smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCN(CC)CCn1nc2c3ccc(Cl)cc3sc3c(C)ccc1c32 2006085 NGZVEPBBEAOJNA-UHFFFAOYSA-N 371.937 5.708 5 1 FKBF O=[N+]([O-])c1cc2nc(C3(c4ccc(Cl)cc4)CCC3)[nH]c2cc1Cl 587074584 BIZLWJAYFGLORA-UHFFFAOYSA-N 362.216 5.248 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)c(F)cc3[nH]2)ccc1Cl 587048343 SSZGSZBNESPTMD-RQOWECAXSA-N 352.152 5.087 5 1 FKBF O=[N+]([O-])c1ccc(Cc2nc3cc4ccccc4cc3[nH]2)cc1C(F)(F)F 6584551 UXKBPVNGOWRNSR-UHFFFAOYSA-N 371.318 5.234 5 1 FKBF COc1ccc([C@@H]2c3c(cccc3[N+](=O)[O-])N[C@H](c3ccccc3)[C@H]2C)cc1 96913188 CFXJNXLZSORNOH-XFEAKLGESA-N 374.440 5.538 5 1 FKBF O=C(c1c(-c2ccccc2Cl)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F 587645190 KQOGVFQMTOJOJI-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF COc1ccccc1-c1ccc(-c2nc3cc(C)c([N+](=O)[O-])cc3[nH]2)cc1 587933448 XWFUEUQIBXHNNY-UHFFFAOYSA-N 359.385 5.122 5 1 FKBF O=[N+]([O-])c1cc(Cl)c(-c2ccccc2Nc2ccccc2)c(Cl)c1 1857607350 YYVVKIITMJYNKJ-UHFFFAOYSA-N 359.212 6.312 5 1 FKBF CC(C)(C)c1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 587048625 XUMBQFQDZHFIQO-WEVVVXLNSA-N 355.825 5.592 5 1 FKBF CCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1 1772603022 NPVQURQHCIOUSB-UHFFFAOYSA-N 361.397 5.375 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3cccc(F)c3)c(-c3ccc(Cl)cc3)c12 587645544 CAMIYANSEPHHJM-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF C[N@@+]12CCCC[C@@H]1[C@H](CN1c3ccccc3Sc3ccccc31)CCC2 254103652 WHBJMLSMNQEBKY-HCYUJWNOSA-N 365.566 5.698 5 1 FKBF Brc1cccc(Nc2ncnc3cc4ccccc4cc23)c1 3815025 BUVKJPOCMOXSSQ-UHFFFAOYSA-N 350.219 5.289 5 1 FKBF in-vivo O=C(c1coc2cc([N+](=O)[O-])ccc12)C1c2ccccc2Oc2ccccc21 587280541 ZISQWFUUSUUHDQ-UHFFFAOYSA-N 371.348 5.462 5 1 FKBF CCCN1CCC(COc2nc3ccc(F)cc3c3ccccc23)CC1 95574674 OQMJNWOPPJTWQA-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cccc(-c4ccc(O)cc4)c3)[nH]c2cc1Cl 586898380 JNNJTRFXOFHXBJ-UHFFFAOYSA-N 365.776 5.164 5 1 FKBF O=[N+]([O-])c1ccc(CCc2c(-c3ccccc3)[nH]c3cc(F)ccc23)cc1 587635763 MVZQMJCGQDPBDS-UHFFFAOYSA-N 360.388 5.667 5 1 FKBF CC(C)=CCOc1cc(O)c2c(=O)c3ccccc3oc2c1CC=C(C)C 28650402 PWWDPCAOXPAFOV-UHFFFAOYSA-N 364.441 5.506 5 1 FKBF CC(C)[C@H](C(=O)c1coc2cc([N+](=O)[O-])ccc12)c1ccc(Cl)cc1 587280235 PDYPPWCQCLRLKD-SFHVURJKSA-N 357.793 5.617 5 1 FKBF COc1ccc(-c2cc(Cl)cc3c(=O)c4ccccc4n(C)c23)cc1F 15935756 ODNHMWXOVUUPOH-UHFFFAOYSA-N 367.807 5.160 5 3 FKBF Cc1cc(Sc2c([N+](=O)[O-])cccc2[N+](=O)[O-])c(Cl)cc1Cl 40846257 QEBIDPPNEFUJQD-UHFFFAOYSA-N 359.190 5.269 5 1 FKBF Oc1ccc(CCNc2nc3ccc(F)cc3c3[nH]c4ccccc4c23)cc1 45358684 WXMRCIWKISHGRA-UHFFFAOYSA-N 371.415 5.369 5 1 FKBF Cc1nc(C2CC2)sc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587013006 VLJPPYGLWPEXGY-UHFFFAOYSA-N 355.466 6.179 5 1 FKBF Cc1cccc([C@@H](C[N+](=O)[O-])c2c(-c3ccccc3)[nH]c3ccccc23)c1 2382231646 RLECFWKZCDJCDQ-HXUWFJFHSA-N 356.425 5.552 5 1 FKBF O=[N+]([O-])c1ccc(/C=C/C2=NN(c3ccccc3)[C@@H](c3ccco3)C2)cc1 971139 CZVIDOWCYBCYFZ-OJLWIZQOSA-N 359.385 5.209 5 3 FKBF CCc1ccc(-c2nc3c([N+](=O)[O-])cc(Br)cc3[nH]2)cc1CC 586880180 OMNSGRWHFHILDG-UHFFFAOYSA-N 374.238 5.025 5 1 FKBF CC(=O)c1ccc(-c2cccc(-c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)c2)cc1 586881696 ZBGLLQUJHSTHPX-UHFFFAOYSA-N 371.396 5.316 5 1 FKBF CC(C)=CCOc1ccc2c(=O)c3ccccc3oc2c1OCC=C(C)C 103220309 WMRCBHCWDRAHPZ-UHFFFAOYSA-N 364.441 5.636 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C(=C/c3ccc(F)cc3)c3cccs3)[nH]c12 587162396 AJKXNYRRAXXJKL-SDNWHVSQSA-N 365.389 5.261 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C/c3ccccc3Oc3ccccc3)[nH]c12 587951378 ZDJNUDHIOKHHBC-BUHFOSPRSA-N 357.369 5.434 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2c(F)cccc12 1857618403 YXJNVFDRPMWEMO-GOSISDBHSA-N 360.388 5.383 5 1 FKBF Cc1cc2[nH]c(-c3csc(-c4ccc(Cl)cc4)n3)nc2cc1[N+](=O)[O-] 587015967 LNMLAHOFYMBKHS-UHFFFAOYSA-N 370.821 5.223 5 1 FKBF O=[N+]([O-])c1cccc([C@H]2Nc3ccccc3-c3cc(-c4ccccc4)nn32)c1 169702032 IBSLRCXTUSXLEK-QFIPXVFZSA-N 368.396 5.098 5 1 FKBF Cc1cc2[nH]c(/C=C/c3ccccc3Oc3ccccc3)nc2cc1[N+](=O)[O-] 587949183 AAKGLVKNNVJEKN-VAWYXSNFSA-N 371.396 5.742 5 1 FKBF c1cc2ccc3ccc4c5cccc6ccc7ccc8c(c1)c2c3c4c8c7c65 104923703 VEABCKAXWWRBAF-UHFFFAOYSA-N 350.420 8.072 5 1 FKBF biogenic Fc1ccc2c(c1)C[C@H]1CCCN1[C@@H]2c1cccc2ccc3ccccc3c12 963104436 UJABUPIDDNSANI-RLWLMLJZSA-N 367.467 6.242 5 1 FKBF CC(C)(C)CC(C)(C)c1ccc(O)c(C(=O)Nc2cccc([N+](=O)[O-])c2)c1 45229169 XIVQKJUMKNDSID-UHFFFAOYSA-N 370.449 5.267 5 1 FKBF CN(c1ccccc1)[C@@H](c1cccc([N+](=O)[O-])c1)c1c[nH]c2ccccc12 71341385 SEIMEJUTESNORB-QFIPXVFZSA-N 357.413 5.302 5 1 FKBF Cc1cc(-c2ccc(-c3ccccc3)cc2)cc2c3ccccc3c[n+](C)c12 1857537722 XUYRMEWSVQWEKW-UHFFFAOYSA-N 360.480 6.460 5 1 FKBF c1ccc2c(c1)C[C@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)S2 587043621 UHUYKIMSYJRDNS-HXUWFJFHSA-N 352.462 6.259 5 1 FKBF CC1=CC[C@H](C(C)C)c2cc(C)c(OC(=O)c3ccc([N+](=O)[O-])cc3)cc21 1772652351 KJCLYDMVAHSAOU-GOSISDBHSA-N 365.429 5.669 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4c(F)cc(F)cc4[nH]3)cc2)cc1 587272529 UNLJRKZLOZVZHS-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF CCCN1[C@@H](C)Cc2ccccc2[C@@]1(C)c1cc([N+](=O)[O-])c(Cl)s1 963230488 PSCNILFUFPOVRS-SGTLLEGYSA-N 364.898 5.230 5 1 FKBF CCCCNc1c(-c2c3ccccc3cc3ccccc23)nc2ccccn12 95563168 AKNAIPDPEKIOIB-UHFFFAOYSA-N 365.480 6.520 5 1 FKBF Cc1c(-c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)cccc1[N+](=O)[O-] 587105187 RQZCQPUSPLUPTL-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF O=[N+]([O-])c1ccc(CCSc2nc3c(Cl)cc(Cl)cc3[nH]2)cc1 136484842 XVQGDVWBWXVQCW-UHFFFAOYSA-N 368.245 5.113 5 1 FKBF C[N@+]12C=CC=C1[C@@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 254194043 WPEKCJPMSAXMJK-XXBNENTESA-N 355.914 5.567 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3ccc4c(c3[nH]2)CCCC4)ccc1Cl 587048818 YUBSJAAGABWCBP-UXBLZVDNSA-N 353.809 5.174 5 1 FKBF C[C@]1(c2ccc(Cl)c([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587501387 AMRFPYNFKJMJPL-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF COc1ccc(-c2[nH]c3cc(F)ccc3c2-c2ccccc2[N+](=O)[O-])cc1 587634879 AMJDZIXSJAZJRG-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF CCC(=O)c1c(-c2ccc(Br)cc2)[nH]c2cccc([N+](=O)[O-])c12 587644257 RQVQSTMMIMDWKK-UHFFFAOYSA-N 373.206 5.098 5 1 FKBF CCc1c(-c2ccc(Br)c(C)c2)[nH]c2cc([N+](=O)[O-])ccc12 587644264 SCTRUQQDRGUBML-UHFFFAOYSA-N 359.223 5.376 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)cc(F)c3[nH]2)ccc1Cl 587047505 JIBAEUYCXLJQSI-DUXPYHPUSA-N 352.152 5.087 5 1 FKBF CCOc1ccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)cc1 1772575764 XEMVAFYJSPRZLS-UHFFFAOYSA-N 368.436 5.709 5 1 FKBF COc1ccc([C@@H]2c3ccc([N+](=O)[O-])cc3N[C@H](c3ccccc3)[C@H]2C)cc1 96914916 JMUYOBNPRAEQDK-BJQRDSPESA-N 374.440 5.538 5 1 FKBF c1ccc2c(c1)cc1c3ccccc3nc(-c3ccc(-c4ccncc4)cc3)n21 49112638 IFCMYMNJFGXONO-UHFFFAOYSA-N 371.443 6.370 5 1 FKBF Cc1c(-c2cccc([N+](=O)[O-])c2)nc2cccc3c2c1-c1ccccc1C3=O 587105061 MQMUTUNRXJMYGB-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(-c3ccc(Cl)cc3)c12 587645863 MVZSDKZZTKUMDS-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF CCCC(Br)(CCC)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 586971483 SNLSYGXEQNDADI-UHFFFAOYSA-N 374.666 5.315 5 1 FKBF C[C@@H](SCc1ccccc1)c1nc2c3cccnc3c3ncccc3c2[nH]1 586960250 AFALJFKJESAZEX-CQSZACIVSA-N 370.481 5.654 5 1 FKBF CC(C)(C)c1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2n1 587265592 QVBXTMXZKWKJGI-UHFFFAOYSA-N 362.389 5.091 5 1 FKBF Cc1cc2nc(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2cc1C 587272408 SBKAQQNBPLXDRT-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF O=[N+]([O-])c1ccc(-c2[nH]c3cccc(F)c3c2-c2nc3ccccc3[nH]2)cc1 587635702 LXFQTAAYHLSILZ-UHFFFAOYSA-N 372.359 5.426 5 1 FKBF COc1c(F)cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1F 587135061 RMQOWLFJDLRMRO-UHFFFAOYSA-N 360.363 5.823 5 1 FKBF Cc1cc2c3nc4cc(OCc5ccccc5)ccc4c-3ccn2nc1C 377819922 HKYOKSQMBWTRFB-UHFFFAOYSA-N 353.425 5.183 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cccc(C(F)(F)F)c3[nH]2)ccc1Cl 587047357 HKBFBNZULMBLQG-ALCCZGGFSA-N 367.714 5.314 5 1 FKBF Cc1cc2[nH]c(/C=C\c3ccccc3Oc3ccccc3)nc2cc1[N+](=O)[O-] 587949182 AAKGLVKNNVJEKN-QXMHVHEDSA-N 371.396 5.742 5 1 FKBF CC(C)(C)c1cccc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 587269438 CNYFVYJZOUPLTJ-UHFFFAOYSA-N 372.428 5.498 5 1 FKBF O=[N+]([O-])c1cc(C2(N3CCCCC3)CCCCC2)sc1Br 1657849 SCVGGNFLOOULSW-UHFFFAOYSA-N 373.316 5.064 5 1 FKBF CCOC(=O)c1sc(SC)c2c1ccc1c3cc(OC)ccc3[nH]c12 29464874 YJQKVNAAQNOZFN-UHFFFAOYSA-N 371.483 5.443 5 1 FKBF CC(C)COC(=O)c1ccc2c3cccc4cccc(c5cccc1c52)c43 71789535 RJJMUBCQVFZMOG-UHFFFAOYSA-N 352.433 6.550 5 1 FKBF Cc1c2ccn(C)cc2c(C)c2c1nc1ccc(OCC(F)(F)F)cc12 377422666 APJWEHXABABSIC-UHFFFAOYSA-N 358.363 5.438 5 1 FKBF Cc1ccc2c(Cc3c4ccccc4nc4ccccc34)cc(=O)oc2c1 64528210 ZXYYWYGVDHFVRT-UHFFFAOYSA-N 351.405 5.394 5 1 FKBF CC/C=C/c1cc2c(cc1Br)c(=O)oc1c(C)c(O)ccc12 28571645 SRRGDPQTGBTWFA-SNAWJCMRSA-N 359.219 5.146 5 1 FKBF Cc1cc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c2cc1Cl 587270961 YEHBWOMUPHCUBX-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF CCCCn1c(=O)c2ccccc2c2cc(CCc3ccccc3)ccc21 49068839 IVFRNWQKVIJARH-UHFFFAOYSA-N 355.481 5.740 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(Cl)cc3)c(-c3ccc(F)cc3)c12 587646016 QHNIZZZKDCBJDU-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF Cc1ccc2[nH]c(-c3ccccc3)c([C@@H](C[N+](=O)[O-])c3cccs3)c2c1 1857569610 BAYYZHGISOMSMK-KRWDZBQOSA-N 362.454 5.613 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccc(C(F)(F)F)cc2c2ccccc12 169339397 IMIVAWPBXCYUSL-KKSFZXQISA-N 373.418 5.577 5 1 FKBF CCCOc1cccc(Cc2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587779119 VAQIFFYWKDBPSP-UHFFFAOYSA-N 368.440 5.039 5 1 FKBF COc1ccccc1N=c1c2ccccc2n(C)c2c1oc1ccccc12 1772587916 CWLDNFUDIJCALQ-UHFFFAOYSA-N 354.409 5.319 5 1 FKBF CC(C)c1cc(-c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)c(O)c(C(C)C)c1 586896145 HVDPWBFQXJRFMD-UHFFFAOYSA-N 373.840 5.744 5 1 FKBF O=C(Cc1c(Cl)cccc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587279870 FLDZISGPFIMVAY-UHFFFAOYSA-N 350.157 5.073 5 1 FKBF COc1cc2c3c(c1)O[C@H](c1cccc4ccc5ccccc5c14)[C@@H](C2)C3=O 587447343 QJTBEXWCDPSPRS-NBGIEHNGSA-N 366.416 5.490 5 1 FKBF CC(C)=CCC/C(C)=C\c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587966676 DNUKUBYECQDMRZ-XFFZJAGNSA-N 364.243 5.383 5 1 FKBF O=C1CC[C@H](N(Cc2ccc([N+](=O)[O-])cc2)C2CCCC2)c2ccccc21 40847593 DPYYBAUSNAALQN-NRFANRHFSA-N 364.445 5.057 5 1 FKBF Cc1ccc(-c2c(-c3ccc(Cl)cc3)[nH]c3cc([N+](=O)[O-])ccc23)cc1 587644577 FVOLEFGJYSGYNC-UHFFFAOYSA-N 362.816 6.372 5 1 FKBF C[n+]1c2ccccc2c(Nc2ccc(F)cc2F)c2[nH]c3ccccc3c21 1772576920 AEDRLFWZWQYSSC-UHFFFAOYSA-O 360.387 5.321 5 1 FKBF O=C(Cc1ccc(Cl)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587071914 NLYLOYWMTWVQSO-UHFFFAOYSA-N 370.839 5.948 5 1 FKBF O=C(c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1coc2ccc(Cl)cc12 587279033 URIANDBUNKJLAG-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF CCc1c(-c2ccc(Br)c(C)c2)[nH]c2cccc([N+](=O)[O-])c12 587644228 QVMPLHXWXYKULX-UHFFFAOYSA-N 359.223 5.376 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=NCc3ccc(C)cc3)c2c1 653707183 RWIZHVXZPSMXNA-UHFFFAOYSA-N 362.860 5.392 5 1 FKBF COc1cc(F)c2c(=O)c3ccc(Nc4ccc(Cl)cc4)cc3[nH]c2c1 1911577123 DWECUPDICGKQPJ-UHFFFAOYSA-N 368.795 5.226 5 1 FKBF O=[N+]([O-])c1ccc(-c2c(Nc3ccccc3)cccc2-c2ccccc2)cc1 1857603649 BRRUKIYNWOSCHA-UHFFFAOYSA-N 366.420 6.672 5 1 FKBF CCn1c2ccccc2c2c3c(c4c5ccccc5n(CC)c4c21)C(=O)NC3 29569917 SBFVKANENMMCOE-UHFFFAOYSA-N 367.452 5.186 5 1 FKBF O=[N+]([O-])c1ccc(Nc2cccc(NC(=S)Oc3ccccc3)c2)cc1 34778403 FXKRNUMPVDGWKY-UHFFFAOYSA-N 365.414 5.114 5 1 FKBF CC(=O)n1c2ccccc2sc2cc(C(F)(F)F)ccc2n1C(C)=O 139717983 YPRAIJVRPSGJBP-UHFFFAOYSA-N 366.364 5.121 5 1 FKBF Cc1ccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)cc1F 1772578037 VZYZXLQMJKOSPJ-UHFFFAOYSA-O 356.424 5.490 5 1 FKBF O=C(CCC[N@+]1([O-])CC=C(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 299853782 PYOCZQLGNLJDON-DEOSSOPVSA-N 373.855 5.244 5 1 FKBF Cc1cccc2c1ccc1c3c(ccc12)[C@](C)([C@H](C)CCCC(C)C)CC3 111475553 KUPQKNLBQPAEEE-HRFSGMKKSA-N 358.569 7.968 5 1 FKBF biogenic CCCCCNc1nnc(NCCCCC)c2cc3ccccc3cc12 53294923 FORWCJLHTHCVTL-UHFFFAOYSA-N 350.510 5.987 5 1 FKBF CN(c1ccccc1)[C@H](c1cccc([N+](=O)[O-])c1)c1c[nH]c2ccccc12 71341386 SEIMEJUTESNORB-JOCHJYFZSA-N 357.413 5.302 5 1 FKBF Cc1[nH]c2cccc(F)c2c1-c1ccc(OC(F)(F)F)cc1[N+](=O)[O-] 587633689 ITUWHPUNRPPNKZ-UHFFFAOYSA-N 354.259 5.089 5 1 FKBF O=[N+]([O-])c1cccc(-c2[nH]c3cccc(F)c3c2-c2nc3ccccc3[nH]2)c1 587636057 PLWUCGIRXBKJMR-UHFFFAOYSA-N 372.359 5.426 5 1 FKBF CCCN1[C@H](C)Cc2ccccc2[C@@]1(C)C(C)(C)c1ccc([N+](=O)[O-])cc1 963223750 DFPCAGCCCRFXPA-HXOBKFHXSA-N 366.505 5.444 5 1 FKBF O=Cc1c2ccc(Br)cc2n2ccc3c4ccccc4[nH]c3c12 14440779 YBDSCGIHRMVHBL-UHFFFAOYSA-N 363.214 5.302 5 1 FKBF biogenic c1ccc2c(c1)CC[C@]21C[C@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 586893481 ZKAUUNWUMYUZSE-UUOWRZLLSA-N 362.436 5.031 5 1 FKBF CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)c1coc2cc([N+](=O)[O-])ccc12 587279401 JBTSSBFKJIMFHK-FRIZHTMISA-N 359.422 5.001 5 1 FKBF COc1cc2c(c3c1c(=O)c1cc4ccccc4cc1n3C)C=CC(C)(C)O2 3941442 UOISCARHVYSQMT-UHFFFAOYSA-N 371.436 5.038 5 1 FKBF c1cc2ccc3ccc(CNCCCNC4CCCCC4)c4ccc(c1)c2c34 26470666 FGBNUQFZBWIAKS-UHFFFAOYSA-N 370.540 5.986 5 1 FKBF CCN(CC)c1cccc(OCc2cc(=O)oc3ccc4ccccc4c23)c1 103201538 HOGGXCFDTHZEAR-UHFFFAOYSA-N 373.452 5.371 5 1 FKBF Cc1cc2c(C(C)C)ccc(C)c2cc1OC(=O)c1ccc([N+](=O)[O-])cc1 1772587754 UUVMQFUVHBHECE-UHFFFAOYSA-N 363.413 5.707 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C(=C\c3ccc(F)cc3)c3cccs3)[nH]c12 587162393 AJKXNYRRAXXJKL-KAMYIIQDSA-N 365.389 5.261 5 1 FKBF CC[C@H](C)c1ccc(NC(=O)c2c(C)[nH]c3cc([N+](=O)[O-])ccc23)cc1 587647315 VLQPTQMJBIRGPL-LBPRGKRZSA-N 351.406 5.150 5 1 FKBF C[C@H](Oc1ccc2ccccc2c1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587951357 KOYGOURAECMHFV-NSHDSACASA-N 367.792 5.418 5 1 FKBF O=C(c1cc2cc(Cl)ccc2s1)c1coc2cc([N+](=O)[O-])ccc12 587280344 BDRJWULGQPAMSK-UHFFFAOYSA-N 357.774 5.440 5 1 FKBF O=c1c2ccccc2oc2c1c(O)cc1oc(-c3ccc(Cl)cc3)nc12 1857752222 JBPOVLRGZXQMLZ-UHFFFAOYSA-N 363.756 5.113 5 1 FKBF Fc1ccc(-c2csc(-c3c4ccccc4cc4ccccc34)n2)cc1F 587922079 JNUJSDYPHVOFIK-UHFFFAOYSA-N 373.427 7.062 5 1 FKBF CCCCOc1ccc(C(=O)c2coc3ccc(Cl)cc23)cc1[N+](=O)[O-] 587276969 XUPOYYWQXCJWLJ-UHFFFAOYSA-N 373.792 5.404 5 1 FKBF CC(C)=CCC[C@H](C)C=CC=C(C)C(=O)NC[C@@H]1CC[N@@+]2(C)CCCC[C@H]12 2356697749 OIRGOJBSVAJDRX-LDXFMPRXSA-O 373.605 5.007 5 1 FKBF CCc1ccc([C@@H](Nc2ccc(C)c([N+](=O)[O-])c2)[C@@H]2CCCCC2=O)cc1 66262518 WJZLDUFERLJEHF-DENIHFKCSA-N 366.461 5.378 5 1 FKBF OCC12CCC(c3nc4c5ccccc5c5ccccc5c4[nH]3)(CC1)CC2 586895556 MLHIUCFKMIQPIT-UHFFFAOYSA-N 356.469 5.454 5 1 FKBF Cc1ccc(S(=O)(=O)n2c3ccccc3c3ccc4ccccc4c32)cc1 96937733 WLYSGIPQBQNUKX-UHFFFAOYSA-N 371.461 5.493 5 1 FKBF CC[N+](CC)(CC)Cc1ccc2oc(-c3ccccc3Cl)cc(=O)c2c1 103216462 GDNZVRYNTZJNGZ-UHFFFAOYSA-N 370.900 5.490 5 1 FKBF c1cnc2c(c1)c1nc(-c3ccc(C4CCC4)cc3)[nH]c1c1cccnc12 586881963 YGITZWCFYLUWDJ-UHFFFAOYSA-N 350.425 5.594 5 1 FKBF Cc1sc2c(c1C)CCN[C@@H]2c1ccccc1-c1cccc([N+](=O)[O-])c1 963014806 VILWAYCTIFKAHH-HXUWFJFHSA-N 364.470 5.175 5 1 FKBF O=[N+]([O-])c1cc2nc(CCCCCCCCCCCO)[nH]c2cc1Cl 586894611 ONWZFFXLASKGAD-UHFFFAOYSA-N 367.877 5.170 5 1 FKBF CC(C)=CCC[C@H](C)C=CC=C(C)C(=O)NC[C@@H]1CC[N@+]2(C)CCCC[C@H]12 2356697751 OIRGOJBSVAJDRX-PFMZIPKWSA-O 373.605 5.007 5 1 FKBF CC[N+](CC)(CC)CCCCCCCCCCCC[N+](CC)(CC)CC 13679884 