFAOYSA-N 415.425 2.790 5 40 HFBB CCS(=O)(=O)C(Br)(Br)C(=O)c1cccc([N+](=O)[O-])c1 96518487 XKEFDVHZSNRWRE-UHFFFAOYSA-N 415.059 2.656 5 40 HFBB COc1ccc(/C=C2/SC(=O)N(CC(=O)N3CCCCC3)C2=O)cc1[N+](=O)[O-] 205788600 UAKKPKYOWASHHP-XNTDXEJSSA-N 405.432 2.652 5 40 HFBB COC(=O)CN(c1cc(Cl)ccc1OC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225027948 GAGFOOIEWFDHQL-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB COc1c2c(cc3c1[C@@H](c1nnnn1-c1c(C)cccc1C)[N+](C)(C)CC3)OCO2 4028909 VJJNOKPDUVUYNE-IBGZPJMESA-N 408.482 2.738 5 40 HFBB biogenic COc1ccc(CNc2ccc(S(=O)(=O)NC(C)C)cc2[N+](=O)[O-])cc1OC 6509347 NJUUKMHSIUXINB-UHFFFAOYSA-N 409.464 2.911 5 40 HFBB COc1ccc(C(=O)NCC(=O)Nc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-] 12592488 JYTNZWKCVHIEGX-UHFFFAOYSA-N 412.446 2.962 5 40 HFBB C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C(=O)c2ccncc2)CC1 48333357 FULZIPMMXLGDDE-CQSZACIVSA-N 414.487 2.891 5 40 HFBB O=C(OCc1ccc([N+](=O)[O-])cc1)C1CCN(S(=O)(=O)c2cccs2)CC1 3529979 DJJGVOKJURGAOT-UHFFFAOYSA-N 410.473 2.800 5 40 HFBB C[C@H]1CN(C(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 5447142 UAZBWNRZXRLKPE-KBPBESRZSA-N 419.459 2.645 5 40 HFBB COc1cc(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(Cl)c1OCC(N)=O 12777090 GYQUQLNKPUBLEE-NSHDSACASA-N 421.837 2.954 5 40 HFBB CC(=O)Nc1ccc(CN2C[C@H](O)C[C@H]2c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 15674875 MCZNGLOEZRAVBF-MOPGFXCFSA-N 423.429 2.911 5 40 HFBB biogenic,in-vitro COc1cc(C(=O)Nc2nnc(-c3cccc([N+](=O)[O-])c3)o2)cc(OC)c1OC 20496155 SVLGZRIUSIGIFR-UHFFFAOYSA-N 400.347 2.923 5 40 HFBB O=C(O)c1ccc(Br)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 226354118 DPDPZAMQDLJBER-UHFFFAOYSA-N 401.194 2.856 5 40 HFBB Cc1cc(CN(C)C(=O)[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C(C)C)no1 40088957 PHBBNKGFBBKEKI-INIZCTEOSA-N 408.842 2.958 5 40 HFBB CCOC(=O)c1c(C)nn2c1ncc1c(=O)n(-c3ccc(C)c([N+](=O)[O-])c3)ccc12 40397923 LEAPBEJTIXQWBQ-UHFFFAOYSA-N 407.386 2.735 5 40 HFBB COC(=O)C[C@H](C(=O)OC)[C@@H](C[N+](=O)[O-])c1ccc(OC)c(OC2CCCC2)c1 65336765 ANIDZYMNYALTTQ-HOTGVXAUSA-N 409.435 2.729 5 40 HFBB CC(=O)c1cccc(NC(=O)[C@H](C)N(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 220411356 LFQUTOMGUFNGMH-LBPRGKRZSA-N 405.432 2.591 5 40 HFBB CC[C@@H](C(=O)NCCCc1ccccc1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222527001 BYZSIPOEMPXNKK-IBGZPJMESA-N 419.503 2.888 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NC(C)(C)Cc1ccccc1)S(C)(=O)=O 223690171 WVZWPTRCWGMKRI-UHFFFAOYSA-N 419.503 2.807 5 40 HFBB COc1ccccc1N1CCN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 4054494 LTAPJQQHQNDNEC-UHFFFAOYSA-N 411.867 2.768 5 40 HFBB O=C(COC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1)Nc1ccccc1Cl 9525982 UMRZGLFDKWFLEC-LBPRGKRZSA-N 417.805 2.783 5 40 HFBB Cc1ccc(-c2nnc(O)c3c2[C@H](c2cccc([N+](=O)[O-])c2)n2nnnc2N3)cc1 10232586 ABINQGZHFWNACF-KRWDZBQOSA-N 402.374 2.747 5 40 HFBB O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccccc3)C2)c(S(=O)(=O)N2CCCC2)c1 23888455 RGGVAJZQHVZRTG-IBGZPJMESA-N 417.487 2.957 5 40 HFBB CC(C)NC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408588370 FQWAQORWMSWIQD-ZDUSSCGKSA-N 407.448 2.688 5 40 HFBB COCCNc1ccc(C(=O)N(C)C[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 24660446 ZECOOXFACQFSPT-HNNXBMFYSA-N 401.419 2.565 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC(NC(=O)OC(C)(C)C)CC1 36392376 CJHWVNHXKCBAHZ-UHFFFAOYSA-N 408.455 2.531 5 40 HFBB O=c1nc2c3cc(I)ccc3ncn2nc1-c1ccccc1 69701200 NMBNTBAUGROFKG-UHFFFAOYSA-N 400.179 2.909 5 40 HFBB COc1ccc(C(=O)[C@H](C)OC(=O)[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1 7881401 SGKIACVQFCDFER-DZGCQCFKSA-N 412.398 2.771 5 40 HFBB COc1ccc(NC(=O)CN(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 7986475 SKEALKHHWGOKCA-UHFFFAOYSA-N 406.826 2.766 5 40 HFBB Cc1cc(NC(=O)COC(=O)C2=NN(c3ccccc3)C(=O)CC2)c([N+](=O)[O-])cc1C 9403327 PHRBMYPKLVAPLP-UHFFFAOYSA-N 424.413 2.876 5 40 HFBB O=C(NCCN1C(=O)S/C(=C\c2cccnc2)C1=O)c1ccc([N+](=O)[O-])s1 12527956 RZNODEFPKTYGGU-WQLSENKSSA-N 404.429 2.518 5 40 HFBB O=C(Nc1cc2c(cc1Cl)OCCO2)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 62580048 AVQRYLZBFMEWBW-UHFFFAOYSA-N 419.825 2.769 5 40 HFBB CCOC(=O)CN(c1ccc(OCC)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 113885458 OTFOQDQVCCSQQR-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1NCc1ccccc1Cl 6392593 QIIYGRAWRCQIIJ-UHFFFAOYSA-N 411.867 2.881 5 40 HFBB O=C1N(c2ccc(Cl)cc2)[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc([N+](=O)[O-])cc1 7718577 WCZLWBMQHGBKHG-CVEARBPZSA-N 407.835 2.860 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1cccn(Cc2cccc([N+](=O)[O-])c2)c1=O 10187819 MNHCPRRVJASJCA-UHFFFAOYSA-N 424.369 2.974 5 40 HFBB CCN(c1ccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1)S(C)(=O)=O 19937798 VOXWXCRZWRUBSN-UHFFFAOYSA-N 407.448 2.707 5 40 HFBB CC1CCN([C@@H](CNC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C(C)C)CC1 31158202 MBKZPJMUGUHLJW-IBGZPJMESA-N 418.542 2.578 5 40 HFBB COc1cccc([C@H]2CC(c3ccc([N+](=O)[O-])cc3)=NN2C(=O)CN2CCOCC2)c1 89469802 IFYDLRJUYTYKPW-OAQYLSRUSA-N 424.457 2.613 5 40 HFBB CCOC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225004162 RWEYTHAYKNHSDZ-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB CCCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408527391 DKWPJBVVMCKTHA-UHFFFAOYSA-N 407.448 2.691 5 40 HFBB O=C(O)CN1C(=O)N/C(=C/c2cn(Cc3ccc([N+](=O)[O-])cc3)c3ccccc23)C1=O 408589250 DKVMTWKHLYDSKX-RQZCQDPDSA-N 420.381 2.575 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1 2622294 RLXOGJMEHGPRDN-UHFFFAOYSA-N 407.448 2.527 5 40 HFBB O=C(NC(=S)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(F)c1 20410905 UKRCFZDMGXJJQN-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB N=C1NC(=O)/C(=C\c2ccccc2OS(=O)(=O)c2ccccc2[N+](=O)[O-])S1 41078037 CSCPECPMDQEAFU-UKTHLTGXSA-N 405.413 2.501 5 40 HFBB CS(=O)(=O)N(CC(=O)NCc1cccc2ccccc12)c1cccc([N+](=O)[O-])c1 222843610 RBHHIRAURFDPCV-UHFFFAOYSA-N 413.455 2.830 5 40 HFBB O=C(CN1CCC(C(=O)N2CCCCCC2)CC1)Nc1ccc(F)cc1[N+](=O)[O-] 12822372 UIWUDXXDMAOHRT-UHFFFAOYSA-N 406.458 2.787 5 40 HFBB O=C(NC(=S)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1F 20410900 KWGOMNWGWRZULU-UHFFFAOYSA-N 404.423 2.697 5 40 HFBB O=S(=O)(O)[N+]1(N2C[C@@H]3CCCC[C@H]3C2)CCN(c2nsc3ccccc23)CC1 98181700 FKKBEEHBJWWXMP-HOTGVXAUSA-O 423.584 2.773 5 40 HFBB CCOC(=O)CN(c1ccccc1OCC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 113887006 QRWDGKVBTQFOAG-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB COc1cc(Cl)c([C@@H]2[C@H](C)N[C@@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408569716 XELHHTRKORBTQX-IEHOFBCGSA-N 417.849 2.925 5 40 HFBB Cc1cc(C)cc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)c1 408671369 XYKXSVAHDACZDU-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)c3cccc([N+](=O)[O-])c3C)cc12 4225180 YEBZKHHSEXPVOF-UHFFFAOYSA-N 411.414 2.734 5 40 HFBB Cc1nc(-c2cccnc2)sc1CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 4392351 PPOLQSNONOULBP-UHFFFAOYSA-N 404.473 2.943 5 40 HFBB CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])ccc2C)cc1 40143707 YDVFWTYSIQIQLG-SJORKVTESA-N 419.459 2.798 5 40 HFBB COCc1n[nH]c(-n2ccc3nc4ccn([C@H]5CCCC[C@@H]5C)c(=O)c4cc3c2=O)n1 40398993 FMCXJQKQHDBTOP-UGSOOPFHSA-N 420.473 2.716 5 40 HFBB O=C(c1ccccc1[N+](=O)[O-])N(Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 408685665 PTTRALHJPRJYPB-XAMWDVODSA-N 417.421 2.959 5 40 HFBB Nn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccc(Cl)c1 5864918 ROMSOKWOPIJMMU-UHFFFAOYSA-N 404.839 2.951 5 40 HFBB