PAXLJBJIRDJUTN-UHFFFAOYSA-N 370.710 6.640 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c3ccccc3cc3ccccc13)O2 587405371 KYHLDSQHVCNAPE-RUZDIDTESA-N 367.448 5.764 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=Nc3ccccc3Cl)c2n1 1772583535 UUKFRMXERALLSK-UHFFFAOYSA-N 370.239 5.264 5 1 FKBF CC1(C)CCSc2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc21 1857567462 SLWHSLTYWSGZAI-UHFFFAOYSA-N 373.503 5.177 5 1 FKBF Cc1cccc(-c2ccc(Cl)cc2)c1-c1nc2ccc([N+](=O)[O-])cc2[nH]1 587074222 TURDUJCSMPRQPA-UHFFFAOYSA-N 363.804 5.767 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccccc2c2cc(C(F)(F)F)ccc12 169339414 XNKDPYCWUQDKAX-IIBYNOLFSA-N 373.418 5.577 5 1 FKBF Cc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)oc2c1[C@H](O)CCC2 586904379 UFLGYMAKADMGKY-GOSISDBHSA-N 368.436 5.807 5 1 FKBF CCCCCCc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 45348210 DZWQHRCORBLGPW-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF O=[N+]([O-])c1cccc(-[c-]2ccc3nc(=S)n(Cc4ccccc4)c-3c2)c1 169717100 UVGJILRTGZOKKY-UHFFFAOYSA-N 360.418 5.060 5 1 FKBF C[C@@H](NCc1ccc2ccc3cccc4ccc1c2c34)[C@H](O)c1ccccc1 26474202 LASREJVYHBUIFM-QUGAMOGWSA-N 365.476 5.796 5 1 FKBF Cc1ccc(C(=O)C[C@@H](Nc2ccc([N+](=O)[O-])cc2)c2ccsc2)cc1 49803403 HEVNCDKNAJNJPY-LJQANCHMSA-N 366.442 5.391 5 1 FKBF Clc1ccc(-c2cc3nc(N4CCCC4)c4ccccc4c3nn2)cc1 28760286 OWZFGYUXOZBYSM-UHFFFAOYSA-N 360.848 5.099 5 1 FKBF COc1ccccc1NCc1cc(=O)oc2cc3oc4ccccc4c3cc12 35931283 VVIKQVODDMCZOV-UHFFFAOYSA-N 371.392 5.313 5 1 FKBF CC(C)=CCc1c(O)c(CC=C(C)C)c2[nH]c3ccccc3c(=O)c2c1O 238762567 YJXSGTZSGZPDFU-UHFFFAOYSA-N 363.457 5.110 5 1 FKBF CCc1ccc2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1 587272443 SLEQFQNDSVCEHP-UHFFFAOYSA-N 359.385 5.493 5 1 FKBF CC(C)Sc1ccc(CC(=O)c2coc3cc([N+](=O)[O-])ccc23)cc1 587279777 AHZQOCHROHYMDE-UHFFFAOYSA-N 355.415 5.267 5 1 FKBF Cc1c(-c2ccc(Br)cc2Cl)[nH]c2cccc([N+](=O)[O-])c12 587644318 ULRICFWBGUUQPD-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4cccc(N)c4)cc3)[C@@H]1C2 95558145 LRTWHHSAUJFCED-UPVQGACJSA-N 361.553 5.505 5 1 FKBF O=C(c1ccc(-c2ccc(Cl)cc2)o1)c1coc2cc([N+](=O)[O-])ccc12 587280387 VJFFWWMVTSJWSY-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF Cc1nc(-c2cccc(Nc3ncnc4cc5ccccc5cc34)c2)cs1 13490858 DACKLMLWHPYTQH-UHFFFAOYSA-N 368.465 5.959 5 1 FKBF COC(=O)Cc1ccccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587783033 DJCNXTJOSJVPGW-UHFFFAOYSA-N 366.420 5.252 5 1 FKBF CC1(C)CC(=O)[C@@H]2C(=NC(c3ccccc3)=C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 169723756 KWXLHRWYRPHVGL-AVRDEDQJSA-N 374.440 5.179 5 1 FKBF CCc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1CC 586878303 CIZALYFHYLMSCV-UHFFFAOYSA-N 352.441 5.451 5 1 FKBF CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587951608 HQBWAWGBIQDELE-JLHGSKIFSA-N 372.512 6.916 5 1 FKBF Cc1c(-c2ccc(Cl)c(Br)c2)[nH]c2cc([N+](=O)[O-])ccc12 587644277 SKJOVUUSDSIWOD-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF CCCc1c(-c2ccc(OC(F)(F)F)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587645958 GSFBBYNUGLLZPU-UHFFFAOYSA-N 364.323 5.594 5 1 FKBF OCc1c(CO)c2c3ccccc3c3ccccc3n2c1-c1ccc(F)cc1 2382245523 BODQHTROELSLDZ-UHFFFAOYSA-N 371.411 5.036 5 1 FKBF CC[C@@H](Oc1ccccc1F)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587154672 GMZRYWVLVAEVRN-HXUWFJFHSA-N 372.403 5.329 5 1 FKBF CCN(CC)CCn1c2ccc3ccccc3c2c2nc3ccccc3nc21 31847917 WRVULNITOSDRPK-UHFFFAOYSA-N 368.484 5.233 5 1 FKBF O=C(C[C@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1cccc(F)c1 49853567 IUZRAMZCEBNUIK-FQEVSTJZSA-N 370.424 5.368 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4ccccc4F)cc3)[C@@H]1C2 95564560 XEYPQBFUCSPXLM-GMAHTHKFSA-N 364.528 6.062 5 1 FKBF C[C@@]1(c2cc(Cl)ccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587498730 GHJOMMAKNSDYCC-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=NCc3cccc(F)c3)c2c1 653716994 FMXBIQCFIQYXGT-UHFFFAOYSA-N 366.823 5.223 5 1 FKBF CCCCCCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 45335773 TWXMIVPOYBQWNF-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF Clc1ccc([C@@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71315914 CMPJCHPQDIBNCS-NRFANRHFSA-N 356.856 6.085 5 1 FKBF c1cnc2c(c1)c1nc(CSCc3ccsc3)[nH]c1c1cccnc12 587026707 WVNGTPSXOMGJHE-UHFFFAOYSA-N 362.483 5.154 5 1 FKBF CC[C@@H](C)n1cc(Cl)c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)n1 587079428 KBBSXADXFOXCRU-CYBMUJFWSA-N 374.875 6.357 5 1 FKBF CCc1c(-c2ccc(OC(F)(F)F)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587645939 FQVBQWCFTNVBPX-UHFFFAOYSA-N 350.296 5.204 5 1 FKBF O=c1cc(-c2ccccc2)oc2c1cc(Br)c1ccccc12 169337357 LEQYCHQCEBBPRC-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF Cc1c(-c2nc3ccc(Sc4ccccc4)cc3[nH]2)cccc1[N+](=O)[O-] 587261779 HUSTWQGAJBZXJL-UHFFFAOYSA-N 361.426 5.598 5 1 FKBF Cc1ccc(C(=O)C[C@H](Nc2ccc([N+](=O)[O-])cc2)C2CCCCC2)cc1 49807447 AWYOCGCIYQEWJB-NRFANRHFSA-N 366.461 5.537 5 1 FKBF O=[N+]([O-])c1ccc(-c2nnc(C3=C(Cl)c4ccccc4CCC3)o2)cc1 299871759 ZEOIWMZLBMICFW-UHFFFAOYSA-N 367.792 5.088 5 1 FKBF CCCCCCc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 45334830 WJKXVCRSXFNFGO-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF COc1ccc(Cl)cc1-c1[nH]c2cccc([N+](=O)[O-])c2c1C(F)(F)F 587644677 AGGCYIHOIZSWRM-UHFFFAOYSA-N 370.714 5.424 5 1 FKBF Clc1ccc2c(c1)C[C@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)O2 587081702 YXIROKSYNQMBAC-HXUWFJFHSA-N 370.839 6.199 5 1 FKBF CC1(C)CC(=O)[C@@H]2C(=NC(c3ccccc3)=C[C@@H]2c2ccc([N+](=O)[O-])cc2)C1 169723754 KWXLHRWYRPHVGL-GCJKJVERSA-N 374.440 5.179 5 1 FKBF Oc1ccccc1C1(c2nc3c4ccccc4c4ccccc4c3[nH]2)CC1 586896939 MKJKHRZIORCYPF-UHFFFAOYSA-N 350.421 5.655 5 1 FKBF O=C(c1cccc(Oc2ccccc2)c1)c1coc2cc([N+](=O)[O-])ccc12 587278902 ARTCCFHWIXHRCT-UHFFFAOYSA-N 359.337 5.364 5 1 FKBF O=[N+]([O-])c1ccc([C@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724703 MNHOJKHCVKBGIQ-FGZHOGPDSA-N 367.408 6.540 5 1 FKBF O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1coc2ccc(Cl)cc12 587278731 SGDNJUCCTGDKLW-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF COc1cc(F)c2c(=O)c3ccc(Oc4ccc(Cl)cc4)cc3[nH]c2c1 1911578888 XKKHBRJVXJBLIW-UHFFFAOYSA-N 369.779 5.275 5 1 FKBF O=c1c2ccc(Cl)cc2oc2c(CSc3ccccc3)cccc12 5844177 IVDJZAGOHBOWFZ-UHFFFAOYSA-N 352.842 5.892 5 1 FKBF Cc1cccc(-c2ccc(C[N+](C)(C)CC3=CC[C@H]4C[C@@H]3C4(C)C)cc2)c1 95562692 ZYVSCMYTJFDJLH-DQEYMECFSA-N 360.565 6.231 5 1 FKBF CO[C@H]1[N+]([O-])=C(/C=C/c2ccc3ccc4cccc5ccc2c3c45)CC1(C)C 103075536 ROLKAAIQJNJPSN-CYNGKWMKSA-N 369.464 5.951 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C\c3ccc(OCc4ccccc4)cc3)[nH]c2c1 587785209 YSZADJYMIVFXRZ-JYRVWZFOSA-N 371.396 5.221 5 1 FKBF Oc1nc2ccccc2c2cc(-c3ccco3)cc(Nc3ccccc3)c12 2382219601 ZAPNBHGFIWFOTQ-UHFFFAOYSA-N 352.393 6.097 5 1 FKBF O=[N+]([O-])c1ccc(CN(Cc2ccccc2)Cc2ccc(Cl)cc2)s1 96270193 DLEMDJVIUAYIGD-UHFFFAOYSA-N 372.877 5.512 5 1 FKBF O[C@@H]1C[C@H](c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586903083 NIGNKJPYSPIWGU-LEWJYISDSA-N 350.421 5.438 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2cc3c4c(cccc4n2)CC3)s1 587359595 IEJJITQSXXXYPN-UHFFFAOYSA-N 358.422 5.637 5 1 FKBF O=c1cc(-c2ccc(F)cc2C(F)(F)F)oc2c1ccc1ccccc12 1772573806 MEJXRCLMQDMNCE-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(-c2ccc3ccccc3c2)c1 299828781 HHIFKRBLQVINTB-UHFFFAOYSA-N 368.392 5.667 5 1 FKBF O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4ccc(F)c(F)c4[nH]3)c2)cc1 587271324 AOMNSAITNNRXFF-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2c(F)cccc12 1857618404 YXJNVFDRPMWEMO-SFHVURJKSA-N 360.388 5.383 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc21 586890209 NUEGOTGFSVYCDB-ZCRMCLKNSA-N 352.481 6.337 5 1 FKBF Cc1ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2c1C 586969741 XCMUDIXAHVHDDD-UHFFFAOYSA-N 355.463 5.503 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2c(C(F)(F)F)cccc12 169338949 RJPPUDBSXRWQTA-YWZLYKJASA-N 373.418 5.577 5 1 FKBF CC(C)(C)c1cccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c12 587048326 SIAUKYLGSIEKAG-NTMALXAHSA-N 355.825 5.592 5 1 FKBF CCc1ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2c1 586974968 ZHZFRYXTEVXRMQ-UHFFFAOYSA-N 355.463 5.449 5 1 FKBF Cc1ccc(Oc2ncccc2C(=O)c2coc3cc([N+](=O)[O-])ccc23)cc1 587280079 ZZKJDODMGNMDMB-UHFFFAOYSA-N 374.352 5.068 5 1 FKBF CC(C)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1[N+](=O)[O-] 587507915 DEOOQTLNUNMFFJ-NRFANRHFSA-N 365.429 5.304 5 1 FKBF CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1 95580402 KMWRABRPTOODHP-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF COc1ccc2[nH]c3c(Nc4ccc(O)cc4)c4ccccc4nc3c2c1 473152233 SSUNKIKRKXWNBW-UHFFFAOYSA-N 355.397 5.327 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c3ccccc3cc3ccccc13)O2 587405374 KYHLDSQHVCNAPE-VWLOTQADSA-N 367.448 5.764 5 1 FKBF c1ccc2nc3c(nc2c1)c1ccccc1n3CCCCCN1CCCCC1 1772650292 XMALAJVWOMSRKM-UHFFFAOYSA-N 372.516 5.394 5 1 FKBF O=[N+]([O-])c1cccc(-c2csc(Nc3ccccc3C(F)(F)F)n2)c1 72117019 VBZWSCDEJJDQOC-UHFFFAOYSA-N 365.336 5.481 5 1 FKBF Cc1ccc(C(=O)C[C@H](Nc2ccc([N+](=O)[O-])cc2)c2ccsc2)cc1 49803402 HEVNCDKNAJNJPY-IBGZPJMESA-N 366.442 5.391 5 1 FKBF Cc1cccc2c1ccc1c3c(ccc12)[C@@](C)([C@H](C)CCCC(C)C)CC3 111475556 KUPQKNLBQPAEEE-NFQMXDRXSA-N 358.569 7.968 5 1 FKBF biogenic Cc1ccc(-c2nc(-c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)c(C)s2)cc1 587012410 APQNIEVPUZUOGL-UHFFFAOYSA-N 368.393 5.018 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c3ccccc3c(C)c3ccccc13)O2 587404614 GEVKYFDQZLIIQM-HSZRJFAPSA-N 367.448 5.899 5 1 FKBF CCCCCCc1ccc(C(=O)Oc2ccc(Cl)c([N+](=O)[O-])c2)cc1 45348714 BQLZJMSRSNUESB-UHFFFAOYSA-N 361.825 5.590 5 1 FKBF c1ccc2c(c1)CC[C@]21C[C@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 586891139 SVBBODWWPHRPFU-FYSMJZIKSA-N 362.436 5.031 5 1 FKBF CC(C)c1cc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c(O)c(C(C)C)c1 586896485 MQRLCVOIUHNRPL-UHFFFAOYSA-N 357.385 5.230 5 1 FKBF O=C(c1c(-c2ccccc2Cl)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F 587644822 CDXYJKKKRDJDNL-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF Cc1ccc(-c2nc(-c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)c(C)s2)cc1 587011825 CZCDTJHZYDANFL-UHFFFAOYSA-N 364.430 5.187 5 1 FKBF CC[N+](CC)(CC)CCCCCCCCCCCC[n+]1cccc(C)c1 43173456 GKQBLAVHYZMLIZ-UHFFFAOYSA-N 362.646 6.060 5 1 FKBF CC[C@H](CC[C@H](C)[C@]1(C)CCc2c1ccc1c2ccc2ccccc21)C(C)C 2356622370 DOOKGIUHXBYNAK-GTNJKRJXSA-N 372.596 8.295 5 1 FKBF Clc1ccc2c(c1)C[C@@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)O2 587081700 YXIROKSYNQMBAC-FQEVSTJZSA-N 370.839 6.199 5 1 FKBF CCCN1[C@H](C)Cc2ccccc2[C@]1(C)c1cc([N+](=O)[O-])c(Cl)s1 963230484 PSCNILFUFPOVRS-KZULUSFZSA-N 364.898 5.230 5 1 FKBF CNc1cccc(-c2cccc(-c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)c2)c1 587233925 WXHSYUPYBPXRIW-UHFFFAOYSA-N 358.401 5.155 5 1 FKBF O=[N+]([O-])c1ccc2[nH]cc([C@H](c3ccccc3)c3cc4ccccc4o3)c2c1 2382232205 OWHAQZGBIIPZSQ-QHCPKHFHSA-N 368.392 6.003 5 1 FKBF [O-][N+](CCc1c[nH]c2ccccc12)(CC1CCCCC1)CC1CCCCC1 71341645 LTCPPPGVFYLXBZ-UHFFFAOYSA-N 368.565 6.186 5 1 FKBF Cc1cccc2c1ccc1c3c(ccc12)[C@H]1[C@H]2OC[C@]1(CC3)CCC2(C)C 238755075 GXEWDOFQKGSZBN-GSLIJJQTSA-N 356.509 6.536 5 1 FKBF O=[N+]([O-])c1cc2nc([C@H]3C[C@H]3c3c(Cl)cccc3Cl)[nH]c2cc1F 587048960 KCSXAAZYVPEQIT-SFYZADRCSA-N 366.179 5.188 5 1 FKBF CCOc1cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)ccc1C 587778768 SZODSBNHHRGAEB-UHFFFAOYSA-N 352.437 6.243 5 1 FKBF CCC[C@H](C)[C@H]1CCc2c1ccc1c2ccc2c3cccc(C)c3ccc12 2356605341 BUQMYMPMZDOPMU-PKOBYXMFSA-N 352.521 7.921 5 1 FKBF Cc1ccc([C@H](C)[C@H](O)c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 586887123 HLCIAMKNHDPAEJ-FYSMJZIKSA-N 366.464 6.015 5 1 FKBF Clc1ccccc1CCc1nc2c3cccnc3c3ncccc3c2[nH]1 587059070 MNBFWQOAWNMGMW-UHFFFAOYSA-N 358.832 5.098 5 1 FKBF CCCCc1c(-c2ccc(Br)cc2)[nH]c2cccc([N+](=O)[O-])c12 587643183 BOZQHFBVHAUIQH-UHFFFAOYSA-N 373.250 5.848 5 1 FKBF O=C(CCC[N@@+]1([O-])CC=C(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1 299853783 PYOCZQLGNLJDON-XMMPIXPASA-N 373.855 5.244 5 1 FKBF Fc1ccc2c(c1)C[C@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)O2 587174100 MFFMOYACVKXPBP-HXUWFJFHSA-N 354.384 5.685 5 1 FKBF C(=C1C2CC3CC(C2)CC1C3)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587968029 RVXDNGZTQVYFOX-UHFFFAOYSA-N 366.468 5.499 5 1 FKBF [O-][N+](CCc1c[nH]c2ccccc12)(Cc1ccccc1)Cc1ccccc1 71341108 QAVWGFFQDXBYQP-UHFFFAOYSA-N 356.469 5.425 5 1 FKBF Fc1ccc(-c2csc(-c3c4ccccc4cc4ccccc34)n2)cc1 587923248 XVVFXWMYOYKFDX-UHFFFAOYSA-N 355.437 6.923 5 1 FKBF c1ccc(C[N+]23CCC(CC2)[C@H](C(c2ccccc2)c2ccccc2)C3)cc1 95592157 MGGAIBHHXKYZIY-KJIXGKQBSA-N 368.544 5.875 5 1 FKBF O[C@H](CNCc1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 26474223 SWVXNBFGMAKKRS-HSZRJFAPSA-N 351.449 5.407 5 1 FKBF Clc1ccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)nc1Cl 587085171 ZFYPDFMRULSSMI-UHFFFAOYSA-N 366.211 5.028 5 1 FKBF O=[N+]([O-])c1cc(-c2c(Cl)cc(Cl)c(Cl)c2[N+](=O)[O-])cs1 103207038 OUGNVRHQTIXQPF-UHFFFAOYSA-N 353.570 5.192 5 1 FKBF CC1(C)CC(=O)[C@H]2C(=NC(c3ccccc3)=C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 169723757 KWXLHRWYRPHVGL-PGRDOPGGSA-N 374.440 5.179 5 1 FKBF Cc1cc2[nH]c(-c3ccccc3-c3ccc(F)c(F)c3)nc2cc1[N+](=O)[O-] 587145616 OFUCFABZSFGWPF-UHFFFAOYSA-N 365.339 5.392 5 1 FKBF C[C@]12CC[C@@H]3c4ccc5oc(=O)c6ccccc6c5c4CC[C@H]3[C@@H]1CCC2=O 1772606305 XVALBSVFABFERX-DLIJCHQBSA-N 372.464 5.371 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(C[C@@H]3OCCc4ccsc43)nc21 587035870 VDPCOELYRKFSFY-IBGZPJMESA-N 370.477 5.787 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(C)c(C(=O)OCc3ccc([N+](=O)[O-])cc3)c2c1 587641844 HWYDGKKAMGFRMJ-ZDUSSCGKSA-N 366.417 5.255 5 1 FKBF COc1cc(-c2cccc(C(F)(F)F)c2)cc2c3ccccc3c[n+](C)c12 1857538681 CSBSOXFGLBQSPP-UHFFFAOYSA-N 368.378 5.512 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2ccc(C(F)(F)F)cc12 169339487 AAFZENJQFOUSJE-HRAATJIYSA-N 373.418 5.577 5 1 FKBF C[n+]1cc2ccccc2c2cc(-c3ccc(OC(F)(F)F)cc3)ccc21 1857536767 DAWBVHGZEBXDCS-UHFFFAOYSA-N 354.351 5.383 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339369 PKKNIAXJILSMLH-IERDGZPVSA-N 374.311 5.865 5 1 FKBF COc1cc2c3c(c1)O[C@@H](c1cc4ccccc4c4ccccc14)[C@@H](C2)C3=O 587446791 FVZYZSAKRPZOPP-OFVILXPXSA-N 366.416 5.490 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)cc1 587271836 JNUBZUQEOHDVCK-UHFFFAOYSA-N 365.776 5.584 5 1 FKBF CN1CCC[C@H]1C[C@H](O)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 221611215 YZENIFOTBGKBLX-KKSFZXQISA-N 374.311 5.818 5 1 FKBF Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)ccc2c1CCCC2 586897718 IGLLIVLPJDKHGJ-UHFFFAOYSA-N 364.448 6.121 5 1 FKBF CCc1c(-c2ccc(OC(F)(F)F)cc2)[nH]c2cccc([N+](=O)[O-])c12 587646618 XWXRTIAKXBJEFZ-UHFFFAOYSA-N 350.296 5.204 5 1 FKBF Fc1ccc2c(c1)C[C@@H]1CCCN1[C@@H]2c1cccc2ccc3ccccc3c12 963104431 UJABUPIDDNSANI-LVXARBLLSA-N 367.467 6.242 5 1 FKBF N[C@]1(c2nc3c4ccccc4c4ccccc4c3[nH]2)C[C@@H]1c1ccccc1F 587154367 DRZRKISNQXAFSH-NTKDMRAZSA-N 367.427 5.350 5 1 FKBF c1ccc2oc(CCc3nc4cc5nc6ccccc6nc5cc4[nH]3)cc2c1 586906325 BJHJXOMQUKNOSC-UHFFFAOYSA-N 364.408 5.191 5 1 FKBF Cc1ccccc1C(C)(C)c1nc2c3cccnc3c3ncccc3c2[nH]1 587954655 DKONWRRNJWUVNW-UHFFFAOYSA-N 352.441 5.294 5 1 FKBF CC(=O)c1ccc2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1 587271373 BDFYTYDGCDBILL-UHFFFAOYSA-N 373.368 5.133 5 1 FKBF O=c1cc(-c2cccc(Br)c2)oc2ccc3ccccc3c12 1857770276 AFKDCVXWQZYDNV-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF Nc1c(F)c(F)cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1F 587136730 KUJGFHUFKMWTAT-UHFFFAOYSA-N 363.342 5.536 5 1 FKBF Nc1ccccc1-c1ccc(-c2nc3cc(Cl)c([N+](=O)[O-])cc3[nH]2)cc1 587250643 OMUAIKOJIYRZCP-UHFFFAOYSA-N 364.792 5.041 5 1 FKBF C[C@H](CSc1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587169886 DYJWWDZEEWCTCW-SECBINFHSA-N 365.817 5.159 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2cc(C(F)(F)F)ccc12 169339411 XNKDPYCWUQDKAX-KKSFZXQISA-N 373.418 5.577 5 1 FKBF O=C1c2ccccc2-c2cc(-c3cccc([N+](=O)[O-])c3F)nc3cccc1c23 587104343 SIGGHPFOXGFTCW-UHFFFAOYSA-N 370.339 5.161 5 1 FKBF Cc1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1F 587146892 ZWXIKTWQSSZMGG-OUKQBFOZSA-N 352.412 6.487 5 1 FKBF CCCCC1CCC(c2nc3c4ccccc4c4ccccc4c3[nH]2)CC1 586883475 DGMMEQUJPFEUKC-UHFFFAOYSA-N 356.513 7.333 5 1 FKBF c1cnc2c(c1)c1nc([C@H]3SCCc4sccc43)[nH]c1c1cccnc12 587037348 UGKGSONUZHWHQD-IBGZPJMESA-N 374.494 5.100 5 1 FKBF CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1 95576935 GGQFEMQQQLOYIH-UHFFFAOYSA-N 368.908 5.542 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cccc(-c4ccccc4)c3O)[nH]c2cc1Cl 586896870 SRCOZVFQMKRDKF-UHFFFAOYSA-N 365.776 5.164 5 1 FKBF COc1cc(C)c2nc(O)c3ccccc3c2c1-c1ccc([C@@H](C)N)cc1 1857601473 BWZKFGPGMOSNJU-CQSZACIVSA-N 358.441 5.097 5 1 FKBF Brc1ccc(-c2nc3ccccc3c3c2[nH]c2ccccc23)cc1 299867800 YTZYCVZZCWWQFH-UHFFFAOYSA-N 373.253 6.299 5 1 FKBF O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cc3ccccc3cc2[nH]1 587109011 FSEHKHRGZAVXPU-UHFFFAOYSA-N 371.318 5.234 5 1 FKBF C[C@@]1(c2cc(Cl)cc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587497447 AVPCVMQAINBKEH-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=NCc3ccccc3F)c2c1 653722495 XXLNXYLGLPDSOI-UHFFFAOYSA-N 366.823 5.223 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2c(Cl)cc(Cl)cc2c2ccccc12 169338942 MEDAUDVOOZRWLE-LHSJRXKWSA-N 374.311 5.865 5 1 FKBF c1ccc(CCCCNCc2ccc3ccc4cccc5ccc2c3c45)cc1 26468343 CHKJDHZLCCZZFC-UHFFFAOYSA-N 363.504 6.697 5 1 FKBF C[C@@H](Oc1ccc(F)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587169131 TUMRNWDFGDXDHP-CQSZACIVSA-N 356.400 6.148 5 1 FKBF Cc1ccc2c(ccc3c4c(ccc32)[C@](C)([C@H](C)CCCC(C)C)CC4)c1 238768153 OJUUVFJKMJUPIX-HRFSGMKKSA-N 358.569 7.968 5 1 FKBF O=C(c1c(-c2cc3ccccc3o2)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F 587645505 XBWRWQSSJACZDM-UHFFFAOYSA-N 374.274 5.234 5 1 FKBF COc1cc(-c2cscc2-c2cccc([N+](=O)[O-])c2)cc(OC)c1OC 72111021 IGTAZXBUKFZCFU-UHFFFAOYSA-N 371.414 5.016 5 1 FKBF CCCCN(CCCC)C[C@@H](O)c1cc2ccc(F)cc2c2ccccc12 169332938 PDOVKIIJVOJOPF-XMMPIXPASA-N 367.508 6.068 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc3ccc4ccccc4c13)O2 587403928 APINRBXFYGXUSI-QFIPXVFZSA-N 353.421 5.590 5 1 FKBF Cc1[nH]c2c(C)cc(Cl)cc2c1-c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 587624212 GBLGJRFRHYCMHB-UHFFFAOYSA-N 368.742 6.032 5 1 FKBF C[C@]1(c2cc([N+](=O)[O-])ccc2Cl)CC(=O)c2ccc3c(c2O1)CCCC3 587505972 MOXRGOQVMOILRX-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF COc1ccc(C=O)cc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587787210 LLNCDIGBNBPUFF-UHFFFAOYSA-N 352.393 5.357 5 1 FKBF CCCN1[C@@H](C)Cc2ccccc2[C@@]1(C)C(C)(C)c1ccc([N+](=O)[O-])cc1 963223752 DFPCAGCCCRFXPA-SBUREZEXSA-N 366.505 5.444 5 1 FKBF CC[N+](CC)(CC)CCOc1ccc(-c2cc(=S)ss2)cc1 53229042 WLDGLMABCHXHNI-UHFFFAOYSA-N 354.586 5.461 5 1 FKBF CCN(CC)CCOc1c2ccc(Cl)cc2nc2c1[nH]c1ccccc12 64540188 GYPSVEWXFPTGRE-UHFFFAOYSA-N 367.880 5.243 5 1 FKBF c1ccc(COc2ccc3[nH]c4c5c6ccccc6nc-5c[nH]c4c3c2)cc1 100660661 OOKKUINKHBXAHH-UHFFFAOYSA-N 363.420 5.881 5 1 FKBF Cc1c(F)ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c12 586969839 ZDHCWNZAMOQEMZ-UHFFFAOYSA-N 359.426 5.334 5 1 FKBF COc1ccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)cc1 1772572346 VLYPHZBBSSFHKD-UHFFFAOYSA-N 354.409 5.319 5 1 FKBF Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2cccc([N+](=O)[O-])c2[nH]1 587012069 MVMHYDGPNVNHLK-UHFFFAOYSA-N 370.821 5.223 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2cc(F)ccc12 1857597014 GJZMAVHJIVDKDJ-IBGZPJMESA-N 360.388 5.383 5 1 FKBF Oc1c(-c2cc3nc4ncccc4nc3c3ccccc23)ccc2ccccc12 72110347 MKLGFGAGJFDJBF-UHFFFAOYSA-N 373.415 5.857 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 586893478 ZKAUUNWUMYUZSE-MHECFPHRSA-N 362.436 5.031 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2ccccc2F)[nH]c2ccccc12 1857549232 UXEWHTIMUWUEGJ-GOSISDBHSA-N 360.388 5.383 5 1 FKBF OC[C@@H]1C[C@H](c2cc3ccccc3c3ccccc23)N(Cc2ccccc2)O1 28566827 HUXVDOAFZVPBJI-NBGIEHNGSA-N 369.464 5.233 5 1 FKBF COc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-c2ccc(F)cc2)cc1 587646131 UFGXCNOQJPACGB-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF CSc1nc2c(Nc3cccc([N+](=O)[O-])c3)c3ccccc3nc2s1 29131316 JTKGFOZKWNGDAM-UHFFFAOYSA-N 368.443 5.218 5 1 FKBF c1ccc2c(c1)N[C@H](c1cc3ccccc3c3ccccc13)[C@@H]1CCCO[C@@H]21 95574784 UOVBAOZXTRRJFJ-HRNNMHKYSA-N 365.476 6.628 5 1 FKBF Clc1ccc([C@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724711 JNXFFUXXCQXBBG-FGZHOGPDSA-N 356.856 7.285 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)c(Cl)cc3[nH]2)ccc1Cl 587047274 DWNZDTCESZOPNZ-DUXPYHPUSA-N 368.607 5.602 5 1 FKBF CCCCCCc1ccc(C(=O)c2coc3cc([N+](=O)[O-])ccc23)cc1 587279898 STAYZQFNSPWZSU-UHFFFAOYSA-N 351.402 5.695 5 1 FKBF O=C1O/C(=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586907232 VFZTXTLIEXUNPI-DEDYPNTBSA-N 362.388 5.538 5 1 FKBF Clc1ccccc1CCc1nc2c3ccccc3c3ccccc3c2[nH]1 587058110 DGCIJVWCZWLXMU-UHFFFAOYSA-N 356.856 6.308 5 1 FKBF Cc1ccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)cc1F 1772570603 WPNVGAYMZPVWOB-UHFFFAOYSA-N 356.400 5.758 5 1 FKBF Nc1nc2c3ccccc3cc(-c3ccc4c(c3)OCO4)c2c2ccccc12 28474181 LUSTYACTOMXVLE-UHFFFAOYSA-N 364.404 5.519 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccccc3)c(Nc3ccc(Cl)cc3)c12 587645058 JGLOGBWFAOXCTG-UHFFFAOYSA-N 363.804 6.140 5 1 FKBF Cc1c2n(c3ccccc13)-c1ccccc1N[C@H]2c1ccc([N+](=O)[O-])cc1 71331286 MNISEXYKDQBEHY-NRFANRHFSA-N 355.397 5.362 5 1 FKBF CC/C(=C\c1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccc(C)cc1 587965593 CEKZNIROFGZICE-JQIJEIRASA-N 364.452 5.918 5 1 FKBF O=c1cc(-c2cccc3cc4ccccc4cc23)[nH]c2cc3c(cc12)OCO3 43074500 NQGBHPCXYMMEAC-UHFFFAOYSA-N 365.388 5.230 5 1 FKBF COc1cccc(OC)c1/C=C/c1cc(=O)oc2c1ccc1ccccc12 1857541793 YIDXGRKZPLSFJO-ACCUITESSA-N 358.393 5.134 5 1 FKBF O=C1c2ccccc2-c2nc(-c3ccccc3)cc3c2c1nc1ccccc13 1649603 KANYAAXIIQKOJM-UHFFFAOYSA-N 358.400 5.661 5 1 FKBF O=c1cc(Cc2c3ccccc3nc3ccccc23)c2ccc(Cl)cc2o1 64539019 HLNORORASJARMS-UHFFFAOYSA-N 371.823 5.739 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2c(Cl)cc(Cl)cc12 169339352 DDSTWKISZLVRST-YWZLYKJASA-N 374.311 5.865 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587951283 GRUXYORBFKLKHO-HLFMIMNKSA-N 374.488 5.706 5 1 FKBF OC[C@@H]1C[C@H](c2c3ccccc3cc3ccccc23)N(Cc2ccccc2)O1 28566693 MSTYJZCYVYXJAT-XUZZJYLKSA-N 369.464 5.233 5 1 FKBF C[C@@]1(c2cc([N+](=O)[O-])ccc2Cl)CC(=O)c2ccc3c(c2O1)CCCC3 587505971 MOXRGOQVMOILRX-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF Cc1ccc2nc3c(cnc4c3c(C)nn4-c3ccccc3)c(Cl)c2c1 28975820 CFSHETNQCWJHOF-UHFFFAOYSA-N 358.832 5.392 5 1 FKBF CCN(CC)c1cccc(OCc2cc(=O)oc3c2ccc2ccccc23)c1 103201540 BDVSDPSLCVKSJZ-UHFFFAOYSA-N 373.452 5.371 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)c(F)cc3[nH]2)ccc1Cl 587048341 SSZGSZBNESPTMD-DUXPYHPUSA-N 352.152 5.087 5 1 FKBF Cc1ccc2c(ccc3nc(/C=C/c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c32)n1 587048061 PNNZCYNCKHFPNG-RUDMXATFSA-N 364.792 5.152 5 1 FKBF O=[N+]([O-])c1ccc(-c2ccccc2Nc2ccccc2)cc1C(F)(F)F 1857588991 SKESJUNPHBKTOE-UHFFFAOYSA-N 358.319 6.024 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(Cc3csc4nccn34)nc21 587039371 DICMHJHRWSWCDK-UHFFFAOYSA-N 354.438 5.169 5 1 FKBF Cc1nc(-c2cccc(C(=O)c3coc4cc([N+](=O)[O-])ccc34)c2)cs1 587280806 ZALNIACWQCGXQZ-UHFFFAOYSA-N 364.382 5.004 5 1 FKBF CCc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2C(=O)C(F)(F)F)cc1 587645256 MVUFTONTWCOCII-UHFFFAOYSA-N 362.307 5.051 5 1 FKBF Cc1ccc2c(c1)c1cc(C)ccc1c1[nH]c(-c3c(F)cccc3Cl)nc21 45334368 ABFVUJAWCNCDCE-UHFFFAOYSA-N 374.846 6.946 5 1 FKBF CC(C)(C)c1cccc2nc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)[nH]c12 587268774 FAQVVPHYKHQFDY-UHFFFAOYSA-N 364.449 5.036 5 1 FKBF O=c1[nH]ccc2nc(Nc3c(Cl)cccc3Cl)c3ccc(F)cc3c12 64548711 ZGBZDEDHSMWXEG-UHFFFAOYSA-N 374.202 5.266 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)cc(Cl)c3[nH]2)ccc1Cl 587047547 KOZJVTGOMVLJBW-RQOWECAXSA-N 368.607 5.602 5 1 FKBF CCC(C)(C)c1ccc(OCc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1 587565010 TVAYLNVAYYKSOA-UHFFFAOYSA-N 373.840 5.391 5 1 FKBF Cc1c2c(nc3cnc4ccccc4c13)-c1cc(Cl)cc(Cl)c1OC2 1857652220 RLVRGEJTXLOVHQ-UHFFFAOYSA-N 367.235 5.958 5 1 FKBF c1ccc2c(c1)N[C@@H](c1cc3ccccc3c3ccccc13)[C@@H]1CCCO[C@H]21 95571889 UOVBAOZXTRRJFJ-HDYLNDSGSA-N 365.476 6.628 5 1 FKBF Cc1oc(-c2nc3cc(Sc4ccccc4)ccc3[nH]2)cc1[N+](=O)[O-] 587269787 QDIHGOJNKHVLKD-UHFFFAOYSA-N 351.387 5.191 5 1 FKBF COc1cc(-c2c(C)[nH]c3c(C)cc(Cl)cc23)c([N+](=O)[O-])cc1OC 587627403 UYNPYVNRQCOUDJ-UHFFFAOYSA-N 360.797 5.031 5 1 FKBF CC[N+](CC)(CC)Cc1ccc2oc(-c3ccc(Cl)cc3)cc(=O)c2c1 103217766 XICHRUZBOBKWOW-UHFFFAOYSA-N 370.900 5.490 5 1 FKBF C[C@@H](SCc1ccccc1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 586961522 JUHVNAVKDJWLQF-CQSZACIVSA-N 370.481 5.654 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3ccccc3-c3ccc(F)c(F)c3)[nH]c2cc1F 587145206 LGQJZTNLEUVYMZ-UHFFFAOYSA-N 369.302 5.222 5 1 FKBF Cc1cccc(-c2ccc(Cl)cc2)c1-c1nc2cccc([N+](=O)[O-])c2[nH]1 587074110 QEKOHUVBUAHBAF-UHFFFAOYSA-N 363.804 5.767 5 1 FKBF COc1ccc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)c(F)c1 587148587 KPMBPQCZYPIKLM-UHFFFAOYSA-N 356.400 5.608 5 1 FKBF Nc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)ccc2ccccc12 587254313 ZWIYGUSBYNJBEM-UHFFFAOYSA-N 359.432 6.272 5 1 FKBF CCOC(=O)c1c(-c2ccccc2[N+](=O)[O-])[nH]c2ccc([C@@H](C)CC)cc12 587643035 QRJAZQQPHQYGEV-ZDUSSCGKSA-N 366.417 5.433 5 1 FKBF CCCCc1c(-c2ccc(Br)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587644202 PNXIJEWFQMSBOU-UHFFFAOYSA-N 373.250 5.848 5 1 FKBF O=[N+]([O-])c1cc2nc(/C=C/c3cccc(Cl)c3Cl)[nH]c2cc1Cl 587055127 SGDFJIUTGSXOLP-SNAWJCMRSA-N 368.607 5.602 5 1 FKBF O=[N+]([O-])c1cccc2c(Sc3ccccc3C(F)(F)F)cc(O)nc12 299871572 YRGXABXQBMWWQA-UHFFFAOYSA-N 366.320 5.019 5 1 FKBF CCc1ccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1CC 586878226 ARBNIBUNZOJZKX-UHFFFAOYSA-N 352.441 5.451 5 1 FKBF CCCCC1CCC(c2nc3c4cccnc4c4ncccc4c3[nH]2)CC1 586883232 AFPARRKZVZNMKL-UHFFFAOYSA-N 358.489 6.123 5 1 FKBF O=[N+]([O-])c1ccc2c(Sc3ccccc3)c(-c3ccc(F)cc3)[nH]c2c1 587646178 WGSHQFHVKSYXEU-UHFFFAOYSA-N 364.401 6.033 5 1 FKBF COc1cccc([C@H](C[N+](=O)[O-])c2c(-c3ccccc3)[nH]c3ccccc23)c1 2382242740 QWCAFAXUXGFUMF-FQEVSTJZSA-N 372.424 5.252 5 1 FKBF Cn1c2nc3ccccc3c-2c(Nc2ccc(CCO)cc2)c2ccccc21 103173055 AGZVBFIFXAVAOQ-UHFFFAOYSA-N 367.452 5.110 5 1 FKBF CC12c3ccccc3C(C)(c3ccccc31)[C@H]([N+](=O)[O-])[C@H]2c1ccccc1 34133359 VCZAJAOFTQXHQO-SSPWFOHLSA-N 355.437 5.055 5 1 FKBF biogenic FC(F)(F)c1cncc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587115411 NHVZVVSLKWSCEG-UHFFFAOYSA-N 363.342 5.950 5 1 FKBF O=c1cc(-c2ccc(OC(F)(F)F)cc2)oc2c1ccc1ccccc12 1772576756 QVUWJPSQEYJBTD-UHFFFAOYSA-N 356.299 5.512 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(OC(C)=O)c2c1 587641505 GPIJZPNWTOUKSW-LBPRGKRZSA-N 352.390 5.182 5 1 FKBF c1ccc2nc3cc4[nH]c(-c5ccc(OC6CCC6)cc5)nc4cc3nc2c1 587951458 LRSOZXJMCBEWQA-UHFFFAOYSA-N 366.424 5.258 5 1 FKBF O=[N+]([O-])c1ccc(-c2ccccc2Nc2ccccc2Br)cc1 1857616922 MTEWEELSRDFKMF-UHFFFAOYSA-N 369.218 5.768 5 1 FKBF COc1cc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2cc1C 586969844 ZHACJCWPXZZBPP-UHFFFAOYSA-N 371.462 5.203 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(C)c(C(=O)Nc3ccc([N+](=O)[O-])cc3)c2c1 587641095 FGCFGDLMSKESMI-GFCCVEGCSA-N 351.406 5.150 5 1 FKBF CCc1c(-c2ccc(Br)cc2F)[nH]c2cc([N+](=O)[O-])ccc12 587645676 HPPGNLSHMJKFRV-UHFFFAOYSA-N 363.186 5.207 5 1 FKBF O=[N+]([O-])c1ccc(-c2ccccc2[C@H]2NCCc3cc(Cl)ccc32)cc1 963391290 SAKRSVUGQXSPGR-NRFANRHFSA-N 364.832 5.150 5 1 FKBF CC1(C)Cc2c(c3ccccc3c3nc(-c4ccc([N+](=O)[O-])cc4)oc23)O1 95579520 QAQXSXYLRGITAA-UHFFFAOYSA-N 360.369 5.270 5 1 FKBF Cc1cc2[nH]c(-c3cc(C(C)C)cc(C(C)C)c3O)nc2cc1[N+](=O)[O-] 586896895 UGIGLLDURUMMQU-UHFFFAOYSA-N 353.422 5.399 5 1 FKBF Cc1cc(F)ccc1Nc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12 1772570804 JUKCGRMIQABZMI-UHFFFAOYSA-O 356.424 5.490 5 1 FKBF COc1ccc(C2(C(=O)c3coc4cc([N+](=O)[O-])ccc34)CCCC2)cc1 587279897 SSAIUSWNQAOHQX-UHFFFAOYSA-N 365.385 5.044 5 1 FKBF CCCN1[C@@H](C)Cc2ccccc2[C@]1(C)c1cc([N+](=O)[O-])c(Cl)s1 963230482 PSCNILFUFPOVRS-KPZWWZAWSA-N 364.898 5.230 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccccc2c2ccc(C(F)(F)F)cc12 169339488 AAFZENJQFOUSJE-IERDGZPVSA-N 373.418 5.577 5 1 FKBF O=C(O)c1ccccc1/C=C/c1nc2c3ccccc3c3ccccc3c2[nH]1 586881310 VXEBUJSJRWZEPJ-BUHFOSPRSA-N 364.404 5.738 5 1 FKBF Cc1cccc(-c2ccc(Cl)cc2)c1-c1nc2cc([N+](=O)[O-])cnc2[nH]1 587073445 GEVYNHHHBMYSRH-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF CCCCN(CCCC)CC[C@H](O)c1c2ccccc2nc2ccccc12 25972146 IFHNTUTXLXIXQU-QHCPKHFHSA-N 364.533 5.714 5 1 FKBF CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CO)C(C)(C)C[C@H](O)C1 64633390 XVQDCCGQSOTQBN-HEZGKBSMSA-N 368.561 5.984 5 1 FKBF in-vitro Cc1c(C(=O)O)ccc2c1nc(Nc1cccc(Cl)c1)c1ccncc12 66104864 JHNGYTFSNQHQEW-UHFFFAOYSA-N 363.804 5.187 5 1 FKBF Cc1cc(Cl)ccc1-n1cccc1-c1nc2cc(C)c([N+](=O)[O-])cc2[nH]1 587066036 GJTBCKJUQQJWAA-UHFFFAOYSA-N 366.808 5.199 5 1 FKBF Clc1ccc([C@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724709 JNXFFUXXCQXBBG-YADHBBJMSA-N 356.856 7.285 5 1 FKBF CC(C)(C)C1=NN(c2ccc(Cl)cc2)[C@@H](c2ccc([N+](=O)[O-])cc2)C1 299832123 RUITXMDELYMDDO-QGZVFWFLSA-N 357.841 5.602 5 1 FKBF Cc1cc(Br)cc2c3cn(C)c4ccc(Cl)cc4c-3nc12 299863516 PHWBDNKKZAIBIX-UHFFFAOYSA-N 359.654 5.556 5 1 FKBF CC(=O)c1ccc(-c2cccc(-c3nc4ccc([N+](=O)[O-])cc4[nH]3)c2)cc1 586880417 MTQRJTAVRABOEJ-UHFFFAOYSA-N 357.369 5.008 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 586891144 SVBBODWWPHRPFU-UPCLLVRISA-N 362.436 5.031 5 1 FKBF c1cnc2c(c1)c1nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c1c1cccnc12 586892780 WJRFGRALIOBEMX-OYBPKBROSA-N 354.457 5.127 5 1 FKBF CCOc1ccccc1-c1cccc(-c2nc3cccc([N+](=O)[O-])c3[nH]2)c1 587779897 JCYXCXVQUAAOKC-UHFFFAOYSA-N 359.385 5.204 5 1 FKBF CC(C)=CCC/C(C)=C\c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587968117 KXDYCUGOSIWEFS-LUAWRHEFSA-N 364.243 5.383 5 1 FKBF COc1ccccc1CC(=O)c1nc2c3ccccc3c3ccccc3c2[nH]1 587929155 GKFGXAPINPAIFT-UHFFFAOYSA-N 366.420 5.303 5 1 FKBF OC[C@@H](NCc1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 26466612 ZPINGZCFZUSQCU-HSZRJFAPSA-N 351.449 5.407 5 1 FKBF CC12c3ccccc3C(C)(c3ccccc31)[C@@H]([N+](=O)[O-])[C@H]2c1ccccc1 34133361 VCZAJAOFTQXHQO-CZKGODDJSA-N 355.437 5.055 5 1 FKBF biogenic O=[N+]([O-])c1cc(F)cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587160360 PUXZZFURJRGVIG-UHFFFAOYSA-N 357.344 5.584 5 1 FKBF Cc1ccccc1[C@H](C[N+](=O)[O-])c1c(-c2ccccc2)[nH]c2ccccc12 2382249409 YETFDRBZGXBULL-FQEVSTJZSA-N 356.425 5.552 5 1 FKBF O=c1cc(-c2c(F)cccc2C(F)(F)F)oc2c1ccc1ccccc12 1772627806 KTLCGCDZILEKMZ-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF O=[N+]([O-])C[C@@H](Cc1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 2382222508 GKQGDPUISOETSU-LJQANCHMSA-N 356.425 5.438 5 1 FKBF N=C(Nc1ccc2ccc3cccnc3c2n1)c1ccc(Cl)c(Cl)c1 28223730 OPKTZENOENPIEB-UHFFFAOYSA-N 367.239 5.527 5 1 FKBF CC(C)=CCC/C(C)=C/CCC1=C[C@H](c2ccc([N+](=O)[O-])cc2)OC1=O 1857754829 BKVDEJBFSRGNGS-MOWFPQLSSA-N 