COc1ccc(OC)c(/C=C/C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 6347302 NGWIQJQPCNLJSD-RUDMXATFSA-N 416.386 2.816 5 40 HFBB CC[C@H](NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O)c1ccc(C)cc1 22523501 LSKZPVUPDGNBRM-SFHVURJKSA-N 405.476 2.937 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 40074146 GJFJSPHAEQSYAM-UHFFFAOYSA-N 405.476 2.539 5 40 HFBB O=C1c2cccc3c(NCCO)c([N+](=O)[O-])cc(c23)C(=O)N1c1ccc([N+](=O)[O-])cc1 95470799 AJBBOMVOBAKDCY-UHFFFAOYSA-N 422.353 2.861 5 40 HFBB CN(Cc1ccccc1)C(=O)[C@H](C(=O)c1cccc([N+](=O)[O-])c1)n1ccccc1=O 199425451 VUWIPJUQAMYPEY-FQEVSTJZSA-N 405.410 2.839 5 40 HFBB CCOC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(OCC)cc1 224598838 XMQDJLPFSGSWFV-UHFFFAOYSA-N 408.432 2.752 5 40 HFBB O=C(CCc1c[nH]c2ccccc12)N1C[C@H]2C[C@H](C1)c1ccc([N+](=O)[O-])c(=O)n1C2 604403888 CAWBSDRNMRHCFA-GDBMZVCRSA-N 406.442 2.816 5 40 HFBB biogenic O=c1nc2n(-c3ccc(I)cc3)c3ccccc3cc-2c(=O)[nH]1 1437011 LYVWTXUSCPBIOS-UHFFFAOYSA-N 415.190 2.783 5 40 HFBB Cc1ccc(C)c(NC(=O)COC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1 8433871 LWDDXARHISDYRA-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB COc1ccccc1[C@H]1[C@H]2SC(N)=NC2=NN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 16228425 QAFRUPKHGMKQQW-LSDHHAIUSA-N 414.403 2.817 5 40 HFBB CC(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Sc1ncnc2[nH]cnc12 17059240 CAAWIOGGSZEECZ-UHFFFAOYSA-N 404.364 2.886 5 40 HFBB O=C(Nc1ccc(F)cc1)NC1CCN(c2ncc([N+](=O)[O-])c(NC3CC3)n2)CC1 40153764 YDDIMXHGFYOHEX-UHFFFAOYSA-N 415.429 2.889 5 40 HFBB Nn1c(SCC(=O)Nc2ccc(O)c([N+](=O)[O-])c2)nnc1-c1ccccc1Cl 409172573 KYKQQVVFYCFWQH-UHFFFAOYSA-N 420.838 2.657 5 40 HFBB CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2ccccc2c1 12942589 ABHQYWONURPXDY-SFHVURJKSA-N 416.455 2.808 5 40 HFBB COc1ccc(-c2nc3n(n2)[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(=O)N3)cc1 20728776 APXZOSXIEMMISZ-MRXNPFEDSA-N 422.401 2.692 5 40 HFBB COc1cccc(N2CCN(C(=O)c3cn[nH]c3-c3ccc([N+](=O)[O-])cc3)CC2)c1 72328748 XJTULAOUEWJBHK-UHFFFAOYSA-N 407.430 2.956 5 40 HFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 408532220 MEGDBPIBZQNDAZ-UHFFFAOYSA-N 403.420 2.578 5 40 HFBB COC(=O)c1sc2ncn3nc([C@H](C)Cn4nc([N+](=O)[O-])cc4C)nc3c2c1C 2804184 ATQOHEDKNPNBTA-MRVPVSSYSA-N 415.435 2.651 5 40 HFBB CCCCN1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 9089983 XDJZZRVSSBETBS-UTKZUKDTSA-N 414.462 2.765 5 40 HFBB O=[N+]([O-])c1cc2c(c(CN3CCN(Cc4ccc5c(c4)OCO5)CC3)c1)OCOC2 23751796 NCBGXAQLJOYJGI-UHFFFAOYSA-N 413.430 2.508 5 40 HFBB CO[C@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1 96006532 QKVACYBTSDMMGR-GJZGRUSLSA-N 422.482 2.537 5 40 HFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1 1398782 SUPYDKUDWNCTLM-UHFFFAOYSA-N 404.473 2.715 5 40 HFBB CNS(=O)(=O)c1ccc(NCC(=O)Nc2cccc(Cl)c2C)c([N+](=O)[O-])c1 8203832 KSODGTQAQRJMCV-UHFFFAOYSA-N 412.855 2.515 5 40 HFBB Cc1ccc(-n2nnn(CN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c2=S)cc1 16081822 RRVBLNXWEBUSJY-UHFFFAOYSA-N 411.491 2.795 5 40 HFBB O=C(O)[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 547878917 HZEUMUBLUQIGLN-CQSZACIVSA-N 412.851 2.611 5 40 HFBB O=C(c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1)N1CCOCC1 1388729 SDHQNIWHRWQWBB-UHFFFAOYSA-N 424.862 2.695 5 40 HFBB COc1cccc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2[N+](=O)[O-])c1 3170552 QDJUMGKHORJPAK-QGZVFWFLSA-N 419.459 2.785 5 40 HFBB COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)N1CCCC1 8476166 RRLNSPMESGVUAO-UHFFFAOYSA-N 419.459 2.949 5 40 HFBB CNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1c2ccccc2NC(=O)C1(C)C 10248198 FSJYILXXUSGBJY-UHFFFAOYSA-N 412.402 2.557 5 40 HFBB CNC(=O)c1ccc(N2CCc3c(ncn3CCc3ccccc3)C2)c([N+](=O)[O-])c1 95467525 ZAULCEOEIAFIOF-UHFFFAOYSA-N 405.458 2.956 5 40 HFBB CCNC(=O)c1cc2c(=O)n3ccccc3nc2n(Cc2ccccc2Cl)c1=N 101230686 RNVDFDNMKMEVPI-UHFFFAOYSA-N 407.861 2.580 5 40 HFBB CCOC(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224774784 AGZBNYLHELPJKB-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4cccc([N+](=O)[O-])c4C)cnc32)cc1C 10252068 DFKCJIUNHRQGII-UHFFFAOYSA-N 418.413 2.800 5 40 HFBB COc1cccc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 17090590 WQYBSKFVIPHYRT-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB COc1ccccc1C(=O)NC(=S)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 20410923 NGFKTWDZSMPQQY-UHFFFAOYSA-N 416.459 2.567 5 40 HFBB O=[N+]([O-])c1ccc(N2CCN(Cn3nc(CN4CCCCC4)oc3=S)CC2)cc1 25046572 FTQVROIRBFAZAW-UHFFFAOYSA-N 418.523 2.879 5 40 HFBB CCOC(=O)[C@H]1CSCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 32902943 RVXGJYVVRIUJBV-LJQANCHMSA-N 410.495 2.662 5 40 HFBB COC(=O)c1ccc(C(=O)N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)c(C)[nH]2)nc1 89547815 UZRLPTCQYINJFE-UHFFFAOYSA-N 409.402 2.747 5 40 HFBB COc1ccccc1N(CCCC(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222580644 OKHIBICXXBVEMJ-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB CCc1ccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 4393633 BOQZMORDPYBFTJ-ZWKOTPCHSA-N 401.444 2.769 5 40 HFBB O=C(NCCSc1nnnn1-c1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1 5234637 OIMBPZWRWYDRCT-UHFFFAOYSA-N 404.839 2.746 5 40 HFBB COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1N1CCCC1=O 20460526 FOKLMWCSGJOKSC-UHFFFAOYSA-N 405.432 2.839 5 40 HFBB CC(=O)Nc1cc(C)nn1-c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 32595977 FUTBGQGTVOMOBT-UHFFFAOYSA-N 415.431 2.848 5 40 HFBB O=C(Cn1cnc([N+](=O)[O-])n1)N(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2 40152584 KRQRIHHKUBEFEY-QPJJXVBHSA-N 421.413 2.704 5 40 HFBB CC[C@H](C(=O)NCCSC(C)(C)C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222521022 WXODCIUQZDAOEB-OAHLLOKOSA-N 417.553 2.787 5 40 HFBB O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCCC2)cc1 3445565 IZKSCGJORZDWMD-UHFFFAOYSA-N 423.422 2.536 5 40 HFBB O=C(CSc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1)NCc1ccco1 8821966 ATOXGSYIPMZAAP-UHFFFAOYSA-N 419.444 2.700 5 40 HFBB CNS(=O)(=O)c1ccc(N2CCC[C@@H]2CN(C)c2ccccc2)c([N+](=O)[O-])c1 58157292 JADUHOOBBXAVMC-MRXNPFEDSA-N 404.492 2.608 5 40 HFBB Cc1nn(-c2ccccc2)c2nc3[nH]c(=O)[nH]c(=O)c3c(-c3ccc([N+](=O)[O-])cc3)c12 72332771 PYUPTPFLXNSPIM-UHFFFAOYSA-N 414.381 2.834 5 40 HFBB COc1cc([N+](=O)[O-])c(C(=O)N[C@H](CO)C[C@H](O)c2ccccc2)cc1SC 89423809 PLTJKMNEJPRJCX-BBRMVZONSA-N 406.460 2.540 5 40 HFBB O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 541338406 UWAIIUZXFZFUIF-FUHWJXTLSA-N 409.446 2.957 5 40 HFBB O=C(Cn1cnc2c(cnn2-c2ccc(Cl)cc2)c1=O)Nc1cccc([N+](=O)[O-])c1 9416426 GKAURWPAIQNAKB-UHFFFAOYSA-N 424.804 2.783 5 40 HFBB O=C(Nc1ccc(N2CCN(C(=O)c3ccco3)CC2)cc1)c1ccc([N+](=O)[O-])o1 17088430 FLOKLELQARJCBO-UHFFFAOYSA-N 410.386 2.996 5 40 HFBB CCOC(=O)CN(c1ccccc1OC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 225078518 NTUBMBPFECJPOX-UHFFFAOYSA-N 408.432 2.670 5 40 HFBB Cc1cc(=O)oc2cc(NC(=O)[C@H](C)N3C(=O)c4cccc([N+](=O)[O-])c4C3=O)ccc12 9507262 PGYZLOKIEXPCSR-NSHDSACASA-N 421.365 2.633 5 40 HFBB O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1nn(-c2ccc(F)cc2)c2c1CCC2 11240989 BLWXNNRBHSWHIN-LJQANCHMSA-N 410.405 2.872 5 40 HFBB O=C(N[C@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 12429023 IFJNBTSLUHNFGX-HDICACEKSA-N 412.402 2.974 5 40 HFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 12986322 XOWNWHWJXPEIIB-CYBMUJFWSA-N 403.460 2.869 5 40 HFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2ccc(C(=O)NC3CC3)cc2)c1C 24839915 ZBQZPBISKMZUQC-UHFFFAOYSA-N 417.487 2.925 5 40 HFBB