355.434 5.592 5 1 FKBF CCCc1sc(=N)[nH]c1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587013634 VMLPYIZRZWBHIK-UHFFFAOYSA-N 358.470 5.358 5 1 FKBF c1ccc2nc3cc4[nH]c(CSCc5ccsc5)nc4cc3nc2c1 587024800 CXKUCZMAYBCWPS-UHFFFAOYSA-N 362.483 5.154 5 1 FKBF CC(=O)N1N=C(c2ccco2)C[C@H]1c1c2ccccc2cc2ccccc12 66103012 QARZDXARDIMXGB-NRFANRHFSA-N 354.409 5.284 5 1 FKBF Nc1cccc2c(Nc3cc(=O)oc4c3ccc3ccccc34)cccc12 84602064 IVWXBKFOTPWYCG-UHFFFAOYSA-N 352.393 5.425 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(-c4cc(Cl)ccc4Cl)o3)nc12 587050329 IKFYVQOMXPDXLV-UHFFFAOYSA-N 374.183 5.705 5 1 FKBF O=c1cc(-c2ccc(C(F)(F)F)cc2F)oc2c1ccc1ccccc12 1772644187 APCKNZCPMKHWDT-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF Cc1ccc2cc3n(c2c1)-c1ccccc1N[C@@H]3c1ccc([N+](=O)[O-])cc1 71341735 YAPKPZYUONJFFN-JOCHJYFZSA-N 355.397 5.362 5 1 FKBF C/C(=C/CC1=CC(c2ccc([N+](=O)[O-])cc2)=CC1)c1ccc2ccccc2c1 95573510 JBLLWBDMSHVSME-FXBPXSCXSA-N 367.448 6.955 5 1 FKBF Cc1cccc2c1ccc1c3c(ccc12)[C@H]1[C@H]2OC[C@@]1(CC3)CCC2(C)C 2356445590 GXEWDOFQKGSZBN-BFLUCZKCSA-N 356.509 6.536 5 1 FKBF CC/N=c1/cc2sc3cc(N(CC)CC)ccc3nc-2c2ccccc12 101058712 OTBUNUJZMOCLRE-NMWGTECJSA-N 361.514 5.321 5 1 FKBF Oc1cccc(CCCCc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 586895858 BUUYYVBFGBQXGE-UHFFFAOYSA-N 366.464 6.140 5 1 FKBF Cc1cc2[nH]c([C@@H]3C[C@H]3c3c(Cl)cccc3Cl)nc2cc1[N+](=O)[O-] 587052203 YNWHUOWLWDDWQL-NXEZZACHSA-N 362.216 5.357 5 1 FKBF Cc1ccc2c(ccc3c4c(ccc32)[C@](C)([C@@H](C)CCCC(C)C)CC4)c1 2356700479 OJUUVFJKMJUPIX-DCFHFQCYSA-N 358.569 7.968 5 1 FKBF CCCCN(CCCC)C[C@@H](O)c1ccc2ncc3ccccc3c2c1 25972782 RVRFJHDQNNPXMJ-HSZRJFAPSA-N 350.506 5.324 5 1 FKBF Cc1ccc2ccccc2c1-c1nc2c3ccccc3c3ccccc3c2[nH]1 586883581 LAMIWVZIZGBVED-UHFFFAOYSA-N 358.444 6.998 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(-c3csc([C@H]4CCCO4)n3)nc21 587017523 XROLTLQYHWELSV-GOSISDBHSA-N 371.465 5.844 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(Cl)cc3)c(-c3cccc(F)c3)[nH]c2c1 587646193 WPNUGOAFWIVEKJ-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2c3cccnc3c3ncccc3c2[nH]1 587951591 HMEFICSQXIUBMU-MPGHIAIKSA-N 374.488 5.706 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc(F)c(Cl)cc3[nH]2)o1 587265927 UUAMAANRTQPSAK-UHFFFAOYSA-N 357.728 5.191 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4cccc(F)c4)cc3)[C@@H]1C2 95564031 WYNCXQNHQLUJLV-UPVQGACJSA-N 364.528 6.062 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cccc(-c4ccsc4)c3)[nH]c2cc1Cl 587026604 VUIRQHDHCDEHAM-UHFFFAOYSA-N 355.806 5.520 5 1 FKBF Clc1cccc(Cl)c1Cn1c2cccc3cccc(c32)n2cnnc12 1772633916 NRUGOBQHLVAKHE-UHFFFAOYSA-N 367.239 5.192 5 1 FKBF Nc1c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)ccc2ccccc12 587253127 BKTMSOOHKFHBAX-UHFFFAOYSA-N 361.408 5.062 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2ccc(C(F)(F)F)cc12 169339485 AAFZENJQFOUSJE-KKSFZXQISA-N 373.418 5.577 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(F)c(F)c3)c(-c3ccccc3)[nH]c2c1 587645682 HTUMDAKYLIQQHY-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccccc2c2ccc(C(F)(F)F)cc12 169339490 AAFZENJQFOUSJE-IIBYNOLFSA-N 373.418 5.577 5 1 FKBF C(=C\c1cccc2ccccc12)\c1nc2c3ccccc3c3ccccc3c2[nH]1 587969786 XAYIDUFYYHNWSY-MSUUIHNZSA-N 370.455 7.193 5 1 FKBF Cc1cc2[nH]c(Cc3ccc(-c4ccccc4)c(F)c3)nc2cc1[N+](=O)[O-] 587145207 HZPVZEVFQYLRGM-UHFFFAOYSA-N 361.376 5.176 5 1 FKBF CCCc1c(-c2ccc(OC(F)(F)F)cc2)[nH]c2cccc([N+](=O)[O-])c12 587645793 DBFFRJBFUIRGBT-UHFFFAOYSA-N 364.323 5.594 5 1 FKBF Cc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-n2ccnc2C(C)C)cc1C 587647282 FJGQLYASWRIOLF-UHFFFAOYSA-N 374.444 5.669 5 1 FKBF COc1c(C(=O)c2ccc([N+](=O)[O-])cc2)cc(C(C)(C)C)cc1C(C)(C)C 1618966 ZAKXVLKPKLFGSV-UHFFFAOYSA-N 369.461 5.429 5 1 FKBF O=[N+]([O-])c1ccc(-c2c3c(nn2-c2ccccc2)-c2ccccc2C3)cc1 1857582005 SVYYHXCKVVRZOG-UHFFFAOYSA-N 353.381 5.019 5 1 FKBF CC(C)(C)OC(=O)N1CCC[C@H]1c1c(C2CC2)[nH]c2cccc([N+](=O)[O-])c12 587649351 SJGRZUAYONKBCJ-AWEZNQCLSA-N 371.437 5.026 5 1 FKBF Fc1ccc2c(c1)C[C@H]1CCCN1[C@H]2c1cccc2ccc3ccccc3c12 963104434 UJABUPIDDNSANI-QFQXNSOFSA-N 367.467 6.242 5 1 FKBF C[N+](=O)[C@@H](CC(=O)c1ccccc1)c1c2ccccc2cc2ccccc12 72116272 CQQURDRULVVOKC-QFIPXVFZSA-N 354.429 5.716 5 1 FKBF CC[C@H](Oc1ccccc1F)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587154670 GMZRYWVLVAEVRN-FQEVSTJZSA-N 372.403 5.329 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(C)c(C(=O)Nc3ccc([N+](=O)[O-])cc3)c2c1 587641098 FGCFGDLMSKESMI-LBPRGKRZSA-N 351.406 5.150 5 1 FKBF FC(F)(F)Oc1ccc(-c2cc3c(ccc4oc5ccccc5c43)o2)cc1 96931846 HKJSDMRYMYKRJT-UHFFFAOYSA-N 368.310 6.898 5 1 FKBF Oc1ccc(Nc2c3ccccc3nc3c2[nH]c2ccc(Cl)cc23)cc1 473152709 VPCZQWPWIOHQQI-UHFFFAOYSA-N 359.816 5.972 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cccc(C(F)(F)F)c3[nH]2)ccc1Cl 587047358 HKBFBNZULMBLQG-FNORWQNLSA-N 367.714 5.314 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(OCc3ccccc3)c12 587645782 JZNNVLASVLFKHM-UHFFFAOYSA-N 362.360 5.461 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2c(Cl)cc(Cl)cc2c2ccccc12 169338946 MEDAUDVOOZRWLE-SZNDQCEHSA-N 374.311 5.865 5 1 FKBF COc1ccc2[nH]c3c(C)c4cc[n+](C)c(Nc5ccccc5)c4cc3c2c1 28224382 LHHFAXKXTMODMM-UHFFFAOYSA-O 368.460 5.359 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@@H]1c1nc2c3ccccc3c3ccccc3c2[nH]1 586887989 JYPBVGHUJZKAFY-ATIYNZHBSA-N 360.460 6.241 5 1 FKBF c1ccc2oc(CCc3nc4c5cccnc5c5ncccc5c4[nH]3)cc2c1 586906582 DDJQXOCFQSGCEN-UHFFFAOYSA-N 364.408 5.191 5 1 FKBF CCc1ccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)cc1 1772589290 FFNXMVDQGBENLQ-UHFFFAOYSA-O 352.461 5.605 5 1 FKBF COc1ccc(/C=C/c2cc(=O)oc3c2ccc2c(C)cccc23)c(OC)c1 1857557271 HDDSACHMVRTDDL-BQYQJAHWSA-N 372.420 5.442 5 1 FKBF O=c1c2cc(OCc3ccc(Cl)cc3)ccc2[nH]c2cc(F)cc(F)c12 1911580886 OGIVVXQSOLWGMB-UHFFFAOYSA-N 371.770 5.192 5 1 FKBF O=C1Nc2cc(Cl)ccc2/C1=C\c1c2ccccc2cc2ccccc12 169332137 TWCOVQOFBRCYAL-FYJGNVAPSA-N 355.824 6.139 5 1 FKBF CC(C)(C)c1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2c1 587264128 BWGUAIQISKINGG-UHFFFAOYSA-N 361.401 5.696 5 1 FKBF COc1ccc([C@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724739 GMFUGNKBPPBASM-DHIUTWEWSA-N 352.437 6.640 5 1 FKBF O=C1[C@H]2CC=C[C@H]1C[C@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)C2 586888743 XRNPVRCXYYYTQQ-JYJNAYRXSA-N 352.437 5.508 5 1 FKBF O=[N+]([O-])c1ccc2c(Cc3ccccc3Cl)c(-c3ccccc3)[nH]c2c1 587644617 IEYBYHJKKQMQCJ-UHFFFAOYSA-N 362.816 5.987 5 1 FKBF Fc1ccc2c(c1)C[C@@H]1CCCN1[C@H]2c1cccc2ccc3ccccc3c12 963104425 UJABUPIDDNSANI-HFZDXXHNSA-N 367.467 6.242 5 1 FKBF O=C1c2ccccc2-c2cc(-c3cccc([N+](=O)[O-])c3)nc3cccc1c23 587105066 MXYGLLHXMUBRNH-UHFFFAOYSA-N 352.349 5.021 5 1 FKBF O=[N+]([O-])c1ccc([C@@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724700 MNHOJKHCVKBGIQ-VXKWHMMOSA-N 367.408 6.540 5 1 FKBF Cc1cc(F)c2[nH]c(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)nc2c1 587271461 CZXZCAUWAGTHHJ-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF Cc1[nH]c2ccccc2c1[C@@H](Nc1ccccc1)c1ccc([N+](=O)[O-])cc1 84609915 SQOQCTLLQYSMCW-QFIPXVFZSA-N 357.413 5.586 5 1 FKBF C[N+]12C=CC=C1[C@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 31871180 WPEKCJPMSAXMJK-HSTJUUNISA-N 355.914 5.567 5 1 FKBF O=C(c1ccc(Cc2ccccc2)cc1)c1coc2cc([N+](=O)[O-])ccc12 587279696 OUNIGZCBUKMRLL-UHFFFAOYSA-N 357.365 5.163 5 1 FKBF Cc1[nH]c2cccc([N+](=O)[O-])c2c1[C@H]1CCCCCN1C(=O)OC(C)(C)C 587649380 TWUQDDKXMRPPKD-OAHLLOKOSA-N 373.453 5.237 5 1 FKBF C/C(=C\c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)C1CCCCC1 587967382 JEZONPDPDZBNRL-JXMROGBWSA-N 364.243 5.217 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587953065 ZAAMADPLWHZJOH-USBNGQNGSA-N 351.834 5.171 5 1 FKBF O=C(c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1coc2ccc(Cl)cc12 587279195 YCIZTDXCCMDKNB-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4ccccc4O)cc3)[C@@H]1C2 95564860 ZINJZVKDOVPSGN-GMAHTHKFSA-O 362.537 5.628 5 1 FKBF Fc1cccc([C@H]2C[C@@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587161238 LQBLWURUWRLKMM-CABCVRRESA-N 354.388 5.070 5 1 FKBF CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2ccc(Cl)cc2[nH]1 586969550 VADCSIAFNPORTR-UHFFFAOYSA-N 361.854 5.540 5 1 FKBF Clc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)nc1Cl 587083919 CMEBJKSOXFPLGB-UHFFFAOYSA-N 364.235 6.238 5 1 FKBF O=[N+]([O-])c1cccc([C@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)c1 71319260 MUOLZTFDKQBWFE-OAQYLSRUSA-N 367.408 5.340 5 1 FKBF c1ccc2nc3c(nc2c1)c1ccccc1n3CCCCN1CCCCC1 1772638186 MELMLSBRFPBQQK-UHFFFAOYSA-N 358.489 5.004 5 1 FKBF C[N+]1(CCCCCCCCCCCCCC[N+]2(C)CCCC2)CCCC1 27560172 HKIXQKZEHADONI-UHFFFAOYSA-N 366.678 6.148 5 1 FKBF O[C@@H](CN1CCCCC1)c1c2ccccc2nc2c1ccc1ccccc12 143582305 NCTPFHJSYIOLDU-QFIPXVFZSA-N 356.469 5.061 5 1 FKBF Cc1ccc(-c2ccc([C@@H]3NCCc4c3sc(C)c4C)o2)c([N+](=O)[O-])c1 963022975 KWCYIZFCVPDYBY-IBGZPJMESA-N 368.458 5.077 5 1 FKBF O=C(C[C@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1ccc(F)cc1 49853574 FFBFTWHDFGXBAD-FQEVSTJZSA-N 370.424 5.368 5 1 FKBF FC(F)(F)c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 73240824 RCRGNBYQYKKXMP-UHFFFAOYSA-N 364.330 5.345 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=NCc3cccc(C)c3)c2c1 653707172 NUPGAGUGJNTUPB-UHFFFAOYSA-N 362.860 5.392 5 1 FKBF c1ccc2nc3cc4[nH]c([C@]56CCC[C@@H]5[C@H]5CC[C@H]6C5)nc4cc3nc2c1 586890257 NWISBMGTJOCDEU-SONXGWPDSA-N 354.457 5.127 5 1 FKBF COc1cc2c3c(c1)O[C@@H](c1c4ccccc4cc4ccccc14)[C@@H](C2)C3=O 587447062 KSQDDHCNTYJBCE-NBGIEHNGSA-N 366.416 5.490 5 1 FKBF Nc1cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc2c1 587252011 QEYCERSZFYNGLH-UHFFFAOYSA-N 359.432 6.272 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(COc3ccccc3)c12 587646183 WKDRECPLAVTKON-UHFFFAOYSA-N 362.360 5.461 5 1 FKBF CC1=C(/C=C/C(C)=C\C=C\C(C)=C\C=C\C=C(\C)CO)C(C)(C)C[C@@H](O)C1 13371191 XVQDCCGQSOTQBN-LJINJRKVSA-N 368.561 5.984 5 1 FKBF endogenous,in-man O=[N+]([O-])c1cccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-c2ccccc2)c1 587647950 VFQGZGPIZZWBRY-UHFFFAOYSA-N 359.341 5.318 5 1 FKBF CC(C)=CCC/C(C)=C/c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587968118 KXDYCUGOSIWEFS-PKNBQFBNSA-N 364.243 5.383 5 1 FKBF COc1cc(F)cc2[nH]c3cc(Oc4ccc(Cl)cc4)ccc3c(=O)c12 1911586670 PYZKUMZYODUIET-UHFFFAOYSA-N 369.779 5.275 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169338476 CYSYOXUUGZRCBN-HRAATJIYSA-N 374.311 5.865 5 1 FKBF O=C(c1c(-c2ccc(Cl)cc2)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F 587645014 HMAMQWCKKWPUOL-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2cc(F)cc(F)c2[nH]1 586969761 XVFRPUYCFXDWHB-UHFFFAOYSA-N 363.389 5.164 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587161241 LQBLWURUWRLKMM-GJZGRUSLSA-N 354.388 5.070 5 1 FKBF O=C(CCc1ccccc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587954141 FJSFWEKUMOPDDZ-UHFFFAOYSA-N 350.421 5.685 5 1 FKBF O=C1c2ccccc2-c2cc(-c3ccc(F)cc3[N+](=O)[O-])nc3cccc1c23 587103654 MQIAWLHLSUQQAM-UHFFFAOYSA-N 370.339 5.161 5 1 FKBF O=[N+]([O-])c1ccc(-c2ccccc2[C@@H]2NCCc3cc(Cl)ccc32)cc1 963391291 SAKRSVUGQXSPGR-OAQYLSRUSA-N 364.832 5.150 5 1 FKBF C[C@@H](Cn1c2c3ccccc3ccc2c2oc(=O)c3ccccc3c21)N(C)C 1625576 LZXKLIZZZXXCCH-HNNXBMFYSA-N 370.452 5.004 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587951607 HQBWAWGBIQDELE-JKSBSHDWSA-N 372.512 6.916 5 1 FKBF O=C(C[C@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1ccccc1 49807774 PONOGVXIIRSESP-FQEVSTJZSA-N 352.434 5.229 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)o1 587266129 VOGLBZBKAYZUIW-UHFFFAOYSA-N 373.290 5.417 5 1 FKBF CN(C)CCCNc1nc2ccccc2c2cc3[nH]c4ccccc4c3cc12 2382229451 QJRNZQHXNGTGMO-UHFFFAOYSA-N 368.484 5.386 5 1 FKBF COc1ccc2[nH]cc(-c3nc4ccccc4c4cc5ccccc5n34)c2c1 49111447 MXDYEFACQGZMIU-UHFFFAOYSA-N 363.420 5.798 5 1 FKBF CCCCCCc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 45374507 MVVHROGXEBQAQX-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF CC[C@@H](Oc1ccccc1Cl)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587061461 GYDAQNICBATWRT-CQSZACIVSA-N 366.204 5.308 5 1 FKBF Nc1ccc(C(=O)CCc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587252136 XFRUOPSBYUCULR-UHFFFAOYSA-N 365.436 5.267 5 1 FKBF Cc1cc(C)c2c(=O)c3ccccc3n(CCCCN3CCCCC3)c2c1 103273226 UJBZACHBQDYHGY-UHFFFAOYSA-N 362.517 5.038 5 1 FKBF Cc1cc(Cl)cc2c(-c3ccccc3)c(-c3cccc([N+](=O)[O-])c3)[nH]c12 587627466 XOCHMJXFIYEOFH-UHFFFAOYSA-N 362.816 6.372 5 1 FKBF CCOC(=O)c1c(-c2ccc([N+](=O)[O-])cc2)[nH]c2ccc([C@H](C)CC)cc12 587642456 MAAVZGRBBQTLDD-CYBMUJFWSA-N 366.417 5.433 5 1 FKBF O=C1C[C@@H](c2ccc3ccccc3c2[N+](=O)[O-])Oc2c1ccc1c2CCCC1 587512300 MVLJHMHNLRRQGH-NRFANRHFSA-N 373.408 5.333 5 1 FKBF Brc1cccc(Nc2ncnc3c2ccc2ccccc23)c1 96914116 XSIRMZRJHPWTIH-UHFFFAOYSA-N 350.219 5.289 5 1 FKBF O=[N+]([O-])c1ccc(Nc2nc(-c3c(Cl)cccc3Cl)cs2)cc1 103279072 MRGKDXSUXZKKIU-UHFFFAOYSA-N 366.229 5.769 5 1 FKBF Cc1c(-c2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)cccc1[N+](=O)[O-] 587260823 HIHSWCXCSKWQQK-UHFFFAOYSA-N 355.703 5.119 5 1 FKBF COc1cc2c(c3nc4ccc5ccccc5c4c(OC)c13)C=CC(C)(C)O2 38209003 USHUVZJRNFSMPQ-UHFFFAOYSA-N 371.436 5.743 5 1 FKBF COc1ccc(-c2csc(Nc3ccc(Cl)cc3[N+](=O)[O-])n2)cc1 299837062 PDNBJRBBTNDDNC-UHFFFAOYSA-N 361.810 5.124 5 1 FKBF CN1CCN(CCCCNc2cc3cccc4ccc5cccc2c5c43)CC1 299839184 RWQGULFZGAXFDF-UHFFFAOYSA-N 371.528 5.024 5 1 FKBF [O-][N+](CCc1c[nH]c2ccccc12)(Cc1cccs1)Cc1cccs1 71411389 FZKCXWITNADZDZ-UHFFFAOYSA-N 368.527 5.548 5 1 FKBF CCOc1ccc(-c2cc(=O)c3ccc4ccccc4c3o2)cc1OCC 73291892 HHWMKRNWUGWKTF-UHFFFAOYSA-N 360.409 5.411 5 1 FKBF CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2cc(F)c(F)cc2[nH]1 586968562 FTJBWUAJYDVPSS-UHFFFAOYSA-N 363.389 5.164 5 1 FKBF C[C@@H](CSc1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587169887 DYJWWDZEEWCTCW-VIFPVBQESA-N 365.817 5.159 5 1 FKBF CCCc1c(-c2ccc(Br)c(C)c2)[nH]c2cc([N+](=O)[O-])ccc12 587644332 VHTBAKASPCQCQG-UHFFFAOYSA-N 373.250 5.767 5 1 FKBF Cc1ccc2c([C@@H](C[N+](=O)[O-])c3cccs3)c(C3CCCCC3)[nH]c2c1 1857603913 NMQWQEUPCLVIRV-KRWDZBQOSA-N 368.502 5.994 5 1 FKBF COc1ccc(/C=C/c2cc(=O)oc3c2ccc2c(OC)cccc23)cc1 1857617281 RFXOQPIFVXKOIG-RMKNXTFCSA-N 358.393 5.134 5 1 FKBF Cc1cc2[nH]c([C@H]3C[C@H]3c3c(Cl)cccc3Cl)nc2cc1[N+](=O)[O-] 587052207 YNWHUOWLWDDWQL-ZJUUUORDSA-N 362.216 5.357 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339368 PKKNIAXJILSMLH-HRAATJIYSA-N 374.311 5.865 5 1 FKBF Cc1ccc2c(Cl)c(C(=O)c3coc4cc([N+](=O)[O-])ccc34)sc2c1 587280338 AKCDVQSFJGWWLY-UHFFFAOYSA-N 371.801 5.749 5 1 FKBF Cc1cc(-c2ccc(C(F)(F)F)cc2)cc2c3ccccc3c[n+](C)c12 1857538728 RZOGQZFRQPZUOW-UHFFFAOYSA-N 352.379 5.812 5 1 FKBF COc1cc2c(SCCN(C)C)nc3ccccc3c2c2ccccc12 1651656 ABIVZBOIWVZRAA-UHFFFAOYSA-N 362.498 5.204 5 1 FKBF O=C1c2ccccc2[C@]2(c3c4ccccc4cc4ccccc34)SCCN12 6584050 SLZIXYGPYFYCPU-XMMPIXPASA-N 367.473 5.397 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C/c3ccc(SC(F)(F)F)cc3)[nH]c12 587125493 RENHFUHCQYEOBR-RMKNXTFCSA-N 365.336 5.253 5 1 FKBF O=c1c2ccc(Oc3ccc(Cl)cc3)cc2[nH]c2cc(F)cc(F)c12 1911571738 UFSQSAPVCNYMRV-UHFFFAOYSA-N 357.743 5.405 5 1 FKBF CCc1cccc2c1ccc1c3occ(-c4ccc(OC)cc4)c3c(=O)oc21 45358391 MCHBMOBCDHJGLB-UHFFFAOYSA-N 370.404 5.930 5 1 FKBF O=[N+]([O-])c1cccc(-c2[nH]c3cc(F)ccc3c2-c2nc3ccccc3[nH]2)c1 587635367 FXJHCCJOGGIZIY-UHFFFAOYSA-N 372.359 5.426 5 1 FKBF COc1cc2c(c3c1c(=O)c1c4ccccc4ccc1n3C)C=CC(C)(C)O2 40564620 AFDUZQMCEPLFAC-UHFFFAOYSA-N 371.436 5.038 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccccc2c2cc(C(F)(F)F)ccc12 169339413 XNKDPYCWUQDKAX-IERDGZPVSA-N 373.418 5.577 5 1 FKBF CC/C(=C/c1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccc(C)cc1 