CC1CCN([C@H](CNC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C(C)C)CC1 31158208 MBKZPJMUGUHLJW-LJQANCHMSA-N 418.542 2.578 5 40 HFBB O=C(CCn1ccc2ccccc21)N1C[C@H]2C[C@H](C1)c1ccc([N+](=O)[O-])c(=O)n1C2 409413720 SUEASGXTWMXEDA-NVXWUHKLSA-N 406.442 2.747 5 40 HFBB COc1cc([N+](=O)[O-])cc2sc(NC(=O)CS(=O)(=O)c3ccc(C)cc3)nc12 15881838 TYMFXUIZSXFJFM-UHFFFAOYSA-N 421.456 2.934 5 40 HFBB CC(C)c1cccc(N2C[C@@H](C(=O)NC[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2=O)c1 23018503 XFANOAGEXOVLJB-PXNSSMCTSA-N 411.458 2.921 5 40 HFBB NCCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 5603328 FKFJWYPXPIUVGU-GOSISDBHSA-N 400.435 2.957 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)OC(=O)c1ccc(OC)c(OC)c1 6545572 UUPGHGCFMDDBKO-LLVKDONJSA-N 404.375 2.805 5 40 HFBB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc([N+](=O)[O-])cc1Cl 13668367 CHRZZRGCOAXDQS-UHFFFAOYSA-N 409.851 2.701 5 40 HFBB COC(=O)CN(c1ccc(OC)c(Cl)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225030347 CGZGBXCYAOVXEM-UHFFFAOYSA-N 414.823 2.625 5 40 HFBB N=C1NC(=O)/C(=C/c2cccc(OS(=O)(=O)c3ccccc3[N+](=O)[O-])c2)S1 408895153 MFPJYNFAUKEPLN-LCYFTJDESA-N 405.413 2.501 5 40 HFBB Cc1cccc(N2C[C@@H](C(=O)OCC(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2=O)c1 8037425 GDELSFLQZGSVIT-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)[C@H]1CCCN(c2ccc(-n3cccn3)nn2)C1 62022799 CAYKVXJODAALCI-HNNXBMFYSA-N 407.434 2.734 5 40 HFBB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1)Nc1ccc(Cl)cc1 408659664 MNCXEDPTJBYTSX-GFCCVEGCSA-N 417.805 2.783 5 40 HFBB O=[N+]([O-])c1ccc(-c2nnc(O)c3c2[C@H](c2ccccc2F)n2nnnc2N3)cc1 10296259 QUUKWLZQLGXWBF-INIZCTEOSA-N 406.337 2.578 5 40 HFBB COc1cc(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)c([N+](=O)[O-])c(OC)c1OC 12772076 DBFATNGWVVKIBW-HNNXBMFYSA-N 421.425 2.792 5 40 HFBB COc1ccc(-c2noc(CN(C)C(=O)COc3ccc([N+](=O)[O-])c(C)c3)n2)cc1 22257408 KYCLMPXGXULNMY-UHFFFAOYSA-N 412.402 2.999 5 40 HFBB O=C(O)[C@@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 547873650 RBZGHVAUJFHYGH-LLVKDONJSA-N 416.814 2.609 5 40 HFBB COc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1N1CCCCC1=O 5330200 UFSYIQKEHXESQX-UHFFFAOYSA-N 405.432 2.921 5 40 HFBB CC(C)[C@H](NC(=O)c1ccccc1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 6663996 GKPPBLCBFAYMQS-SFHVURJKSA-N 414.414 2.959 5 40 HFBB COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2N2CCOCC2)cc1[N+](=O)[O-] 20611774 ZQBBNNUXFLRIIT-UHFFFAOYSA-N 402.363 2.601 5 40 HFBB COc1ccc(C)c(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2cccc([N+](=O)[O-])c2)c1 22230005 LOQMEBIFSLFDHM-KRWDZBQOSA-N 419.459 2.704 5 40 HFBB Cc1ccc(C(=O)NCCN2C(=O)S/C(=C/c3ccc([N+](=O)[O-])cc3)C2=O)o1 96594247 KFHSBWUEVANCIX-XNTDXEJSSA-N 401.400 2.963 5 40 HFBB CC[C@H](C(=O)Nc1cccc(C(C)=O)c1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222523316 FSCCVPXYIOVMGQ-GOSISDBHSA-N 419.459 2.981 5 40 HFBB CCOC(=O)c1ccc(Nc2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1 4823007 DQUYGDGROGBWSH-UHFFFAOYSA-N 403.782 2.988 5 40 HFBB CC[C@@H](C)N1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C1=O 8995960 MBRANFPVIJLCSR-PJUBBZNESA-N 414.462 2.763 5 40 HFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 12986324 XOWNWHWJXPEIIB-ZDUSSCGKSA-N 403.460 2.869 5 40 HFBB O=C(NC(=S)Nc1ccc(Cl)cc1C(=O)O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 16384822 LEWZOJABXNEDNK-UHFFFAOYSA-N 424.778 2.981 5 40 HFBB CC(C)Oc1ccc(N(CC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 22390019 CKWQOMVMRDIJON-UHFFFAOYSA-N 407.448 2.787 5 40 HFBB O=C(Nc1ccn(CCc2ccncc2)n1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 60335128 SIGPRWGYGGQWCT-UHFFFAOYSA-N 403.402 2.867 5 40 HFBB CNC(=O)/C(=C/c1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1 1107876 NRYXYKSVAFFBCD-GDNBJRDFSA-N 404.220 2.874 