587965749 DINMKVACGXLLMB-VLGSPTGOSA-N 362.476 7.128 5 1 FKBF Cc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2C(=O)C(F)(F)F)cc1C 587645065 JROJHZQQCPHUGH-UHFFFAOYSA-N 362.307 5.105 5 1 FKBF CC(C)=CCOc1cc2oc3ccccc3c(=O)c2c(O)c1CC=C(C)C 28650399 KFUPFOSHOPBDIX-UHFFFAOYSA-N 364.441 5.506 5 1 FKBF O=C(CC(c1ccccc1)c1ccccc1)c1coc2cc([N+](=O)[O-])ccc12 587278983 CKCRPSIQAXOZMR-UHFFFAOYSA-N 371.392 5.746 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2cccc(F)c2)[nH]c2ccccc12 1857570867 QKKGSDSZOLZEFK-IBGZPJMESA-N 360.388 5.383 5 1 FKBF O=[N+]([O-])c1cccc(-c2cncc(-c3nc4cc5ccccc5cc4[nH]3)c2)c1 587269776 GPCNBIANNDYFBI-UHFFFAOYSA-N 366.380 5.353 5 1 FKBF Cc1cc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2N2CCCCC2)cc(C)c1O 587649669 WTHFJTDDTLWGEW-UHFFFAOYSA-N 365.433 5.056 5 1 FKBF CC[C@H](Oc1ccccc1F)c1nc2c3cccnc3c3ncccc3c2[nH]1 587155054 IYMFLKDBBIYQFE-INIZCTEOSA-N 372.403 5.329 5 1 FKBF O=C(c1c(-c2cccc3ccccc23)[nH]c2cc([N+](=O)[O-])ccc12)C(F)F 587646381 QVQLUYLZALATNV-UHFFFAOYSA-N 366.323 5.344 5 1 FKBF Cc1ccccc1C(C)(C)c1nc2c3ccccc3c3ccccc3c2[nH]1 587954577 ARYJJGYEKVJGFU-UHFFFAOYSA-N 350.465 6.504 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(Sc3ccccc3)c12 587645914 ONXMAANCNTXQPS-UHFFFAOYSA-N 364.401 6.033 5 1 FKBF C[C@]1(c2ccc3cc4ccccc4cc3c2)NCCc2nc3ccccn3c21 962992679 YRVBVYYUEMCDIS-RUZDIDTESA-N 363.464 5.050 5 1 FKBF Cc1ccc(SCc2nc3c4cccnc4c4ncccc4c3[nH]2)c(C)c1 586964949 OYLIXBLCNQTIOH-UHFFFAOYSA-N 370.481 5.568 5 1 FKBF CC1(C)CCc2c(c3ccccc3c3nc(-c4ccc([N+](=O)[O-])cc4)[nH]c23)O1 39179367 XJQANOXEXMZCLB-UHFFFAOYSA-N 373.412 5.395 5 1 FKBF Cc1cc(F)c2nc(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2c1 587272444 SNGLJKUXCLIORC-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF CCCN1CCC(COc2nc3cc(F)ccc3c3ccccc23)CC1 95572712 DBUWXKOGBDPUGP-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF Cc1ccc2c([C@H](C[N+](=O)[O-])c3nccs3)c(-c3ccccc3)[nH]c2c1 2382244090 QBUCGGZWSKCNDL-INIZCTEOSA-N 363.442 5.008 5 1 FKBF O=c1c2ccccc2oc2cc(-c3ccc(O)cc3)c(-c3ccccc3)cc12 64491972 NQWXEGZRMFZSTK-UHFFFAOYSA-N 364.400 5.986 5 1 FKBF Cc1cc2nc(-c3sccc3-c3ccc(F)cc3)[nH]c2cc1[N+](=O)[O-] 587165232 NECVTQJVPQBXQH-UHFFFAOYSA-N 353.378 5.314 5 1 FKBF COc1cc(-c2ccc(C(F)(F)F)cc2)cc2c3ccccc3c[n+](C)c12 1857537711 RCWJXFPKXLYVPE-UHFFFAOYSA-N 368.378 5.512 5 1 FKBF O=C1c2ccccc2-c2cc(-c3cc(F)ccc3[N+](=O)[O-])nc3cccc1c23 587103615 LUUILTMYOSOPLS-UHFFFAOYSA-N 370.339 5.161 5 1 FKBF O=C(c1ccc(OCc2ccccc2)cc1)c1coc2cc([N+](=O)[O-])ccc12 587279343 GNNBEZRSYLQGIT-UHFFFAOYSA-N 373.364 5.151 5 1 FKBF CCC(=O)c1c(-c2ccc(C(F)(F)F)cc2)[nH]c2cccc([N+](=O)[O-])c12 587645988 HSZOGOLVFIZKCT-UHFFFAOYSA-N 362.307 5.355 5 1 FKBF C(=C/c1cccc2ccccc12)\c1nc2c3cccnc3c3ncccc3c2[nH]1 587967662 IEMSCSOKKQXCAB-OUKQBFOZSA-N 372.431 5.983 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@H]3SCCc4sccc43)nc21 587036779 NAKYXEJEJDMZTR-NRFANRHFSA-N 372.518 6.310 5 1 FKBF O=[N+]([O-])c1sccc1-c1c(Cl)cc(Cl)c(Cl)c1[N+](=O)[O-] 103208486 YOAWZALTPGUKRE-UHFFFAOYSA-N 353.570 5.192 5 1 FKBF Fc1ccc2c(c1)C[C@@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)O2 587174099 MFFMOYACVKXPBP-FQEVSTJZSA-N 354.384 5.685 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc4ccccc4cc3[nH]2)o1 587264182 CTBZAIDWZCUPKF-UHFFFAOYSA-N 355.353 5.551 5 1 FKBF CN(C)c1ccc2nc3c4ccccc4c(=Nc4ccccc4)cc-3oc2c1 377820817 VMBGRJCPNUZDOL-UHFFFAOYSA-N 365.436 5.384 5 1 FKBF Cc1ccc2ccccc2c1-c1nc2c3cccnc3c3ncccc3c2[nH]1 586884610 VDLANIUJEUVIPD-UHFFFAOYSA-N 360.420 5.788 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(-c3cccc([N+](=O)[O-])c3)c(-c3ccccc3)c2c1 587642854 PGFBJKZXYFWWMK-INIZCTEOSA-N 370.452 6.924 5 1 FKBF Cc1ccc2c(ccc3[nH]c(-c4ccc(-c5ccccc5[N+](=O)[O-])o4)nc32)n1 587264074 ACPIYEFJFISWDQ-UHFFFAOYSA-N 370.368 5.255 5 1 FKBF C/C(=C/c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)C1CCCCC1 587967383 JEZONPDPDZBNRL-YFHOEESVSA-N 364.243 5.217 5 1 FKBF Cc1cccc(N2CCN(c3nc4ccccc4c4ccccc34)CC2)c1 103264626 XQGSVFBULZNVPG-UHFFFAOYSA-N 353.469 5.023 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccccc2c2c(C(F)(F)F)cccc12 169338952 RJPPUDBSXRWQTA-QRWLVFNGSA-N 373.418 5.577 5 1 FKBF Fc1cccc([C@H]2C[C@@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587160529 CXMQVYVNXRKJHF-SJORKVTESA-N 354.388 5.070 5 1 FKBF c1ccc2nc3cc4[nH]c([C@]56CCC[C@H]5[C@H]5CC[C@H]6C5)nc4cc3nc2c1 586890250 NWISBMGTJOCDEU-NIUAMNACSA-N 354.457 5.127 5 1 FKBF CCOc1n[nH]c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1Cl 587065653 WFWDWDQXUCXROO-UHFFFAOYSA-N 362.820 5.312 5 1 FKBF CCOc1ccccc1Nc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12 1772623214 LMKGHJCEXPVLKV-UHFFFAOYSA-O 368.460 5.441 5 1 FKBF Cc1ccc2c(ccc3nc(/C=C\c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c32)n1 587048062 PNNZCYNCKHFPNG-WTKPLQERSA-N 364.792 5.152 5 1 FKBF Cc1cc(C)c2nc(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2c1 587272617 WQVRNSMLNUICAC-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF COc1ccc(/C=C/c2cc(=O)oc3c2ccc2c(C)cccc23)cc1OC 1857574999 PBEHPWVYOAHLFS-VQHVLOKHSA-N 372.420 5.442 5 1 FKBF Clc1ccc2nc3[nH]c4ccccc4c3c(NCCN3CCCC3)c2c1 40901195 QOIAZKYKNOHSOM-UHFFFAOYSA-N 364.880 5.030 5 1 FKBF Cc1cc2[nH]c([C@@H]3C[C@@H]3c3c(Cl)cccc3Cl)nc2cc1[N+](=O)[O-] 587052206 YNWHUOWLWDDWQL-VHSXEESVSA-N 362.216 5.357 5 1 FKBF O=c1c2ccccc2[nH]c2c(Cl)cc(Cl)c(NC3CCCCC3)c12 5543299 XKDPBQFHVVRYSL-UHFFFAOYSA-N 361.272 5.733 5 1 FKBF CCCN1CCC(COc2nc3cc(Cl)ccc3c3ccccc23)CC1 95578727 OKQQSELFJPRKMP-UHFFFAOYSA-N 368.908 5.542 5 1 FKBF Cc1cc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2cc1Cl 587264142 CCXAVYFECJKVSO-UHFFFAOYSA-N 353.765 5.360 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2cccc(F)c2)[nH]c2ccccc12 1857570868 QKKGSDSZOLZEFK-LJQANCHMSA-N 360.388 5.383 5 1 FKBF COc1cc2cc(CN3CCCC[C@H]3C)c3ccc(O)cc3c2cc1OC 28565503 LGGSFSLBLIQBAZ-OAHLLOKOSA-N 365.473 5.090 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3c(C(F)(F)F)cccc3[nH]2)o1 587264158 CGLGGGFADTWLPH-UHFFFAOYSA-N 373.290 5.417 5 1 FKBF c1ccc2c(c1)N[C@H](c1cc3ccccc3c3ccccc13)[C@@H]1CCCO[C@H]21 95574782 UOVBAOZXTRRJFJ-UCGXPXSYSA-N 365.476 6.628 5 1 FKBF CCCCCOc1ccc(C(=O)c2coc3cc([N+](=O)[O-])ccc23)cc1 587278997 CPPREFUWMNFPEE-UHFFFAOYSA-N 353.374 5.141 5 1 FKBF COc1ccc(-c2[nH]c3cccc(F)c3c2-c2ccccc2[N+](=O)[O-])cc1 587636388 ZOKXWGAQISIAAT-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF c1ccc2c(c1)C[C@@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)S2 587043620 UHUYKIMSYJRDNS-FQEVSTJZSA-N 352.462 6.259 5 1 FKBF O=[N+]([O-])c1cc2nc(Cc3ccc(-c4ccccc4)c(F)c3)[nH]c2cc1F 587144826 CAMFOZHBWQWICM-UHFFFAOYSA-N 365.339 5.007 5 1 FKBF O=C(c1ccc(C(F)(F)F)cc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280232 PCNURGLCJUZIHC-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF Cc1ccc2c(O)nc3c(C)cc(O)c(-c4ccc([C@@H](C)N)cc4)c3c2c1 1857554234 ZIFFLWUKZRSOOA-CQSZACIVSA-N 358.441 5.103 5 1 FKBF O=C(Cc1ccc(-c2ccccc2)cc1)c1coc2cc([N+](=O)[O-])ccc12 587279314 GAOGFHMYDKYPAG-UHFFFAOYSA-N 357.365 5.433 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2c3cccnc3c3ncccc3c2[nH]1 587951590 HMEFICSQXIUBMU-DAYGRLMNSA-N 374.488 5.706 5 1 FKBF CC1=C(/C=C/C(C)=C\C=C\C(C)=C\C=C\C=C(\C)CO)C(C)(C)C[C@H](O)C1 13371189 XVQDCCGQSOTQBN-ADEFWGKCSA-N 368.561 5.984 5 1 FKBF endogenous,in-man Cc1cc([N+](=O)[O-])c(Sc2cc(C)c(Cl)cc2Cl)c([N+](=O)[O-])c1 40848192 WDBYEFALTAWFSU-UHFFFAOYSA-N 373.217 5.578 5 1 FKBF Cc1ccc2oc(=O)cc(Cc3c4ccccc4nc4ccccc34)c2c1 64539018 GUYMSWVTTGMXPT-UHFFFAOYSA-N 351.405 5.394 5 1 FKBF c1cnc2c(c1)c1nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c1c1cccnc12 586892781 WJRFGRALIOBEMX-XYVVENMHSA-N 354.457 5.127 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccccc3Cl)c(-c3ccc(F)cc3)c12 587645417 AXGOMXZIGAXKHR-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF CC[C@@H](C)c1ccc(NC(=O)c2c(C)[nH]c3cc([N+](=O)[O-])ccc23)cc1 587647313 VLQPTQMJBIRGPL-GFCCVEGCSA-N 351.406 5.150 5 1 FKBF COC(=O)C=CC(C)=CC=CC(C)=CC=C(C)C=CC=C(C)C=CC(=O)O 2356713684 OVHMOSCQCVKHCV-UHFFFAOYSA-N 368.473 5.254 5 1 FKBF C[N+]1(C)CCC[C@H]1c1ccc([C@](O)(c2ccccc2)C2CCCCC2)o1 45256753 AVNRDCQRRUOTCC-REWPJTCUSA-N 354.514 5.007 5 1 FKBF CCc1oc2ccccc2c1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 586903984 PEPITQHNDUUPNH-UHFFFAOYSA-N 364.408 5.635 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)c(F)c(F)c3[nH]2)ccc1Cl 587047802 NSJYJKKPXFFGIY-RQOWECAXSA-N 370.142 5.227 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587951609 HQBWAWGBIQDELE-YVHKJVDXSA-N 372.512 6.916 5 1 FKBF Brc1ccc2c(c1)-c1nc3cnc4ccccc4c3cc1CO2 1857768018 KODNPNJYAMHIOG-UHFFFAOYSA-N 363.214 5.105 5 1 FKBF Cc1cccc2c1cc1n2-c2ccccc2N[C@H]1c1ccc([N+](=O)[O-])cc1 71331609 QHVHCYMPFQMFQG-QFIPXVFZSA-N 355.397 5.362 5 1 FKBF O=C(c1ccc(Cl)cc1C(F)(F)F)c1coc2cc([N+](=O)[O-])ccc12 587280199 NPCQITFBBBGUBQ-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587953066 ZAAMADPLWHZJOH-UVWXRNBGSA-N 351.834 5.171 5 1 FKBF c1ccc2c(c1)C[C@H](c1nc3cc4nc5ccccc5nc4cc3[nH]1)S2 587043191 QLPRRDKZIRHFAI-HXUWFJFHSA-N 354.438 5.049 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169338480 CYSYOXUUGZRCBN-IIBYNOLFSA-N 374.311 5.865 5 1 FKBF Clc1ccc(Cn2c3cccc4cccc(c43)n3cnnc23)c(Cl)c1 1772590763 SJFHKHFTJXSALV-UHFFFAOYSA-N 367.239 5.192 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)c(F)c(F)c3[nH]2)ccc1Cl 587047801 NSJYJKKPXFFGIY-DUXPYHPUSA-N 370.142 5.227 5 1 FKBF Nc1cc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c2ccccc2c1 587252499 YBJYWOVROQKSDK-UHFFFAOYSA-N 361.408 5.062 5 1 FKBF CCN(CC)CCC[C@@H](C)NCc1ccc2ccc3cccc4ccc1c2c34 26399627 MOPXTAMLOHHYIB-LJQANCHMSA-N 372.556 6.184 5 1 FKBF CCCCCCc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2Cl)cc1 45335767 RAKCHFJSTNMGFC-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF CC(=O)Oc1ccc(Nc2c3ccccc3nc3c2[nH]c2ccccc23)cc1 473151522 PSGZXUBNJHWOQM-UHFFFAOYSA-N 367.408 5.538 5 1 FKBF Clc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)nc1Cl 587084693 RDYVLFPHMLBGME-UHFFFAOYSA-N 366.211 5.028 5 1 FKBF FC(F)(F)[C@@](F)(Cl)c1nc2c3ccccc3c3ccccc3c2[nH]1 587089912 IQRUMUJUDQCNGY-MRXNPFEDSA-N 352.718 5.793 5 1 FKBF O=c1c2ccccc2n(CCCCN2CCCCC2)c2ccc(Cl)cc12 29037571 HRUVQGQKSJUBOM-UHFFFAOYSA-N 368.908 5.074 5 1 FKBF O=[N+]([O-])c1cc2nc(/C=C/c3cccc(Cl)c3Cl)[nH]c2cc1F 587053818 ISRBJFJAJUIKJS-SNAWJCMRSA-N 352.152 5.087 5 1 FKBF CCc1ccc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c2c1 587272364 RDOPRPZJNULDOF-UHFFFAOYSA-N 359.385 5.493 5 1 FKBF c1ccc2nc3cc4[nH]c([C@@]56CCC[C@H]5[C@H]5CC[C@H]6C5)nc4cc3nc2c1 586890244 NWISBMGTJOCDEU-BDTDXFHBSA-N 354.457 5.127 5 1 FKBF CCc1ccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)cc1 1772597349 FRTZDTDMCBIXRJ-UHFFFAOYSA-N 352.437 5.873 5 1 FKBF COc1cc2c3c(c1)O[C@H](c1cc4ccccc4c4ccccc14)[C@@H](C2)C3=O 587446792 FVZYZSAKRPZOPP-SQJMNOBHSA-N 366.416 5.490 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccc(C(F)(F)F)cc2c2ccccc12 169339401 IMIVAWPBXCYUSL-IERDGZPVSA-N 373.418 5.577 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2c(C(F)(F)F)cccc12 169338951 RJPPUDBSXRWQTA-MGPUTAFESA-N 373.418 5.577 5 1 FKBF Cc1ccc(-c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)cc1[N+](=O)[O-] 587105336 YWYLLVBLVTXDQD-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF COc1ccc(/C=C/c2cc(=O)oc3c2ccc2ccccc23)cc1OC 1857587992 OYCDCZOQRQFYAI-VQHVLOKHSA-N 358.393 5.134 5 1 FKBF CCN(CC)C(=O)c1ccc(Nc2ccnc3cc4ccccc4cc23)cc1 3056470 GIMYHOHVUHAYJF-UHFFFAOYSA-N 369.468 5.614 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1F 587153217 WYTMEAVTZAAHHJ-OALUTQOASA-N 370.402 6.419 5 1 FKBF Cc1nc2ccccc2c(Cl)c1Cc1c(C)[nH]c2cc([N+](=O)[O-])ccc12 587645318 PLVPRWJSJYWGSR-UHFFFAOYSA-N 365.820 5.485 5 1 FKBF O=[N+]([O-])c1cccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-c2ccccc2)c1 587647919 TUEIRESDDHCIRN-UHFFFAOYSA-N 359.341 5.318 5 1 FKBF Cc1ccc(C2=Cc3ccccc3[C@H](C[N+](=O)[O-])N2c2ccc(F)cc2)cc1 653801297 LDQOCFLBPYPPMH-QHCPKHFHSA-N 374.415 5.470 5 1 FKBF C/C(=C\c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)C1CCCCC1 587966699 DYGNAERVIYJOEA-MDZDMXLPSA-N 364.243 5.217 5 1 FKBF c1ccc2c(c1)C[C@@H](c1nc3cc4nc5ccccc5nc4cc3[nH]1)S2 587043190 QLPRRDKZIRHFAI-FQEVSTJZSA-N 354.438 5.049 5 1 FKBF c1ccc2oc(CCc3nc4c5ccccc5c5ccccc5c4[nH]3)cc2c1 586906307 BCWHNMCRJZPBDM-UHFFFAOYSA-N 362.432 6.401 5 1 FKBF C[C@H](Oc1ccc(F)c(F)c1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587148455 AIILUWFRDOLPRN-ZDUSSCGKSA-N 374.390 6.288 5 1 FKBF Cc1cc2c(cc1C(=O)O)nc(Nc1cccc(Cl)c1)c1ccncc12 66104867 QYCAXPZBXKEFNF-UHFFFAOYSA-N 363.804 5.187 5 1 FKBF CCCc1cc(=O)oc2c1c(-c1ccc(F)cc1)cc1oc([N+](=O)[O-])cc12 169342972 VVHCMHGUMLYVTN-UHFFFAOYSA-N 367.332 5.206 5 1 FKBF Cc1c2ccn(C)cc2c(C)c2c1nc1ccc(O)c(OCC(F)(F)F)c12 377819874 ACIYKIGHVRYKTA-UHFFFAOYSA-N 374.362 5.143 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc3c(ccc4ccccc43)c1)O2 587406484 RSEPFTQNHFOXPT-VWLOTQADSA-N 367.448 5.764 5 1 FKBF Cc1cccc(C)c1-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 95564506 OSBODHIZQIUNQR-DQEYMECFSA-N 374.592 6.539 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2c(Cl)cc(Cl)cc2c2ccccc12 169338948 MEDAUDVOOZRWLE-SPLOXXLWSA-N 374.311 5.865 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2ccccc2c2c(Cl)cc(Cl)cc12 169339355 DDSTWKISZLVRST-QRWLVFNGSA-N 374.311 5.865 5 1 FKBF Cc1cc(Cl)cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 587109878 PGLCUXMZZGYLLC-UHFFFAOYSA-N 369.730 5.043 5 1 FKBF c1ccc([C@@H]2C[C@H]2Cc2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 587962212 VWOQFLHWJXBHNS-YJBOKZPZSA-N 350.425 5.006 5 1 FKBF COc1ccc(-c2cc(-c3ccccc3)nc3cnc4ccccc4c23)cc1 1772631742 KRRAMKGIRYHIEV-UHFFFAOYSA-N 362.432 6.126 5 1 FKBF O=[N+]([O-])c1ccc2c(C3CC3)c(-c3ccc(Br)cc3)[nH]c2c1 587644365 WGJVVQSJPBJFTF-UHFFFAOYSA-N 357.207 5.383 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3csc(-c4ccc(Cl)cc4)n3)[nH]c2cc1F 587015971 LQCYDVQXQDXTRG-UHFFFAOYSA-N 374.784 5.054 5 1 FKBF C[C@@H]1CCCN1CCc1cc2cc(Nc3ccccc3[N+](=O)[O-])ccc2o1 13674368 BRNUYGZFXCZDOD-OAHLLOKOSA-N 365.433 5.111 5 1 FKBF CCOc1ccc2ccccc2c1C(=O)c1coc2cc([N+](=O)[O-])ccc12 587279675 NWKFDXLVCJEHTL-UHFFFAOYSA-N 361.353 5.124 5 1 FKBF Cc1cc(CCCOc2c(C)cc(-c3ccc([N+](=O)[O-])cc3)cc2C)on1 3590513 SZLPTFXRPFCVTK-UHFFFAOYSA-N 366.417 5.187 5 1 FKBF CSc1ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2c1 586972231 FNFLXHDLAMSNFQ-UHFFFAOYSA-N 373.503 5.608 5 1 FKBF Cn1c(-c2c(-c3ccccc3)[nH]c3cc([N+](=O)[O-])ccc23)nc2ccccc21 587646990 BRPSXKHYKOWASQ-UHFFFAOYSA-N 368.396 5.297 5 1 FKBF Cn1c(-c2ccccc2)c([C@@H](C[N+](=O)[O-])c2ccccc2)c2ccccc21 1857542889 OFTOXEBAWTUTNR-FQEVSTJZSA-N 356.425 5.254 5 1 FKBF C[N+]12CCCC[C@@H]1[C@H](CN1c3ccccc3Sc3ccccc31)CCC2 71294682 WHBJMLSMNQEBKY-BBRSIGJESA-N 365.566 5.698 5 1 FKBF FC(F)=C(C[C@@H]1CCCN1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587087119 BBFPXBAODLQGID-ZDUSSCGKSA-N 363.411 5.619 5 1 FKBF O=[N+]([O-])c1cccc(CCc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587269848 HRHQBWGUPQUDRM-UHFFFAOYSA-N 367.408 5.563 5 1 FKBF COc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c(Cl)n1 587084324 YJFDROQYUSNBBI-UHFFFAOYSA-N 359.816 5.593 5 1 FKBF Cn1c2c3ccccc3nc-2c(NCCCN2CCCCC2)c2ccccc21 169729279 GZBSVBSKUXBDFW-UHFFFAOYSA-N 372.516 5.119 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 586893472 ZKAUUNWUMYUZSE-HOYKHHGWSA-N 362.436 5.031 5 1 FKBF C[N@@+]12C=CC=C1[C@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 254194042 WPEKCJPMSAXMJK-WMZHIEFXSA-N 355.914 5.567 5 1 FKBF O=[N+]([O-])c1cccc2c(Sc3ccc(C(F)(F)F)cc3)cc(O)nc12 299868491 RNFKEPXNYPIQHF-UHFFFAOYSA-N 