5 40 HFBB COc1cc(-c2nnc(NC(=O)c3ccc([N+](=O)[O-])cc3)o2)cc(OC)c1OC 11025882 XJZRCQPBTVIJMO-UHFFFAOYSA-N 400.347 2.923 5 40 HFBB CCOCCCNc1nnc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])s1 12846980 GDRRMJNOAGWJNL-UHFFFAOYSA-N 418.522 2.840 5 40 HFBB Cc1ccc([N+](=O)[O-])c(NC(=O)CN2CCN(C(=O)c3cccs3)CC2)c1C 12870984 PNHBWBHISFUADS-UHFFFAOYSA-N 402.476 2.670 5 40 HFBB CCN(CC)C(=O)CSc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 951688 LVPBKJLZHXFBFX-UHFFFAOYSA-N 400.400 2.849 5 40 HFBB O=C(NN1C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2C1=O)c1ccncc1 3150497 WKZZZGZSZFEPRA-UHFFFAOYSA-N 404.338 2.723 5 40 HFBB CN(C)S(=O)(=O)c1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)c(Cl)c1 28207991 LSDBUVUHMLWHRH-UHFFFAOYSA-N 413.839 2.516 5 40 HFBB CCOC(=O)c1ccc(N2CCN(C(=O)c3cccc(OC)c3)CC2)c([N+](=O)[O-])c1 408572571 KHLGPPBLHKWEOH-UHFFFAOYSA-N 413.430 2.743 5 40 HFBB CN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2ccccc2c1 7813536 OFHLPPVTMTVGCC-UHFFFAOYSA-N 406.441 2.757 5 40 HFBB COc1ccc(OCCN(C)S(=O)(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 83861028 QWIULVSORHHECC-UHFFFAOYSA-N 405.432 2.784 5 40 HFBB COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)OC(=O)c1ccc(OC)c(OC)c1 6545560 UUPGHGCFMDDBKO-NSHDSACASA-N 404.375 2.805 5 40 HFBB C[C@@H](Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccc(F)cc1 8050844 SJCNGEADWBXRRX-CYBMUJFWSA-N 409.439 2.928 5 40 HFBB Cc1ccc(N2C(=O)N(c3cccc([N+](=O)[O-])c3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1C 8843968 TUSCQTTUPRKLSL-QZTJIDSGSA-N 401.444 2.824 5 40 HFBB COc1ccc(NC(=O)CN(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 8307829 VJQHFRRSQRFLLM-UHFFFAOYSA-N 412.446 2.914 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1C 8433886 SITKZMIOQMYLCT-OAHLLOKOSA-N 411.414 2.746 5 40 HFBB CCn1/c(=N\C(=O)c2cccc(S(C)(=O)=O)c2)sc2cc([N+](=O)[O-])ccc21 13286785 GLEUHSBDBXSXDD-ISLYRVAYSA-N 405.457 2.776 5 40 HFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)Cc1ccc(OC)c(OC)c1 6552957 QVJXLBMYMWFXJY-LBPRGKRZSA-N 418.402 2.734 5 40 HFBB CCOc1cc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1OC 23181854 VZCOZVGQCRJLJL-OKILXGFUSA-N 409.483 2.620 5 40 HFBB CC[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1ccc(OC)cc1)S(C)(=O)=O 220646229 PVCAPNSHRCFPCG-QGZVFWFLSA-N 407.448 2.787 5 40 HFBB CC(C)[C@H](NC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1)C(=O)O 4611178 ONJOBRKDTHKTFV-WQJNHMDYSA-N 411.414 2.591 5 40 HFBB CC(=O)N1CCc2c(sc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])c2C(N)=O)C1 12378152 DAOXHPHIIWMJMD-UHFFFAOYSA-N 422.850 2.566 5 40 HFBB COC(=O)C1=C(C)NC(C)=C(C(=O)OCCSC)[C@H]1c1cccc([N+](=O)[O-])c1 19923900 XDKYGHYOBFIPIG-KRWDZBQOSA-N 406.460 2.909 5 40 HFBB COc1ccc(C(=O)N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1 32831102 ZZFMCIORWIMHFQ-UHFFFAOYSA-N 413.430 2.647 5 40 HFBB C[C@H](OCC(F)(F)F)C(=O)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 43008010 YLKQESJRYMVGLX-LBPRGKRZSA-N 412.368 2.759 5 40 HFBB Cc1cc(C(=O)COc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])c(C)n1C 5207246 XVOFKRPFYYCYCQ-UHFFFAOYSA-N 421.475 2.596 5 40 HFBB O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1cccc(C(=O)NC2CC2)c1 12849837 VPHMDFYVWFGEFQ-UHFFFAOYSA-N 416.821 2.509 5 40 HFBB Cc1cccc(NC(=O)COc2ccc(/C=C\c3nc(O)c([N+](=O)[O-])c(=O)[nH]3)cc2)c1 13847646 UFHAGHZYSFTKAQ-YFHOEESVSA-N 422.397 2.880 5 40 HFBB CCCNS(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OC 14291971 PLHLATBYFXGODM-UHFFFAOYSA-N 407.448 2.852 5 40 HFBB Cc1cc(CN(C)C(=O)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C(C)C)no1 40088956 PHBBNKGFBBKEKI-MRXNPFEDSA-N 408.842 2.958 5 40 HFBB CCOC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 224782352 JJORVICSJKREIQ-UHFFFAOYSA-N 414.386 