366.320 5.019 5 1 FKBF O=[N+]([O-])c1ccc2oc3nccc(NCc4ccc(Cl)cc4)c3c2c1 1857763365 KYWJVKSSGWBSTQ-UHFFFAOYSA-N 353.765 5.155 5 1 FKBF NC[C@H]1C[C@H](c2cc3ccccc3c3ccccc23)N(Cc2ccccc2)O1 66074959 AITWXFPAQNDRGX-CJFMBICVSA-N 368.480 5.199 5 1 FKBF COc1ccc2[nH]c3c(C)c4ccnc(NCCC(C)C)c4c(C)c3c2c1 6069475 AIKGNCPHGNDPFI-UHFFFAOYSA-N 361.489 5.953 5 1 FKBF Cc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-c2ccc(Cl)cc2)cc1 587644971 SLJPYDNAXIAUAY-UHFFFAOYSA-N 362.816 6.372 5 1 FKBF O=C(c1cccc2ccccc12)c1c(C(F)F)[nH]c2cc([N+](=O)[O-])ccc12 587646100 JNMVOJBOTYBYAL-UHFFFAOYSA-N 366.323 5.398 5 1 FKBF CCc1ccc(-c2nc3c([N+](=O)[O-])c(Br)ccc3[nH]2)cc1CC 586878282 BZPPFCUKWWBIMB-UHFFFAOYSA-N 374.238 5.025 5 1 FKBF O=C(O)/C=C\c1ccccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 586878301 CHAJYFXYGVLHJY-YPKPFQOOSA-N 364.404 5.634 5 1 FKBF CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2c3cccnc3c3ncccc3c2[nH]1 587951593 HMEFICSQXIUBMU-VKJFTORMSA-N 374.488 5.706 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nnc(-c3ccc(Cl)cc3)o2)o1 103211819 XBXQZXUJUKNMKF-UHFFFAOYSA-N 367.748 5.225 5 1 FKBF Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2ccc([N+](=O)[O-])cc2[nH]1 587012095 NWWDHOPGBOZOCT-UHFFFAOYSA-N 370.821 5.223 5 1 FKBF CCc1ccc(-c2nc(-c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)cs2)cc1 587015976 LZVXBUMDVSTOMK-UHFFFAOYSA-N 364.430 5.132 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1F 587152342 LZTSKJRZNBMKES-CHWSQXEVSA-N 372.378 5.209 5 1 FKBF CC(C)=CCc1c2c(c(O)c3c(=O)c4ccccc4[nH]c13)C=CC(C)(C)O2 13380768 ZFPOMIPUJBBEKD-UHFFFAOYSA-N 361.441 5.080 5 1 FKBF biogenic,in-vitro C[C@@]1(c2ccc([N+](=O)[O-])cc2Cl)CC(=O)c2ccc3c(c2O1)CCCC3 587510336 YPKJKIVBGXRZTB-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(-c3ccc(F)cc3)c12 587645994 PSIICDMVZYYNFT-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF Oc1nc2ccccc2c2cc(-c3cccs3)cc(Nc3ccccc3)c12 2382236872 VMXUNHJFSNCZRR-UHFFFAOYSA-N 368.461 6.566 5 1 FKBF O=[N+]([O-])c1ccc2c3c([N+](=O)[O-])ccc4ccc5ccc6ccc1c2c6c5c43 5845759 SFCASHHOWLOBOG-UHFFFAOYSA-N 366.332 6.145 5 1 FKBF CCOc1ccccc1N=c1c2ccccc2n(C)c2c1oc1ccccc12 1772617337 KDYVVNFXTMAKKY-UHFFFAOYSA-N 368.436 5.709 5 1 FKBF Cc1ccc2cc3n(c2c1)-c1ccccc1N[C@H]3c1ccc([N+](=O)[O-])cc1 71341736 YAPKPZYUONJFFN-QFIPXVFZSA-N 355.397 5.362 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc4oc5ccccc5c4c3)[C@@H]1C2 95562651 OVZLCNZJIMAHSM-UGKGYDQZSA-N 360.521 6.155 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(Br)cc3)c(C3CC3)c12 587643651 IEBHOCRUMWYYPX-UHFFFAOYSA-N 357.207 5.383 5 1 FKBF CCc1ccc([C@H](Nc2ccc(C)c([N+](=O)[O-])c2)[C@H]2CCCCC2=O)cc1 66262520 WJZLDUFERLJEHF-UGKGYDQZSA-N 366.461 5.378 5 1 FKBF Cc1cccc2ccc3c4c(ccc3c12)[C@@](C)([C@H](C)CCCC(C)C)CC4 111475567 UKMKQDKERXPFHR-NFQMXDRXSA-N 358.569 7.968 5 1 FKBF biogenic C[C@]1(c2cc(Cl)cc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587497450 AVPCVMQAINBKEH-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccc(C(F)(F)F)cc2c2ccccc12 169339399 IMIVAWPBXCYUSL-HRAATJIYSA-N 373.418 5.577 5 1 FKBF O[C@H]1C[C@@H](c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586903085 NIGNKJPYSPIWGU-RTWAWAEBSA-N 350.421 5.438 5 1 FKBF c1ccc2c(c1)OC[C@@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)O2 586917340 BZYKMUOGFCVZIW-FQEVSTJZSA-N 352.393 5.382 5 1 FKBF COc1cccc([C@@H](C)Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587930110 GZYRLEDSKNYIIJ-AWEZNQCLSA-N 368.440 5.014 5 1 FKBF CCCCCCc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 45386829 ZNVFAIGALQROKS-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF COc1cnc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1Cl 587064688 MPHZBUDGBDCKDT-UHFFFAOYSA-N 359.816 5.593 5 1 FKBF O=[N+]([O-])c1ccc(-c2[nH]c3cc(F)ccc3c2-c2nc3ccccc3[nH]2)cc1 587636396 ZVFBSMYJRXVFFX-UHFFFAOYSA-N 372.359 5.426 5 1 FKBF COc1ccc(Cl)cc1-c1[nH]c2cc([N+](=O)[O-])ccc2c1C(F)(F)F 587645282 NWRRQOJNKSNZLS-UHFFFAOYSA-N 370.714 5.424 5 1 FKBF Cc1c2n(c3ccccc13)-c1ccccc1N[C@@H]2c1ccc([N+](=O)[O-])cc1 71331288 MNISEXYKDQBEHY-OAQYLSRUSA-N 355.397 5.362 5 1 FKBF COc1ccc2c(Sc3ccc([N+](=O)[O-])cc3)c3ccoc3nc2c1 29044003 DLNXNKRVKJHRQD-UHFFFAOYSA-N 352.371 5.049 5 1 FKBF Clc1ccc([C@@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724708 JNXFFUXXCQXBBG-VXKWHMMOSA-N 356.856 7.285 5 1 FKBF O=[N+]([O-])c1cccc2c(Sc3ccc(Cl)cc3Cl)cc(O)nc12 299871647 YZIUFUKOVAAVHJ-UHFFFAOYSA-N 367.213 5.307 5 1 FKBF Cc1cc(F)c2[nH]c(-c3cc([N+](=O)[O-])ccc3SCC(C)C)nc2c1 586968856 KEKJWUBPMRVATN-UHFFFAOYSA-N 359.426 5.334 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(F)cc3)c(-c3ccc(Cl)cc3)[nH]c2c1 587645902 OAEHKLHGORQSES-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587951606 HQBWAWGBIQDELE-HOIFWPIMSA-N 372.512 6.916 5 1 FKBF CC(=O)S[C@H]1CC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 1857597711 FUWOOYFXEWDHNG-WKILWMFISA-N 352.455 5.252 5 1 FKBF Clc1cccc(-c2csc(-c3c4ccccc4cc4ccccc34)n2)c1 587921498 ZYWQAHDLRWNFMI-UHFFFAOYSA-N 371.892 7.437 5 1 FKBF Fc1ccc(F)c(-c2csc(-c3c4ccccc4cc4ccccc34)n2)c1 587922703 XBADQGJUJKHXQE-UHFFFAOYSA-N 373.427 7.062 5 1 FKBF COc1cccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)c1 1772618307 SMBZURAYBIBKEI-UHFFFAOYSA-N 354.409 5.319 5 1 FKBF CCCNc1nc2ccccc2c2c(=O)c3ccc(Cl)cc3sc12 2382250934 BAAAWFSGRHPKCH-UHFFFAOYSA-N 354.862 5.438 5 1 FKBF CCCCN(CCCC)CC[C@@H](O)c1c2ccccc2nc2ccccc12 25972138 IFHNTUTXLXIXQU-HSZRJFAPSA-N 364.533 5.714 5 1 FKBF COc1ccc2ccc3cc(Nc4ccc(F)cc4F)ccc3c(=O)c2c1 95580049 WWRBZJPZHKZWHC-UHFFFAOYSA-N 363.363 5.384 5 1 FKBF CCCNCc1cc2nc3ccccc3cc2c2cc3ccccc3nc12 103273132 WQILAACRNLOPLM-UHFFFAOYSA-N 351.453 5.589 5 1 FKBF Cc1cc2[nH]c([C@@H](C)Cc3cccc(C(F)(F)F)c3)nc2cc1[N+](=O)[O-] 587112900 IDPQZBZXMQNTRZ-NSHDSACASA-N 363.339 5.145 5 1 FKBF Cc1ccccc1C(C)(C)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587954654 DJAVVVPXYFAIJM-UHFFFAOYSA-N 352.441 5.294 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339370 PKKNIAXJILSMLH-IIBYNOLFSA-N 374.311 5.865 5 1 FKBF NC(=O)Nc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587243213 GCNAJJABUABLCA-UHFFFAOYSA-N 352.397 5.027 5 1 FKBF CCCn1c(C)c(C(=O)c2cc([N+](=O)[O-])cc3ccccc23)c2ccccc21 28125025 FUQZTABZSHOQOG-UHFFFAOYSA-N 372.424 5.652 5 1 FKBF c1ccc(C[N+]23CCC(CC2)[C@@H](C(c2ccccc2)c2ccccc2)C3)cc1 95592158 MGGAIBHHXKYZIY-KLIUIWTBSA-N 368.544 5.875 5 1 FKBF O=C1c2ccoc2CC[C@@H]1Cc1nc2c3ccccc3c3ccccc3c2[nH]1 586908780 VHCIHBFRAZQENK-CQSZACIVSA-N 366.420 5.450 5 1 FKBF Cc1cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2cc1Cl 587109873 OZAMYVVPXKUCQW-UHFFFAOYSA-N 369.730 5.043 5 1 FKBF CCN(CC)CCC[C@H](C)NCc1ccc2ccc3cccc4ccc1c2c34 26399631 MOPXTAMLOHHYIB-IBGZPJMESA-N 372.556 6.184 5 1 FKBF O=[N+]([O-])c1ccc([C@@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71317428 GQZDURBFXSVNIJ-NRFANRHFSA-N 367.408 5.340 5 1 FKBF Cc1cccc(OCc2nc3c4ccccc4c4ccccc4c3[nH]2)c1C 587563782 JFGCFLULGKRLIM-UHFFFAOYSA-N 352.437 6.065 5 1 FKBF CC(C)(C)OC(=O)N1CCC[C@@H]1c1c(C2CC2)[nH]c2cccc([N+](=O)[O-])c12 587649353 SJGRZUAYONKBCJ-CQSZACIVSA-N 371.437 5.026 5 1 FKBF C(=C\c1cccc2ccccc12)\c1nc2c3cccnc3c3ncccc3c2[nH]1 587967663 IEMSCSOKKQXCAB-SEYXRHQNSA-N 372.431 5.983 5 1 FKBF CCN(CC)CCCNc1[nH]cc(C)c2nc3c(ccc4ccccc43)c1-2 100789780 GWNFHVHWRDNDQE-UHFFFAOYSA-N 360.505 5.273 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1F 587153219 WYTMEAVTZAAHHJ-RBUKOAKNSA-N 370.402 6.419 5 1 FKBF CCC[C@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587514567 ZTLZQBDUIQXJAI-JOCHJYFZSA-N 365.429 5.134 5 1 FKBF CC(C)=CCCC(C)=CCC[C@@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1 2356846577 LIQXVRBBAVQORU-IEBWSBKVSA-N 368.905 5.297 5 1 FKBF Cc1c(F)cccc1-c1cc(-c2nc3ccc(F)cc3[nH]2)cc([N+](=O)[O-])c1 587136401 ZUTOWHZNOWFJLC-UHFFFAOYSA-N 365.339 5.392 5 1 FKBF Cc1c(Cl)ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc12 587265094 MHSMNNKEZCMGLX-UHFFFAOYSA-N 353.765 5.360 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3cccc(F)c3)c(-c3cccc(F)c3)c12 587645586 FCIAVZMIHJLGGX-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF c1ccc2c(c1)cc1c3ccccc3nc(-c3csc4ccccc34)n21 49054992 SXVPTUAVVZGYIZ-UHFFFAOYSA-N 350.446 6.522 5 1 FKBF CCCN1CCC(COc2nc3ccccc3c3ccc(F)cc23)CC1 95576467 WPBFAYSKYMRCFJ-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF O=[N+]([O-])c1cc2nc([C@H]3C[C@@H]3c3c(Cl)cccc3Cl)[nH]c2cc1F 587048961 KCSXAAZYVPEQIT-YUMQZZPRSA-N 366.179 5.188 5 1 FKBF O=C(CCc1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccc(F)cc1 587162874 KKRBVLOVWGWMJR-UHFFFAOYSA-N 368.411 5.824 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3c(Cl)cc(Cl)cc3[nH]2)o1 587266260 XWSGSNZQDNJSGW-UHFFFAOYSA-N 374.183 5.705 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1F 587152345 LZTSKJRZNBMKES-STQMWFEESA-N 372.378 5.209 5 1 FKBF N[C@@H](Cc1ccccc1Cl)c1nc2c3ccccc3c3ccccc3c2[nH]1 587058737 IUPTXPHRYIQMGX-FQEVSTJZSA-N 371.871 5.765 5 1 FKBF O=[N+]([O-])c1cc2nc(C3CC(F)(c4cccc(F)c4)C3)[nH]c2cc1Cl 587131308 DHZSMUMZMDHEEK-UHFFFAOYSA-N 363.751 5.006 5 1 FKBF CC(C=CC=C(C)C=CC1=C(C)C[C@@H](O)CC1(C)C)=CC=CC=C(C)CO 2356744347 XVQDCCGQSOTQBN-HSZRJFAPSA-N 368.561 5.984 5 1 FKBF O=c1oc2ccc3ccccc3c2c(O)c1Cc1ccc2ccccc2c1 62242514 YKENHACPZONAST-UHFFFAOYSA-N 352.389 5.396 5 1 FKBF Fc1cncc(Cl)c1Cc1nc2c3ccccc3c3ccccc3c2[nH]1 587175370 BVKWFOWGOQHPNH-UHFFFAOYSA-N 361.807 5.648 5 1 FKBF c1cc2ccc3ccc(-c4cc5c6c(cccc6n4)CC5)c4ccc(c1)c2c34 587213171 GWNRDOQZBQXLJN-UHFFFAOYSA-N 355.440 6.898 5 1 FKBF C(=C/c1ccccc1)\COCc1nc2c3ccccc3c3ccccc3c2[nH]1 587781366 UHHAVDFZAFVBSA-DHZHZOJOSA-N 364.448 6.099 5 1 FKBF FC(F)(F)c1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587111396 BUHYYBIXYDSTRX-UHFFFAOYSA-N 364.330 5.345 5 1 FKBF Cc1c(F)cccc1-c1cc(-c2nc3cccc(C)c3[nH]2)cc([N+](=O)[O-])c1 587136107 CGUVHVJNRDUVHQ-UHFFFAOYSA-N 361.376 5.561 5 1 FKBF O=[N+]([O-])c1ccc(CCc2c(-c3ccccc3)[nH]c3cccc(F)c23)cc1 587636153 SCYCDINOGFRXOM-UHFFFAOYSA-N 360.388 5.667 5 1 FKBF CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)[nH]c2ccc([C@H](C)CC)cc12 587641388 FMMGFSKAXOUUPW-CYBMUJFWSA-N 366.417 5.433 5 1 FKBF Cc1cc(-c2cccc(C(F)(F)F)c2)cc2c3ccccc3c[n+](C)c12 1857536423 PXIAWRQENILTSY-UHFFFAOYSA-N 352.379 5.812 5 1 FKBF CC12c3ccccc3C(C)(c3ccccc31)[C@H]([N+](=O)[O-])[C@@H]2c1ccccc1 34133355 VCZAJAOFTQXHQO-APCZXGEWSA-N 355.437 5.055 5 1 FKBF biogenic O=[N+]([O-])c1cccc([C@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)c1 169724735 FKKDTPXDJPVDEE-FGZHOGPDSA-N 367.408 6.540 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(C[C@H]3OCCc4ccsc43)nc21 587035871 VDPCOELYRKFSFY-LJQANCHMSA-N 370.477 5.787 5 1 FKBF COc1cccc([C@H](C)Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587930115 GZYRLEDSKNYIIJ-CQSZACIVSA-N 368.440 5.014 5 1 FKBF Cc1ccc2c([C@H](C[N+](=O)[O-])c3cccs3)c(C3CCCCC3)[nH]c2c1 1857603914 NMQWQEUPCLVIRV-QGZVFWFLSA-N 368.502 5.994 5 1 FKBF CCCCCc1ccc(-c2cc3c(ccc4oc5ccccc5c43)o2)cc1 96931842 NQEOCWCJEPOTCI-UHFFFAOYSA-N 354.449 7.732 5 1 FKBF CC(C)(C)c1cccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c12 587048320 SIAUKYLGSIEKAG-CSKARUKUSA-N 355.825 5.592 5 1 FKBF O=c1cc(NCc2ccccc2C(F)(F)F)oc2c1ccc1ccccc12 13676956 ZXERYFMEZFFBOR-UHFFFAOYSA-N 369.342 5.577 5 1 FKBF C[N+](C)(C)c1cccc(-c2ccc3c(-c4ccc(F)cc4)cccc3c2)c1 95598639 FHJWQJZBCXVFAK-UHFFFAOYSA-N 356.464 6.510 5 1 FKBF CC(=O)c1ccc(-c2cccc(-c3nc4cccc([N+](=O)[O-])c4[nH]3)c2)cc1 586879525 GTSLEWSAGPBDLZ-UHFFFAOYSA-N 357.369 5.008 5 1 FKBF O=c1cc(-c2ccc(F)c(C(F)(F)F)c2)oc2c1ccc1ccccc12 1772634457 CKVHCFVNQQNXAY-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF Cc1cc2[nH]c([C@H]3C[C@@H]3c3c(Cl)cccc3Cl)nc2cc1[N+](=O)[O-] 587052205 YNWHUOWLWDDWQL-UWVGGRQHSA-N 362.216 5.357 5 1 FKBF Cc1ccc(/C=C\c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1F 587146172 CBLUMPFTBZEBBR-HJWRWDBZSA-N 354.388 5.277 5 1 FKBF CCCCCCC(C)(C)c1cc(O)c2c(c1)oc(=O)c1ccc(C)cc12 13765613 WFUIRMQOOAUKII-UHFFFAOYSA-N 352.474 6.208 5 1 FKBF O=[N+]([O-])c1cc2nc(/C=C\c3cccc(Cl)c3Cl)[nH]c2cc1F 587053817 ISRBJFJAJUIKJS-PLNGDYQASA-N 352.152 5.087 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4c(F)c(F)ccc4[nH]3)cc2)cc1 587272146 OHPVBOINVJQURF-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc3ccccc3c3ccccc13)O2 587406545 SKZBGAYTLXTIBB-VWLOTQADSA-N 367.448 5.764 5 1 FKBF COc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-c2cccc(F)c2)cc1 587645549 CBZDKYVWXFVZFK-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF Cc1ccc(-c2c3c(nc4cnc5ccccc5c24)-c2ccccc2OC3)cc1 1857766849 ZTKKGNUPPDZLRU-UHFFFAOYSA-N 374.443 6.318 5 1 FKBF CCCCc1ccc2ccc3ccc(NC(=O)c4ccccc4)nc3c2n1 28224611 PXXOXIHNZNVMDS-UHFFFAOYSA-N 355.441 5.378 5 1 FKBF O=c1oc2c(ccc3ccccc32)c(O)c1Cc1ccc2ccccc2c1 62242496 PCPQAMMOUXOQIH-UHFFFAOYSA-N 352.389 5.396 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C\c3ccc(OCc4ccccc4)cc3)[nH]c12 587784388 RKRKAWQBBQXJPC-KAMYIIQDSA-N 371.396 5.221 5 1 FKBF COc1cccc(CCc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587930077 DHTJWHIWWIVFKM-UHFFFAOYSA-N 352.437 5.663 5 1 FKBF O=c1cc(-c2cc(F)ccc2C(F)(F)F)oc2c1ccc1ccccc12 1772631874 GOGXYJVWDNBAIU-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF O=[N+]([O-])c1cc(Cl)cc(-c2nc3cc(Cl)cc(Cl)c3[nH]2)c1F 587140261 WASRGXUIRBPLNH-UHFFFAOYSA-N 360.559 5.237 5 1 FKBF FC(F)(F)CN1CCC(COc2nc3ccccc3c3ccccc23)CC1 103248568 AHJJQSFPLXXEPA-UHFFFAOYSA-N 374.406 5.041 5 1 FKBF CSc1c(-c2ccc(C(F)(F)F)cc2)[nH]c2cccc([N+](=O)[O-])c12 587646335 OOBYLWKBESHVFV-UHFFFAOYSA-N 352.337 5.484 5 1 FKBF O=C(Nc1cccc(-c2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Cl 95584937 DESXUVPCYBWBRA-UHFFFAOYSA-N 352.777 5.168 5 1 FKBF Cc1cccc(-c2ccccc2)c1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 586880142 ZJTDBWJAAMBLFR-UHFFFAOYSA-N 374.356 5.022 5 1 FKBF N=c1cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc2[nH]1 587253986 OIBQKDUDZDFSOF-UHFFFAOYSA-N 360.420 5.497 5 1 FKBF Cc1cc(O)c(-c2ccc([C@@H](C)N)cc2)c2c1nc(O)c1c(C)cccc12 1857588913 FINAVVFZSCLZQK-CQSZACIVSA-N 358.441 5.103 5 1 FKBF Clc1ccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c(Cl)c1 299860697 JQAFVELMRVSSAG-UHFFFAOYSA-N 365.223 5.633 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(C)c(C(=O)Nc3cccc([N+](=O)[O-])c3)c2c1 587643779 XHJNTPWKEJITEN-LBPRGKRZSA-N 351.406 5.150 5 1 FKBF O=[N+]([O-])c1ccc2c(OCc3ccccc3)c(-c3ccc(F)cc3)[nH]c2c1 587646050 RRGYZXHQSFJFGO-UHFFFAOYSA-N 362.360 5.461 5 1 FKBF Cc1ccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)cc1C 1772587860 XZRFFDYBFPXYPE-UHFFFAOYSA-O 352.461 5.659 5 1 FKBF CC(C)CCN(Cc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])s1 96270209 HNIOGTOITSTWDU-UHFFFAOYSA-N 352.887 5.358 5 1 FKBF CC(C)Oc1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 587047334 GTGDPYVCOCVAPK-YWEYNIOJSA-N 357.797 5.082 5 1 FKBF Cc1[nH]c2cc(F)ccc2c1-c1ccc(OC(F)(F)F)cc1[N+](=O)[O-] 587634382 XENHCOGSROFGMD-UHFFFAOYSA-N 354.259 5.089 5 1 FKBF CCOc1ccccc1OCc1nc2c3ccccc3c3ccccc3c2[nH]1 587780770 IBMVWZZZVMIVHZ-UHFFFAOYSA-N 368.436 5.847 5 1 FKBF Fc1ccc(/C=C/c2nc3c4cccnc4c4ncccc4c3[nH]2)c(F)c1 587149047 CNBSFPQFPAERBQ-SOFGYWHQSA-N 358.351 5.108 5 1 FKBF CCC(=C(c1ccc(N)cc1)c1ccc(N)cc1)c1ccc([N+](=O)[O-])cc1 1772630219 GHZRJSFLWQFZGF-UHFFFAOYSA-N 359.429 5.128 5 1 FKBF O=C(c1ccc(-c2cccc(Cl)c2)o1)c1coc2cc([N+](=O)[O-])ccc12 587280398 WAVXQECVSQXYCT-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF COc1cccc([C@@H](C[N+](=O)[O-])c2c(-c3ccccc3)[nH]c3ccccc23)c1 2382242741 QWCAFAXUXGFUMF-HXUWFJFHSA-N 372.424 5.252 5 1 FKBF O=c1c2cccc3c(NC4CCCCC4)ccc(c32)c2nc3ccccc3n12 96934438 IAERAZQUZPWSAL-UHFFFAOYSA-N 367.452 5.337 5 1 FKBF