2.940 5 40 HFBB CCOc1ccc(C(=O)NC(=S)NNc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 408624230 BTJNEKHKMDYCDF-UHFFFAOYSA-N 405.392 2.533 5 40 HFBB COc1ccc(OC)c(NC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3OC)C2)c1 408641755 MPURAFTWXIXLIS-LBPRGKRZSA-N 415.402 2.612 5 40 HFBB Cc1ccc(NC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2)cc1C 8038807 JXEIJEGGBMXGPS-HNNXBMFYSA-N 411.414 2.746 5 40 HFBB CN(C)CCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@H]1c1ccc([N+](=O)[O-])cc1 8374007 YEWBOBUAZANWGS-GOSISDBHSA-N 411.389 2.947 5 40 HFBB O=C(Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc12 40074787 QKFKFXHCBGXRFH-UHFFFAOYSA-N 415.431 2.508 5 40 HFBB O=C(Nc1nnc(-c2ccccc2[N+](=O)[O-])o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 215868046 CNZWEDPVDCKMJW-UHFFFAOYSA-N 400.263 2.714 5 40 HFBB Cc1nn(CC(=O)OCC(=O)c2cc(C)n(Cc3ccco3)c2C)c(C)c1[N+](=O)[O-] 3420466 UDYFNVWRIGZDDJ-UHFFFAOYSA-N 414.418 2.894 5 40 HFBB COC(=O)c1cc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)cc([N+](=O)[O-])c1 6642101 JXMNEBWNEWMBLJ-SFDCBXKLSA-N 406.435 2.868 5 40 HFBB O=C(CF)N[C@@H](NC(=S)Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl 13571530 VLXRSURXOJXMSQ-VIFPVBQESA-N 403.650 2.663 5 40 HFBB COc1ccccc1N1CCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 27580347 VUFVCFISWSAAIK-UHFFFAOYSA-N 412.490 2.934 5 40 HFBB COC(=O)c1ccc(S(=O)(=O)Nc2cnc3c(cnn3C(C)C)c2)c([N+](=O)[O-])c1 32097903 ATCVTLKALSUXSI-UHFFFAOYSA-N 419.419 2.508 5 40 HFBB O=[N+]([O-])c1ccc(N[C@H]2CCc3ccccc32)c(S(=O)(=O)N2CCOCC2)c1 32853527 UJABCLCRSVIZGZ-KRWDZBQOSA-N 403.460 2.715 5 40 HFBB CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)OCC(=O)c1ccc[nH]1 6778288 HGLBKCBDYGIQSA-INIZCTEOSA-N 407.810 2.757 5 40 HFBB C[C@H](c1ccccc1)N1C[C@@H](C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 7232524 OOEANLOYLASTTJ-ZBFHGGJFSA-N 411.414 2.686 5 40 HFBB Cc1ccc(CN(C)c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)cc1 12597884 YLJNHNJAJNDACK-UHFFFAOYSA-N 405.476 2.561 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O 24068365 UPRGVKRJQPWFEH-FKIZINRSSA-N 402.451 2.979 5 40 HFBB Cc1cc(S(=O)(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c([N+](=O)[O-])s1 1561425979 PPTYLQDHSDOIJB-GHMZBOCLSA-N 419.525 2.983 5 40 HFBB Cc1cccc(N2C(=O)N(c3ccc([N+](=O)[O-])cc3)[C@H]3CS(=O)(=O)C[C@@H]32)c1C 4393627 PPNGIYAGNYOUGD-ROUUACIJSA-N 401.444 2.824 5 40 HFBB COc1cccc(NC(=O)[C@@H](C)OC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1 6587767 DBWVXTTWCCAROX-LLVKDONJSA-N 402.359 2.559 5 40 HFBB O=C1Nc2ccccc2S[C@H]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 8030604 KGNMZONLJHWONJ-SFHVURJKSA-N 412.471 2.747 5 40 HFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O 10331692 YTQHSFIRQXBDHT-UHFFFAOYSA-N 422.419 2.525 5 40 HFBB COc1cccc(N([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)c1 220171283 FAOLLDYCUZTMNT-CYBMUJFWSA-N 407.448 2.705 5 40 HFBB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])cc(OCC)c2O)C1=O 409014369 PAMQMUOMNRIOSI-PBJWJZLWSA-N 410.404 2.687 5 40 HFBB CNc1ccc(C(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)cc1[N+](=O)[O-] 12587529 RRIMXLBYXJLFGS-RYUDHWBXSA-N 405.480 2.955 5 40 HFBB COc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 12977669 URJNSYJFTGVQRI-HNNXBMFYSA-N 420.443 2.900 5 40 HFBB CC(C)C(=O)N1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 14042888 XQKXRVRHRMJTAG-UHFFFAOYSA-N 416.400 2.742 5 40 HFBB CC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3C)C(=O)[C@H]2[C@H]2C=Cc3ccccc3N12 103913543 DXVZRCABYVDXEY-PLACYPQZSA-N 417.421 2.882 5 40 HFBB COCCCn1c(-c2cccc([N+](=O)[O-])c2)nc2c(c(=O)c3ccccc3n2C)c1=O 2210833 MFHNCOYRAVGNJW-UHFFFAOYSA-N 420.425 2.860 5 40 HFBB Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 6084137 