O=[N+]([O-])c1cccc([C@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)c1 169724733 FKKDTPXDJPVDEE-YADHBBJMSA-N 367.408 6.540 5 1 FKBF O=c1cc(-c2ccc(Br)cc2)oc2c1ccc1ccccc12 207662382 PGSRBEZTISAAKD-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF CCc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2C(=O)C(F)(F)F)s1 587645392 TZWTUUMBUYFICV-UHFFFAOYSA-N 368.336 5.112 5 1 FKBF O[C@H](CN1CCCCC1)c1c2ccccc2nc2c1ccc1ccccc12 143582084 NCTPFHJSYIOLDU-JOCHJYFZSA-N 356.469 5.061 5 1 FKBF O=[N+]([O-])c1ccc2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c2c1 587128492 NYWMZVGGERUGLX-UHFFFAOYSA-N 372.356 5.199 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc3cc4ccccc4cc3c1)O2 587406117 PDMYYOHZCOSQRE-VWLOTQADSA-N 367.448 5.764 5 1 FKBF c1ccc2c(c1)C[C@H](c1nc3c4cccnc4c4ncccc4c3[nH]1)S2 587043904 XAXFNNIIEBTAJG-MRXNPFEDSA-N 354.438 5.049 5 1 FKBF COC(=O)Nc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587243787 QNZWTHKETYJJIM-UHFFFAOYSA-N 367.408 5.715 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(C)c(C(=O)OCc3ccc([N+](=O)[O-])cc3)c2c1 587641840 HWYDGKKAMGFRMJ-CYBMUJFWSA-N 366.417 5.255 5 1 FKBF Cc1ccc2c(ccc3c4c(ccc32)[C@@](C)([C@H](C)CCCC(C)C)CC4)c1 2356700480 OJUUVFJKMJUPIX-NFQMXDRXSA-N 358.569 7.968 5 1 FKBF COc1ccccc1Nc1ccccc1-c1nc2cc([N+](=O)[O-])c(C)cc2[nH]1 587239993 DMDNYXJVRYPSAI-UHFFFAOYSA-N 374.400 5.199 5 1 FKBF CSc1c(-c2ccc(C(F)(F)F)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587646411 RYVMTPCBTXJKCH-UHFFFAOYSA-N 352.337 5.484 5 1 FKBF Cc1c2ccccc2c(CNCCc2c[nH]c3ccccc23)c2ccccc12 653727818 KIYVXUYYKPCZNJ-UHFFFAOYSA-N 364.492 6.115 5 1 FKBF CCN(CC)C[C@@H](O)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169337826 DVYYPAPDKVOUAV-HXUWFJFHSA-N 362.300 5.675 5 1 FKBF O=C(Cc1nc2c3ccccc3c3ccccc3c2[nH]1)OCc1ccccc1 587781746 CJNFYWVMSIPKTB-UHFFFAOYSA-N 366.420 5.155 5 1 FKBF Clc1[nH]c2ccccc2c1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587087178 IRFDVBBLYWOQKY-UHFFFAOYSA-N 367.839 6.671 5 1 FKBF CCc1c(-c2cc(Br)ccc2F)[nH]c2cccc([N+](=O)[O-])c12 587646086 JGSOWJFBPZXADT-UHFFFAOYSA-N 363.186 5.207 5 1 FKBF O=C(c1c(-c2cccc3ccccc23)[nH]c2cccc([N+](=O)[O-])c12)C(F)F 587646403 RQAYWMTXJCLGJD-UHFFFAOYSA-N 366.323 5.344 5 1 FKBF COc1ccc2cc([C@@H](C)c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)ccc2c1 587936113 ZCSAETHKJSRLMT-CYBMUJFWSA-N 361.401 5.093 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1F 587149722 AHHFBEQTFYGDBP-LSDHHAIUSA-N 372.378 5.209 5 1 FKBF O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1coc2ccccc12 587281128 XIUHNRQLBBMTPV-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF Clc1c2ncccc2cc2nc(-c3ccccc3)c(-c3ccccc3)nc12 73221271 KYDFPQCOEPYDEY-UHFFFAOYSA-N 367.839 6.165 5 1 FKBF Cc1cc(OCCCC[N+](C)(C)Cc2ccco2)c(C(C)C)cc1Cl 59718782 JSHUMYCMCIFTGM-UHFFFAOYSA-N 364.937 5.800 5 1 FKBF FC(F)(F)c1ccc2cc3nc4ccccc4c(-c4ccccc4)c3cc2c1 1772578624 BTFAZVVIIGDTMD-UHFFFAOYSA-N 373.377 7.227 5 1 FKBF CCCC/C=C/[C@H](c1ccccc1)[C@H](CO)Cc1ccc([N+](=O)[O-])cc1 13828795 IKTATBHNBVLPNA-JTAIHKRISA-N 353.462 5.276 5 1 FKBF O=C(C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccco1)c1ccc(Cl)cc1 49799627 QUJQBNBSMHJFAG-KRWDZBQOSA-N 370.792 5.267 5 1 FKBF O=C(O)c1cnc2cc(-c3c(O)ccc4ccccc34)c3ccccc3c2n1 72110815 HKJVCZQMGYSRFB-UHFFFAOYSA-N 366.376 5.007 5 1 FKBF CN(C/C=C/c1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)CCCCC2 653827670 GWUKSPPCFMQVHB-SOFGYWHQSA-N 350.462 5.009 5 1 FKBF O=c1[nH]ccc2c3[nH]c(-c4ccccc4Cl)nc3c3ccc(F)cc3c12 29135959 JYYPZVBYHBGFJH-UHFFFAOYSA-N 363.779 5.017 5 1 FKBF CC(C)(C)C1CCC(Nc2cc(-c3cccc([N+](=O)[O-])c3)ncn2)CC1 82162311 UEEVDCCQNHRYHJ-UHFFFAOYSA-N 354.454 5.069 5 1 FKBF O=[N+]([O-])c1cc2nc(C3(Cc4ccc(Cl)cc4)CC3)[nH]c2cc1Cl 587073697 NEQYQZBTGIDIGL-UHFFFAOYSA-N 362.216 5.052 5 1 FKBF O=C(c1c(C(F)F)[nH]c2cccc([N+](=O)[O-])c12)C12CC3CC(CC(C3)C1)C2 587646660 ZTBDSOAZKFKSGW-UHFFFAOYSA-N 374.387 5.413 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccc(F)cc12 1857597093 UXTTYRLYUHMJFU-LJQANCHMSA-N 360.388 5.383 5 1 FKBF Cc1ccc2c(ccc3c4c(ccc32)[C@@](C)([C@@H](C)CCCC(C)C)CC4)c1 2356700478 OJUUVFJKMJUPIX-CCLHPLFOSA-N 358.569 7.968 5 1 FKBF C(=C1C2CC3CC(C2)CC1C3)c1nc2c3cccnc3c3ncccc3c2[nH]1 587968459 SYJYSWKXMMQKOC-UHFFFAOYSA-N 366.468 5.499 5 1 FKBF Cn1c2ccccc2c2cc([N+](C)(C)c3ccnc4ccccc34)ccc21 1857543213 FPJKQILXYUWDFL-UHFFFAOYSA-N 352.461 5.778 5 1 FKBF Cn1c(COCc2ccccc2)c(-c2ccccc2)c2cc([N+](=O)[O-])ccc21 205329495 IHTHTJNSUCSDLQ-UHFFFAOYSA-N 372.424 5.470 5 3 FKBF CC(=O)N1N=C(c2ccco2)C[C@@H]1c1c2ccccc2cc2ccccc12 66103015 QARZDXARDIMXGB-OAQYLSRUSA-N 354.409 5.284 5 1 FKBF O=c1oc2c(ccc3ccccc32)c(O)c1Cc1cccc2ccccc12 62242493 YJPKPSZDQZOZJV-UHFFFAOYSA-N 352.389 5.396 5 1 FKBF CC(=O)NC1(c2nc3c4ccccc4c4ccccc4c3[nH]2)CCC(C)CC1 587234687 TVCOCERHPALHLJ-UHFFFAOYSA-N 371.484 5.411 5 1 FKBF CCCCOc1ccc(OCCCCCCCCCC[N+](C)(C)C)cc1 5188373 GHTRSZCQQDCEET-UHFFFAOYSA-N 364.594 6.071 5 1 FKBF C[N+](C)(C)c1ccc(-c2ccc3c(-c4ccc(F)cc4)cccc3c2)cc1 95598649 NPVJBEWHDAMIKO-UHFFFAOYSA-N 356.464 6.510 5 1 FKBF C(=C/c1cccc2ccccc12)\c1nc2cc3nc4ccccc4nc3cc2[nH]1 587966191 ALZJVLXNJXSWCC-OUKQBFOZSA-N 372.431 5.983 5 1 FKBF Cc1cccc2c1ccc1c3c(ccc12)[C@@H]1[C@H]2OC[C@@]1(CC3)CCC2(C)C 2356445591 GXEWDOFQKGSZBN-DGWZTRNLSA-N 356.509 6.536 5 1 FKBF O=C1c2ccccc2-c2cc(-c3cc([N+](=O)[O-])ccc3F)nc3cccc1c23 587104380 SPTDYDUCHUSSHJ-UHFFFAOYSA-N 370.339 5.161 5 1 FKBF Cc1cc(-c2[nH]c3cccc([N+](=O)[O-])c3c2N2CCCCC2)cc(C)c1O 587649049 ONGHJHAEXYQADV-UHFFFAOYSA-N 365.433 5.056 5 1 FKBF c1ccc2c(c1)nc1c3nc4ccccc4c4cc[nH]c(c5[nH]ccc2c15)c43 2356339800 XRNWPLMNIKPKTD-UHFFFAOYSA-N 358.404 6.052 5 1 FKBF COc1cc(C)c2nc(O)c3ccccc3c2c1-c1ccc([C@@H](C)CN)cc1 1857590191 FIPQTWQDFHBEHR-HNNXBMFYSA-N 372.468 5.140 5 1 FKBF O=c1oc2ccccc2c2nc3c(ccc4cc[nH]c43)c(-c3ccccc3)c12 1911579153 LDCPWAVPLHNCMD-UHFFFAOYSA-N 362.388 5.643 5 1 FKBF Cn1cc2c3cc(Br)ccc3nc-2c2cc(F)cc(Cl)c21 299866767 WTKPLUMBAMQASC-UHFFFAOYSA-N 363.617 5.386 5 1 FKBF CC1(C(=O)c2coc3cc([N+](=O)[O-])ccc23)c2ccccc2-c2ccccc21 587279914 UFWLDCWATBOLBZ-UHFFFAOYSA-N 369.376 5.510 5 1 FKBF Cc1c(-c2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)cccc1[N+](=O)[O-] 587260753 CGQDZLLDMZARCV-UHFFFAOYSA-N 355.703 5.119 5 1 FKBF CCSc1nnc(Sc2c3ccccc3nc3ccccc23)s1 5580961 LSBMWMCHCWBNBV-UHFFFAOYSA-N 355.513 5.503 5 1 FKBF Cc1ccc(-c2ccc([C@H]3NCCc4c3sc(C)c4C)o2)c([N+](=O)[O-])c1 963022990 KWCYIZFCVPDYBY-LJQANCHMSA-N 368.458 5.077 5 1 FKBF O=[N+]([O-])c1cc(Cl)cc2[nH]c(CCc3cc(Cl)cc(Cl)c3)nc12 299857839 DCYWFIBWIUHEEU-UHFFFAOYSA-N 370.623 5.217 5 1 FKBF CC(C)(C)c1cccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc12 587264696 JTWJGKOVUKMXOT-UHFFFAOYSA-N 361.401 5.696 5 1 FKBF O=C1c2ccccc2-c2nc(-c3cccs3)cc3c2c1nc1ccccc13 1651713 NWHPIKBOVBKXAE-UHFFFAOYSA-N 364.429 5.723 5 1 FKBF C[C@H](Cn1c2c3ccccc3ccc2c2oc(=O)c3ccccc3c21)N(C)C 5551311 LZXKLIZZZXXCCH-OAHLLOKOSA-N 370.452 5.004 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587161244 LQBLWURUWRLKMM-LSDHHAIUSA-N 354.388 5.070 5 1 FKBF Cc1ccc(NC2(c3nc4cc([N+](=O)[O-])c(Cl)cc4[nH]3)CCCC2)cc1 587237294 QWJCPCVHHGOIRN-UHFFFAOYSA-N 370.840 5.314 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(F)cc3)c(-c3cccc(F)c3)c12 587645925 OUOHEWMQPHUJCE-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF C[C@@H](NCc1ccc2ccc3cccc4ccc1c2c34)[C@@H](O)c1ccccc1 26474184 LASREJVYHBUIFM-WGDIFIGCSA-N 365.476 5.796 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1F 587149721 AHHFBEQTFYGDBP-HUUCEWRRSA-N 372.378 5.209 5 1 FKBF COC(=O)Nc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cn1 587244584 GPNKZNJLECEPKI-UHFFFAOYSA-N 368.396 5.110 5 1 FKBF NC[C@@H]1C[C@H](c2cc3ccccc3c3ccccc23)N(Cc2ccccc2)O1 66074955 AITWXFPAQNDRGX-NBGIEHNGSA-N 368.480 5.199 5 1 FKBF N[C@@]1(c2nc3c4ccccc4c4ccccc4c3[nH]2)C[C@H]1c1ccccc1F 587154365 DRZRKISNQXAFSH-CYFREDJKSA-N 367.427 5.350 5 1 FKBF c1ccc(-c2cc3[nH]c4ccccc4[nH]c=3cc(-c3ccccc3)nn2)cc1 6582572 SPLQSKNEVSBGEV-UHFFFAOYSA-N 362.436 5.469 5 1 FKBF O[C@@H]1C[C@@H](c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586903084 NIGNKJPYSPIWGU-NHCUHLMSSA-N 350.421 5.438 5 1 FKBF CC/C(=C/c1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccc(C)cc1 587965596 CEKZNIROFGZICE-PEZBUJJGSA-N 364.452 5.918 5 1 FKBF C[C@@H]1CCc2sc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2C1 587033124 DIXSODGEXSISQR-GFCCVEGCSA-N 370.481 5.513 5 1 FKBF CC(C)c1c(Cc2ccc(Cl)cc2Cl)[nH]c2cccc([N+](=O)[O-])c12 587644453 DNRBWAUSTRVQBR-UHFFFAOYSA-N 363.244 6.097 5 1 FKBF CC(C)=CCCC(C)=CCC[C@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1 2356846578 LIQXVRBBAVQORU-MJGOQNOKSA-N 368.905 5.297 5 1 FKBF Oc1c2cnc3c4ccccc4sc3c2nn1-c1ccc(Cl)cc1 26579016 FPUHKPRJHCHXMP-UHFFFAOYSA-N 351.818 5.147 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(Cl)cc3)c(-c3ccc(F)cc3)[nH]c2c1 587646263 ZAUJCAVQZLLAAP-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF FC(F)(F)c1ccc(-c2nc3ccccc3c3c2[nH]c2ccccc23)cc1 299857591 FOCBTOAODXDOBA-UHFFFAOYSA-N 362.354 6.555 5 1 FKBF CC(C)(C)c1ccc2nc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)[nH]c2c1 587268750 CXHKFZVFUIIIGV-UHFFFAOYSA-N 364.449 5.036 5 1 FKBF O=C(c1c(C(F)F)[nH]c2cc([N+](=O)[O-])ccc12)C12CC3CC(CC(C3)C1)C2 587646625 YHDKFFDMYWYLFO-UHFFFAOYSA-N 374.387 5.413 5 1 FKBF O=C(C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccco1)c1ccc(Cl)cc1 49799626 QUJQBNBSMHJFAG-QGZVFWFLSA-N 370.792 5.267 5 1 FKBF O=C1c2ccccc2-c2cc(-c3ccc([N+](=O)[O-])cc3)nc3cccc1c23 587103982 CYMYXODPRMRZPQ-UHFFFAOYSA-N 352.349 5.021 5 1 FKBF CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587951281 GRUXYORBFKLKHO-DFFLPILJSA-N 374.488 5.706 5 1 FKBF COc1ccc(NCc2cccc3c(=O)c4ccc(Cl)cc4oc23)cc1 5581446 JHUYXDVAGJOEHO-UHFFFAOYSA-N 365.816 5.220 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3c(F)cc(Cl)cc3[nH]2)o1 587266376 ZUMOHBQAAQXNCN-UHFFFAOYSA-N 357.728 5.191 5 1 FKBF O=C(O)Cc1ccc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587962028 POJCGFGTPJTUHT-UHFFFAOYSA-N 366.420 5.087 5 1 FKBF CC(C)=CCC/C(C)=C/c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587966677 DNUKUBYECQDMRZ-YRNVUSSQSA-N 364.243 5.383 5 1 FKBF C(=C/c1cccc2ccccc12)\c1nc2c3ccccc3c3ccccc3c2[nH]1 587969787 XAYIDUFYYHNWSY-WUKNDPDISA-N 370.455 7.193 5 1 FKBF O=[N+]([O-])c1cc2nc(Cc3ccccc3-c3ccccc3)[nH]c2cc1Cl 587958810 KAYRIICIKQDLMP-UHFFFAOYSA-N 363.804 5.382 5 1 FKBF O=[N+]([O-])c1ccc2c(c1)C(=Cc1ccccc1OCCF)c1ccccc1-2 1857550814 BVAXPTXGCKJZLB-UHFFFAOYSA-N 361.372 5.512 5 1 FKBF Cc1cccc2c1ccc1c(/C=C/c3ccc([N+](=O)[O-])cc3)cc(=O)oc12 1857541855 ZSCSNTAJQARLST-VMPITWQZSA-N 357.365 5.333 5 1 FKBF CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=CC=C(C)C(=O)O 2356706295 AQYCHKYBQMYQCM-UHFFFAOYSA-N 366.545 7.105 5 1 FKBF Cc1cc(CCCOc2c(C)cc(-c3cccc([N+](=O)[O-])c3)cc2C)on1 3590515 ZURRCODHMVJJKP-UHFFFAOYSA-N 366.417 5.187 5 1 FKBF CCCCN(CCCC)CC[C@@H](O)c1cc2ccccc2c2ccccc12 5973414 VYBIDWRZDLBYHD-RUZDIDTESA-N 363.545 6.319 5 1 FKBF CCCCOc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 73239821 PCHSELQQLXKIKD-UHFFFAOYSA-N 368.440 5.505 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C/c3ccc(SC(F)(F)F)cc3)[nH]c2c1 587126598 ZUJQVZWBZVDVNX-FPYGCLRLSA-N 365.336 5.253 5 1 FKBF Cc1cc(O)c(-c2ccc([C@@H](C)CN)cc2)c2c1nc(O)c1c(C)cccc12 1857558808 KTTXRRDBIPPRIT-HNNXBMFYSA-N 372.468 5.145 5 1 FKBF CC(=O)c1cccc(Nc2nc3ccccc3c3[nH]c4ccccc4c23)c1 1663421 PVLNEWIAIWAZIZ-UHFFFAOYSA-N 351.409 5.816 5 1 FKBF CC(C)(C)C(=O)Oc1ccc2c(c1)[nH]c1c3c4ccccc4nc-3c[nH]c12 100660649 AWLPAJABQMKXOE-UHFFFAOYSA-N 357.413 5.254 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(-c3ccccc3)c(-n3cc([N+](=O)[O-])cn3)c2c1 587640924 CQVKPODIHMPBNQ-AWEZNQCLSA-N 360.417 5.442 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc4c(c3)Cc3ccccc3-4)[C@@H]1C2 95566164 NJIFOBMSYSGRGV-DHLKQENFSA-N 358.549 5.827 5 1 FKBF CC[C@@H](Oc1ccccc1F)c1nc2c3cccnc3c3ncccc3c2[nH]1 587155056 IYMFLKDBBIYQFE-MRXNPFEDSA-N 372.403 5.329 5 1 FKBF Cc1c(CC[C@@H](C)[N+](=O)[O-])[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c12 587627998 NSNFQYXBPRSTDP-SSDOTTSWSA-N 368.277 5.112 5 1 FKBF Cc1ccccc1-c1ccc(Cc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc1 587960025 UWZJEUUYTJENMV-UHFFFAOYSA-N 361.376 5.176 5 1 FKBF c1ccc2c(c1)N[C@H](c1cc3ccccc3c3ccccc13)[C@H]1CCCO[C@@H]21 95574785 UOVBAOZXTRRJFJ-RZFJZAQRSA-N 365.476 6.628 5 1 FKBF O=[N+]([O-])c1cccc(-c2[nH]c3cc(Cl)c(F)cc3c2-c2ccccc2)c1 587631463 MYOYAWVCTIMGPJ-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF COc1cc(/C=C/c2cc(=O)oc3c2ccc2c(C)cccc23)cc(OC)c1 1857558610 OCUDIQGZUKEVCM-BQYQJAHWSA-N 372.420 5.442 5 1 FKBF Cc1cc([N+](=O)[O-])ccc1-c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 587105254 VFSHQHUHJWCJCN-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF CC(=O)c1ccc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c2c1 587272128 NRLULLTULGTLGZ-UHFFFAOYSA-N 373.368 5.133 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4cc(F)c(F)cc4[nH]3)cc2)cc1 587271514 DRGVMDOGRSJSNB-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF O=C(c1ccccc1OCc1ccccc1)c1coc2cc([N+](=O)[O-])ccc12 587279882 RWMYBIQMHDAPIX-UHFFFAOYSA-N 373.364 5.151 5 1 FKBF COc1cc(C)ccc1OCc1nc2c3ccccc3c3ccccc3c2[nH]1 587564844 ZFMBGSZDZDPEMY-UHFFFAOYSA-N 368.436 5.765 5 1 FKBF CC1(NCc2ccc3ccc4cccc5ccc2c3c45)COC(C)(C)OC1 26480742 JPTLOKWHFFKXCJ-UHFFFAOYSA-N 359.469 5.215 5 1 FKBF Clc1ccccc1N1CCN(c2nc3ccccc3c3ccccc23)CC1 103264632 JFKPDVMEGOSVLL-UHFFFAOYSA-N 373.887 5.368 5 1 FKBF CCC[C@@H](C)[C@@H]1CCc2c1ccc1c2ccc2c3cccc(C)c3ccc12 238752572 BUQMYMPMZDOPMU-MJGOQNOKSA-N 352.521 7.921 5 1 FKBF O=[N+]([O-])c1cc(Br)cc2[nH]c(-c3ccc(C4CCC4)cc3)nc12 586881844 WHSWONWOQPQYLQ-UHFFFAOYSA-N 372.222 5.168 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(C)c(C(=O)Nc3cccc([N+](=O)[O-])c3)c2c1 587643778 XHJNTPWKEJITEN-GFCCVEGCSA-N 351.406 5.150 5 1 FKBF COc1cc([N+](=O)[O-])ccc1-c1c(Nc2ccccc2)cccc1OC 1857603504 WUWTYNYDWOEJSO-UHFFFAOYSA-N 350.374 5.023 5 1 FKBF CC(=O)c1ccc(-c2occc2-c2ccc([N+](=O)[O-])c3cccnc23)cc1 1857772005 GMCXZUVSZQTZLR-UHFFFAOYSA-N 358.353 5.273 5 1 FKBF CC(C=CC=C(C)C=CC1=C(C)C[C@H](O)CC1(C)C)=CC=CC=C(C)CO 2356744348 XVQDCCGQSOTQBN-QHCPKHFHSA-N 368.561 5.984 5 1 FKBF COc1cccc2nc3c(OC/C=C(\C)CCC=C(C)C)cccc3nc12 103240381 AYBXOQNDOSRELU-SAPNQHFASA-N 362.473 5.863 5 1 FKBF C(=C1C2CC3CC(C2)CC1C3)c1nc2c3ccccc3c3ccccc3c2[nH]1 587966605 JKTDJHRZOOAEPN-UHFFFAOYSA-N 364.492 6.709 5 1 FKBF O=C(c1c(-c2cccc(Cl)c2)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F 587644745 BNSQPVJNPMLUAI-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF CCCN1[C@@H](C)Cc2ccccc2[C@]1(C)C(C)(C)c1ccc([N+](=O)[O-])cc1 963223749 DFPCAGCCCRFXPA-GAJHUEQPSA-N 366.505 5.444 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(C)c(-c3cc(OC)c(OC)cc3[N+](=O)[O-])c2c1 587643558 VEQVHBADBJLLTN-GFCCVEGCSA-N 368.433 5.582 5 1 FKBF C[C@H](SCc1ccccc1)c1nc2c3cccnc3c3ncccc3c2[nH]1 586960249 AFALJFKJESAZEX-AWEZNQCLSA-N 370.481 5.654 5 1 FKBF O=C(Nc1cccs1)c1ccccc1Sc1ccc([N+](=O)[O-])cc1 1857588118 YLTWPRUQABYKNH-UHFFFAOYSA-N 356.428 5.060 5 1 FKBF Cc1c2cccc-2ccc2c3ccccc3n(C(=O)c3ccc(Cl)cc3)c12 1662098 KBJAZERJSFJSSO-UHFFFAOYSA-N 369.851 6.550 5 1 FKBF O=[N+]([O-])c1ccc(NC(=S)Nc2cc3ccccc3c3ccccc23)cc1 299860687 JOXOGLVQAHBVEM-UHFFFAOYSA-N 373.437 5.710 5 1 FKBF CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2ccc(F)c(F)c2[nH]1 586969848 ZHAPXTYJOCNBEB-UHFFFAOYSA-N 363.389 5.164 5 1 FKBF Cc1ccc2c3c(cc(-c4ccc([N+](=O)[O-])cc4)nc13)-c1ccccc1C2=O 587097961 MIJYIUSZPDASOG-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF CC(C)Nc1c(-c2c3ccccc3cc3ccccc23)nc2ccccn12 95558356 JTHQVWFBWZDZTF-UHFFFAOYSA-N 351.453 6.128 5 1 FKBF