WBIRURRMIWFGRV-IBGZPJMESA-N 416.821 2.962 5 40 HFBB O=C1[C@@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)N1CCCN1[C@@H]2c1ccc(Cl)cc1 100765530 PSIPYZBNSNOTQZ-KSZLIROESA-N 412.833 2.784 5 40 HFBB CC(C)(C)SCCNC(=O)CCCN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 222362500 HOSGNCZFUUTBGK-UHFFFAOYSA-N 417.553 2.789 5 40 HFBB O=[N+]([O-])c1cccc(-n2cccc2[C@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1 223589155 QCYSYABARBKDJB-MOPGFXCFSA-N 409.471 2.745 5 40 HFBB COC(=O)c1ccc([C@@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4ccccc43)[C@@H]2[N+](=O)[O-])cc1 408567775 RHYRRVXJDJJTPF-JZJXAQOMSA-N 407.426 2.528 5 40 HFBB COc1cc(Cl)c([C@@H]2CN(C)[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC 408567828 RPAMAYVIJGLZTE-OPURJYLOSA-N 417.849 2.879 5 40 HFBB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 4569696 VTDGFFFDPIEHAR-GOSISDBHSA-N 417.487 2.795 5 40 HFBB O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccccc2Cn2cccn2)ccc1Cl 10958955 GMHFJKABKPDIPZ-UHFFFAOYSA-N 406.851 2.972 5 40 HFBB CN(CCc1ccccn1)c1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] 6911117 ZBKXGXJBTLLYGZ-UHFFFAOYSA-N 404.492 2.843 5 40 HFBB COc1cc(/C=C2/NC(=S)NC2=O)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 9296716 OMDUEQZJHOAMNO-IZZDOVSWSA-N 416.371 2.649 5 40 HFBB CS(=O)(=O)c1ccc(C(=O)OCc2cc(Cl)c3c(c2)OCO3)cc1[N+](=O)[O-] 11322841 JRYHGABBYCJHIS-UHFFFAOYSA-N 413.791 2.737 5 40 HFBB CCCc1ccc([C@H](C)N(CC(N)=O)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 58154961 WWPGKDUECLLYBT-AWEZNQCLSA-N 405.476 2.785 5 40 HFBB COc1ccccc1N1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 4882842 HIRJSYDQBXMEQL-UHFFFAOYSA-N 411.867 2.768 5 40 HFBB Cc1ccc(N2C[C@H](C(=O)OCC(=O)Nc3ccc(F)cc3[N+](=O)[O-])CC2=O)cc1 5975778 VDZXQHMAJCAELV-CYBMUJFWSA-N 415.377 2.577 5 40 HFBB CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OC 13581427 JHSRABDJPNQLEH-UHFFFAOYSA-N 407.448 2.886 5 40 HFBB C[C@H](OC(=O)C1CCN(C(=O)C(C)(C)C)CC1)C(=O)Nc1cccc([N+](=O)[O-])c1 14246771 LTKIEBILAQDBSB-ZDUSSCGKSA-N 405.451 2.750 5 40 HFBB NS(=O)(=O)c1ccc2nc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])sc2c1 17170485 UXDMCTDZOJVLLM-UHFFFAOYSA-N 412.836 2.758 5 40 HFBB COc1ccc(N2C[C@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)c(OC)c1 5535445 JSNVDBVJMVHOQL-CQSZACIVSA-N 400.387 2.708 5 40 HFBB CC(C)[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 8124458 DBYMDHRODAPAQZ-HXUWFJFHSA-N 413.430 2.609 5 40 HFBB O=[N+]([O-])c1cccc([C@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)c1 10232642 PVVPQOWTACVCDK-INIZCTEOSA-N 406.337 2.578 5 40 HFBB CCOC(=O)CN1C(=O)S/C(=C/c2cccn2-c2cccc([N+](=O)[O-])c2)C1=O 205696964 QURHUEAQXLEZBQ-XNTDXEJSSA-N 401.400 2.985 5 40 HFBB Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)cc1[N+](=O)[O-] 14870519 FYPOCTVIVJXFLI-AWEZNQCLSA-N 419.459 2.613 5 40 HFBB C[C@@H](Sc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc([N+](=O)[O-])c1 24271083 HRMGBMXRBJNGPW-CQSZACIVSA-N 422.532 2.779 5 40 HFBB COc1cccc(NC(=O)CCCN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 222684540 ICDCXNMSHVWIPH-UHFFFAOYSA-N 407.448 2.788 5 40 HFBB Cc1cc(C)nc(N/C=C(\[N+](=O)[O-])S(=O)(=O)c2ccc(OC(F)(F)F)cc2)n1 2561560 IDWCMTZTIUMHPE-MDWZMJQESA-N 418.353 2.953 5 40 HFBB C[C@]1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1=O 3456916 MEMJTHWQJSWGID-GOSISDBHSA-N 420.784 2.793 5 40 HFBB CCN(CC)S(=O)(=O)c1ccc(NC[C@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 5693967 ORHCLFQJXKDVGL-AWEZNQCLSA-N 421.475 2.877 5 40 HFBB CC[C@H](C(=O)NC)N(Cc1ccccc1)C(=O)COc1ccc([N+](=O)[O-])c(OC)c1 222959517 ODNUIIMCUSYHDT-QGZVFWFLSA-N 415.446 2.536 5 40 HFBB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@H](c1ccc([N+](=O)[O-])cc1)N=2 408731490 LBKSXMSUSCWRSY-OLMDTSMNSA-N 415.471 2.567 5 40 HFBB