CCc1oc2ccccc2c1-c1nc2c3cccnc3c3ncccc3c2[nH]1 586904700 YNBXIBDROSQQFH-UHFFFAOYSA-N 364.408 5.635 5 1 FKBF O=[N+]([O-])c1cccc(CCc2nc3ccc(Oc4ccccc4)cc3[nH]2)c1 587269882 IIKNYISLAGDXDY-UHFFFAOYSA-N 359.385 5.049 5 1 FKBF Cc1c(CC[C@H](C)[N+](=O)[O-])[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c12 587627999 NSNFQYXBPRSTDP-ZETCQYMHSA-N 368.277 5.112 5 1 FKBF c1cnc2c(c1)c1nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c1c1cccnc12 586892779 WJRFGRALIOBEMX-MJDLOBTFSA-N 354.457 5.127 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(F)cc3)c(-c3ccccc3Cl)[nH]c2c1 587646210 WWRMQMYGZNIIQN-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF COc1ccc([C@@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724738 GMFUGNKBPPBASM-XZOQPEGZSA-N 352.437 6.640 5 1 FKBF CC(=O)c1ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2c1 586968401 CYAPGLPCBAVISU-UHFFFAOYSA-N 369.446 5.089 5 1 FKBF O=[N+]([O-])c1cc2[nH]c(-c3sccc3-c3ccc(F)cc3)nc2cc1F 587163443 IUUSCVLEWMFQMY-UHFFFAOYSA-N 357.341 5.145 5 1 FKBF O=C(c1cc(C(F)(F)F)ccc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280494 YMCOTTHMXCNJOJ-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF c1ccc2nc3cc4[nH]c([C@H]5SCCc6sccc65)nc4cc3nc2c1 587036567 GGIAENPIEKERPS-IBGZPJMESA-N 374.494 5.100 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C/c3ccc(OCc4ccccc4)cc3)[nH]c12 587784390 RKRKAWQBBQXJPC-SDNWHVSQSA-N 371.396 5.221 5 1 FKBF Sc1nnc2c3c(nc(-c4ccccc4Cl)n12)sc1ccccc13 1857549840 HTIGLPOMZQFZIR-UHFFFAOYSA-N 368.874 5.101 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2cccc(C(F)(F)F)c2c2ccccc12 169339010 CVESWPZWGKZHKO-MGPUTAFESA-N 373.418 5.577 5 1 FKBF Cc1cc2[nH]c([C@@H](Cc3ccccc3)c3ccccc3)nc2cc1[N+](=O)[O-] 587956400 ZNGRPUIOEKEDIQ-SFHVURJKSA-N 357.413 5.154 5 1 FKBF O=[N+]([O-])c1cc(C(F)(F)F)ccc1-c1ccc(COc2ccccc2)cc1 1857653200 QVDMHYKUIHLLBO-UHFFFAOYSA-N 373.330 5.860 5 1 FKBF COc1c2c(cc3c1c(=O)c1cc4ccccc4cc1n3C)OC(C)(C)C=C2 26479690 ZZXSZWKHOYAUQL-UHFFFAOYSA-N 371.436 5.038 5 1 FKBF CC(C)Oc1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 587047333 GTGDPYVCOCVAPK-XBXARRHUSA-N 357.797 5.082 5 1 FKBF Cc1ccc(C2(C(=O)c3coc4cc([N+](=O)[O-])ccc34)CCCCC2)cc1 587279772 RMVHSFCRHSJHIE-UHFFFAOYSA-N 363.413 5.734 5 1 FKBF CCCN1CCC(COc2nc3ccccc3c3cccc(F)c23)CC1 95580301 ADONYAJEPBCRAQ-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF Clc1ccc(N2CCN(c3nc4ccccc4c4ccccc34)CC2)cc1 103264629 PEBQNJLWWZIMGG-UHFFFAOYSA-N 373.887 5.368 5 1 FKBF Cc1c(-c2nc3cccc(OCc4ccccc4)c3[nH]2)cccc1[N+](=O)[O-] 587260737 BPZHKEMIETYAGQ-UHFFFAOYSA-N 359.385 5.026 5 1 FKBF CC(=O)c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])c4cccnc34)s2)cc1 1857755907 HCLYOCUGNHGQLX-UHFFFAOYSA-N 374.421 5.741 5 1 FKBF O=C(c1ccc([N+](=O)[O-])cc1)N1c2ccccc2Oc2ccc(Cl)cc21 72109819 ULYNZRFAXYUCMM-UHFFFAOYSA-N 366.760 5.332 5 1 FKBF Cc1cc2[nH]c([C@H](C)Cc3cccc(C(F)(F)F)c3)nc2cc1[N+](=O)[O-] 587112898 IDPQZBZXMQNTRZ-LLVKDONJSA-N 363.339 5.145 5 1 FKBF OC[C@H](NCc1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 26466618 ZPINGZCFZUSQCU-QHCPKHFHSA-N 351.449 5.407 5 1 FKBF COc1ccc(-c2cc3ccccc3nc2/C=C/c2ccc([N+](=O)[O-])o2)cc1 299823708 SOCOIGBSCISDNB-ZRDIBKRKSA-N 372.380 5.582 5 1 FKBF CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)[nH]c2ccc([C@@H](C)CC)cc12 587641391 FMMGFSKAXOUUPW-ZDUSSCGKSA-N 366.417 5.433 5 1 FKBF Cn1c(-c2c(F)cccc2Cl)nc2c3ccccc3c3ccccc3c21 29135739 DAKAPWMXWYQDOW-UHFFFAOYSA-N 360.819 6.339 5 1 FKBF O=c1cc(-c2cc(F)cc(C(F)(F)F)c2)oc2c1ccc1ccccc12 1772622520 FUNXGVOABNYXEK-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF CNC(=O)OCc1ccc(Oc2c3ccccc3nc3ccccc23)cc1 13603430 AXRHDWBLXDYJAE-UHFFFAOYSA-N 358.397 5.036 5 1 FKBF C/C(=C/c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)C1CCCCC1 587966698 DYGNAERVIYJOEA-KTKRTIGZSA-N 364.243 5.217 5 1 FKBF O=[N+]([O-])c1ccc2c3ccc([N+](=O)[O-])c4ccc5ccc6ccc1c2c6c5c43 5845768 DNJXYVOUOCIWGX-UHFFFAOYSA-N 366.332 6.145 5 1 FKBF COc1ccc2nc3ccc(COC(=O)CC(C)C)cc3c(Cl)c2c1 58582447 OQVFFPHIRBWISU-UHFFFAOYSA-N 357.837 5.139 5 1 FKBF O=[N+]([O-])c1cccc([C@@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)c1 169724732 FKKDTPXDJPVDEE-VXKWHMMOSA-N 367.408 6.540 5 1 FKBF CCCOc1ccc2ccc3c(OCCC)c4ccccc4c4ccc1c2c34 5836674 VUENJGVXEYKUOT-UHFFFAOYSA-N 368.476 7.315 5 1 FKBF CC(C)c1c(-c2cccc(Br)c2)[nH]c2cccc([N+](=O)[O-])c12 587644565 ZWZNAACXIHRHJS-UHFFFAOYSA-N 359.223 5.629 5 1 FKBF Clc1cccc(Nc2nc3c(-c4nnco4)cccc3c3cnccc23)c1 73196009 RATNMNKEUJOIEP-UHFFFAOYSA-N 373.803 5.230 5 1 FKBF Cc1ccc(-c2csc(-c3c4ccccc4cc4ccccc34)n2)cc1C 587921224 RWYVBWJAYHYMDI-UHFFFAOYSA-N 365.501 7.400 5 1 FKBF CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21 40422107 YHXSELHUXJAOLR-UHFFFAOYSA-N 350.506 5.057 5 1 FKBF in-vivo COc1cc2c(c3c1c(=O)c1ccc4ccccc4c1n3C)C=CC(C)(C)O2 38267480 HZDISVNGIHZSOR-UHFFFAOYSA-N 371.436 5.038 5 1 FKBF C(=C\c1ccccc1)\COCc1nc2c3ccccc3c3ccccc3c2[nH]1 587781367 UHHAVDFZAFVBSA-FLIBITNWSA-N 364.448 6.099 5 1 FKBF O=C(C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1ccccc1)c1ccccc1 72113468 MNEXHRFTJIQXRK-OAQYLSRUSA-N 363.438 5.701 5 1 FKBF COc1cccc([C@H](C)Cc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587931931 PHLGBYNVPHNALK-MRXNPFEDSA-N 366.464 6.224 5 1 FKBF O=[N+]([O-])c1cc2c(O)c(-c3ccc4ccccc4c3)c(O)nc2cc1Cl 36185258 MWEPMKZTMUWAJN-UHFFFAOYSA-N 366.760 5.028 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccccc2c2c(Cl)cc(Cl)cc12 169339356 DDSTWKISZLVRST-FOIQADDNSA-N 374.311 5.865 5 1 FKBF CC(C)=CCC[C@H](C)C=CC=C(C)C(=O)NC[C@@H]1CC[N@+]2(C)CCCC[C@@H]12 2356697752 OIRGOJBSVAJDRX-SZBRSHHCSA-O 373.605 5.007 5 1 FKBF CC(/C=C/C=C(\C)c1ccc2ccc3cccc4ccc1c2c34)=C\C(=O)O 66066502 KFMQSDRWGHDDBY-UNRVZEGUSA-N 352.433 6.574 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc21 586890206 NUEGOTGFSVYCDB-KICOXREZSA-N 352.481 6.337 5 1 FKBF CCC(CC)Nc1c([N+](=O)[O-])cc2c(c1[N+](=O)[O-])CCC[C@@]2(C)C(C)C 103190311 XUAFPIOQGVRMOC-IBGZPJMESA-N 363.458 5.354 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(-c3csc([C@@H]4CCCO4)n3)nc21 587017525 XROLTLQYHWELSV-SFHVURJKSA-N 371.465 5.844 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccccc3)c(C(F)(F)Br)[nH]c2c1 587645249 MLMADANTQJKEEY-UHFFFAOYSA-N 367.149 5.187 5 1 FKBF c1ccc2c(c1)CC[C@]21C[C@@H]1c1nc2c3ccccc3c3ccccc3c2[nH]1 586887991 JYPBVGHUJZKAFY-GJZUVCINSA-N 360.460 6.241 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2c(Cl)cc(Cl)cc2c2ccccc12 169338940 MEDAUDVOOZRWLE-QKKBWIMNSA-N 374.311 5.865 5 1 FKBF CN(C)[C@H](c1ccc(F)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587164054 QQOHWQZBYDCFGH-HSZRJFAPSA-N 369.443 5.659 5 1 FKBF CCCCN(CCCC)C[C@H](O)c1c(C)cnc2c1ccc1ccccc12 169334916 PWVVYOCOYFUPNO-QFIPXVFZSA-N 364.533 5.632 5 1 FKBF O=[N+]([O-])c1cc2nc([C@@H]3C[C@H]3c3c(Cl)cccc3Cl)[nH]c2cc1F 587048958 KCSXAAZYVPEQIT-HTQZYQBOSA-N 366.179 5.188 5 1 FKBF C[N+]1(C)CCC[C@@H]1c1ccc([C@@](O)(c2ccccc2)C2CCCCC2)o1 45254715 AVNRDCQRRUOTCC-NFBKMPQASA-N 354.514 5.007 5 1 FKBF Cc1ccc([C@@H](C)[C@@H](O)c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 586887126 HLCIAMKNHDPAEJ-VOIUYBSRSA-N 366.464 6.015 5 1 FKBF Cc1c(-c2ccc(Br)cc2Cl)[nH]c2cc([N+](=O)[O-])ccc12 587644111 MXDKHQCOOBOINK-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF Cc1cc(-c2ccccc2C(F)(F)F)cc2c3ccccc3c[n+](C)c12 1857536913 IYIFLKIZWRWLGJ-UHFFFAOYSA-N 352.379 5.812 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1F 587149720 AHHFBEQTFYGDBP-GJZGRUSLSA-N 372.378 5.209 5 1 FKBF CN(C/C=C/c1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)CCCCC2 653826115 ZIRPFMHQNYTUDE-AATRIKPKSA-N 350.462 5.009 5 1 FKBF Cc1cc(Cl)cc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 587269951 JTNGRGWRMOZFFA-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF C[N+](=O)[C@H](CC(=O)c1ccccc1)c1c2ccccc2cc2ccccc12 72116273 CQQURDRULVVOKC-JOCHJYFZSA-N 354.429 5.716 5 1 FKBF O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4c5ccccc5c5ccccc5c4[nH]1)(C3)C2 587969623 RJIQWZZQZRFHHW-BTWDIVNDSA-N 366.464 5.516 5 1 FKBF COc1ccc(OC)c(/C=C/c2cc(=O)oc3c2ccc2c(C)cccc23)c1 1857542883 MJPPNBMZADZHSI-BQYQJAHWSA-N 372.420 5.442 5 1 FKBF O=C(O)/C=C/c1ccccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 586878299 CHAJYFXYGVLHJY-BUHFOSPRSA-N 364.404 5.634 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc21 586890204 NUEGOTGFSVYCDB-DOKAITLOSA-N 352.481 6.337 5 1 FKBF O=[N+]([O-])c1cc2nc(/C=C\c3cccc(Cl)c3Cl)[nH]c2cc1Cl 587055125 SGDFJIUTGSXOLP-PLNGDYQASA-N 368.607 5.602 5 1 FKBF Cc1ccc([C@H](C)[C@@H](O)c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 586887125 HLCIAMKNHDPAEJ-UPCLLVRISA-N 366.464 6.015 5 1 FKBF COc1cccc([C@@H](C)Cc2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587932321 SNJGJVNKUBTOPE-AWEZNQCLSA-N 368.440 5.014 5 1 FKBF c1ccc2c(CN3CCc4c([nH]c5ccccc45)C3)c3ccccc3cc2c1 299836709 HOIQAWOYXGHYDH-UHFFFAOYSA-N 362.476 6.033 5 1 FKBF O=[N+]([O-])c1ccc(-c2cc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1 27725806 GSQDVEYSGMKGJU-UHFFFAOYSA-N 359.360 5.458 5 1 FKBF O=[N+]([O-])CCCCCCN1c2ccc(Cl)cc2Sc2cccnc21 653722455 KURWYQPIZZNWIR-UHFFFAOYSA-N 363.870 5.175 5 1 FKBF O=[N+]([O-])c1ccc2nc(-c3c[nH]c4ccccc34)cc(-c3ccccc3)c2c1 103240803 LQGHUZLZFHCQPO-UHFFFAOYSA-N 365.392 5.958 5 1 FKBF in-vitro Cc1cc(C)c2[nH]c(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)nc2c1 587271823 JEZULISMCVDQQB-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccc(F)cc3)c(-c3ccc(F)cc3)[nH]c2c1 587645479 BONAJPXMOJZHNQ-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF O=c1ccc2cc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)ccc2o1 586918208 LTNMDXGEFIMGHG-UHFFFAOYSA-N 362.388 5.643 5 1 FKBF CCCCCc1cc2nc3ccc(N(C)C)cc3[s+]c2cc1N(C)C 1857538458 AGENQGXRKMBLSK-UHFFFAOYSA-N 354.543 5.595 5 1 FKBF O=[N+]([O-])c1ccc2sc3ccccc3c3c2c1cn3CCN1CCCC1 71418509 BITVANSWSIOJTB-UHFFFAOYSA-N 365.458 5.013 5 1 FKBF Cc1cc2nc(-c3ccncc3-c3ccc(Cl)cc3)[nH]c2cc1[N+](=O)[O-] 587075491 FKXIAVNMCANUNT-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF O=[N+]([O-])c1ccc2c(Nc3ccc(Cl)cc3)c(-c3ccccc3)[nH]c2c1 587644731 BJASERIOSWUUFJ-UHFFFAOYSA-N 363.804 6.140 5 1 FKBF Fc1cccc([C@H]2C[C@@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1F 587153214 WYTMEAVTZAAHHJ-MOPGFXCFSA-N 370.402 6.419 5 1 FKBF C[C@@H](c1ccc(N(C)C)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587195132 GGGFSXSMLVXBPO-INIZCTEOSA-N 365.480 6.087 5 1 FKBF O=C(c1c(-c2ccc(Cl)cc2)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F 587645419 UIFDOHVKIDVLPV-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF COc1ccc([C@@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724736 GMFUGNKBPPBASM-GOTSBHOMSA-N 352.437 6.640 5 1 FKBF COc1ccc([C@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724737 GMFUGNKBPPBASM-PKTZIBPZSA-N 352.437 6.640 5 1 FKBF O=C(O)c1ccccc1/C=C\c1nc2c3ccccc3c3ccccc3c2[nH]1 586881311 VXEBUJSJRWZEPJ-YPKPFQOOSA-N 364.404 5.738 5 1 FKBF CC(C)[C@@H](C(=O)c1coc2cc([N+](=O)[O-])ccc12)c1ccc(Cl)cc1 587280234 PDYPPWCQCLRLKD-GOSISDBHSA-N 357.793 5.617 5 1 FKBF CCOc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)ccc1C 587778096 JCFNWMNVXBRZSO-UHFFFAOYSA-N 354.413 5.033 5 1 FKBF C[C@H](NCc1ccc2ccc3cccc4ccc1c2c34)[C@@H](O)c1ccccc1 26474192 LASREJVYHBUIFM-MRDQGFSESA-N 365.476 5.796 5 1 FKBF C[C@H](NCc1ccc2ccc3cccc4ccc1c2c34)[C@H](O)c1ccccc1 26474209 LASREJVYHBUIFM-QLXKLKPCSA-N 365.476 5.796 5 1 FKBF CCCCN(CCCC)C[C@@H](O)c1c(C)cnc2c1ccc1ccccc12 169334915 PWVVYOCOYFUPNO-JOCHJYFZSA-N 364.533 5.632 5 1 FKBF O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4cccc(Cl)c4[nH]3)c2)cc1 587273214 QSQLGETUCFVYKV-UHFFFAOYSA-N 365.776 5.584 5 1 FKBF Cn1c(-c2ccccc2)c([C@H](C[N+](=O)[O-])c2ccccc2)c2ccccc21 1857542890 OFTOXEBAWTUTNR-HXUWFJFHSA-N 356.425 5.254 5 1 FKBF C[C@H](SCc1ccccc1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 586961519 JUHVNAVKDJWLQF-AWEZNQCLSA-N 370.481 5.654 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc3ccccc3c3ccccc13)O2 587406544 SKZBGAYTLXTIBB-RUZDIDTESA-N 367.448 5.764 5 1 FKBF Cc1cccc([N+](=O)[O-])c1-c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 587105073 NIMFVDWMQYJYHS-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF Cc1ccc(C)c2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc12 587272232 QGZPPJWNNFWYJL-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF O=C(Nc1ccccc1Cl)c1nc2c3ccccc3c3ccccc3c2[nH]1 587060770 USGVPVHXDKCUTE-UHFFFAOYSA-N 371.827 5.775 5 1 FKBF CCc1c(-c2ccc(Br)cc2F)[nH]c2cccc([N+](=O)[O-])c12 587645861 MQUKAOWLVQYISQ-UHFFFAOYSA-N 363.186 5.207 5 1 FKBF C=CC(=O)OCCCCCCCCCCC[N+](C)(C)Cc1ccccc1 42921294 WFURNENOLDVZMR-UHFFFAOYSA-N 360.562 5.503 5 1 FKBF Cc1cc(Cl)ccc1-n1cccc1-c1nc2cc(F)c([N+](=O)[O-])cc2[nH]1 587066878 UWJWHCBMZBCBIW-UHFFFAOYSA-N 370.771 5.030 5 1 FKBF Cc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2C(=O)C(F)(F)F)cc1C 587645298 ORJCTNOJXFYQEL-UHFFFAOYSA-N 362.307 5.105 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C/c3ccc(OCc4ccccc4)cc3)[nH]c2c1 587785210 YSZADJYMIVFXRZ-MDWZMJQESA-N 371.396 5.221 5 1 FKBF O=C(c1cccc(C(F)(F)F)c1)c1cc2c(ccc3ccccc32)oc1=O 40950200 HMEKUVBAYQKTBF-UHFFFAOYSA-N 368.310 5.196 5 1 FKBF O=[N+]([O-])c1cccc2nc(-c3ccccc3-c3ccc(F)c(F)c3)[nH]c12 587145862 TUVJMTZQNLKYAG-UHFFFAOYSA-N 351.312 5.083 5 1 FKBF O=[N+]([O-])c1ccc2[nH]cc([C@@H](c3ccccc3)c3cc4ccccc4o3)c2c1 2382232204 OWHAQZGBIIPZSQ-HSZRJFAPSA-N 368.392 6.003 5 1 FKBF C[C@H](c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)c1ccccc1C(F)(F)F 587097590 LNYOIPPPEWCEIP-QMMMGPOBSA-N 369.730 5.295 5 1 FKBF Cc1ccc([N+](=O)[O-])c(-c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)c1 587105060 MPTSAFHXHOOUNO-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF Cn1nc(C(F)(F)F)cc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587117125 HJPZFGXNFLNIJO-UHFFFAOYSA-N 366.346 5.289 5 1 FKBF c1ccc2c(c1)N[C@H](c1cc3ccccc3c3ccccc13)[C@H]1CCCO[C@H]21 95574783 UOVBAOZXTRRJFJ-ZSQFBXSQSA-N 365.476 6.628 5 1 FKBF C[N@+]12C=CC=C1[C@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 254194041 WPEKCJPMSAXMJK-CVDCTZTESA-N 355.914 5.567 5 1 FKBF CC(C)=CCCC(C)=CCC[C@@](C)(Cl)[C@@H](O)Cc1c[nH]c([N+](=O)[O-])c1 2356846579 LIQXVRBBAVQORU-PKOBYXMFSA-N 368.905 5.297 5 1 FKBF O=C1[C@H]2CC=C[C@H]1C[C@@H](c1nc3c4ccccc4c4ccccc4c3[nH]1)C2 586888732 XRNPVRCXYYYTQQ-HRCADAONSA-N 352.437 5.508 5 1 FKBF FC(F)(F)c1cccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587113138 OMLRYGYATGUMLS-UHFFFAOYSA-N 362.354 6.555 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccccn3)c(-c3ccc(Cl)cc3F)[nH]c2c1 587645587 FCXHKQQQGAXQNP-UHFFFAOYSA-N 367.767 5.598 5 1 FKBF O=[N+]([O-])c1ccc2c(COc3ccccc3)c(-c3ccc(F)cc3)[nH]c2c1 587645911 OMDJRTMNIXTYQA-UHFFFAOYSA-N 362.360 5.461 5 1 FKBF CCN(CC)CCCNc1[nH]cc(C)c2nc3ccc4ccccc4c3c1-2 100791079 ZUCLVTHRUPDCNP-UHFFFAOYSA-N 360.505 5.273 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(OC4CCC4)cc3)nc21 587951452 LEUHPUJYAIAADI-UHFFFAOYSA-N 364.448 6.468 5 1 FKBF Fc1ccc(/C=C\c2nc3cc4nc5ccccc5nc4cc3[nH]2)c(F)c1 587152045 YEQAVQJEOBUSBV-VURMDHGXSA-N 358.351 5.108 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587160737 GAFQDEHGQLELLR-NHCUHLMSSA-N 352.412 6.280 5 1 FKBF COc1cccc([C@H](C)Cc2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587932323 SNJGJVNKUBTOPE-CQSZACIVSA-N 368.440 5.014 5 1 FKBF COc1ccc([C@@H]2c3cc([N+](=O)[O-])ccc3N[C@H](c3ccccc3)[C@H]2C)cc1 96913182 IMXQHIQNAKWAOL-BJQRDSPESA-N 374.440 5.538 5 1 FKBF Oc1ccc2scc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)c2c1 587033699 ZPEFKLQBHLOCEL-UHFFFAOYSA-N 366.445 6.457 5 1 FKBF Cn1cc2c3cc(Br)ccc3nc-2c2cc(Cl)cc(F)c21 299862520 NEVGCZPZSNYRAI-UHFFFAOYSA-N 363.617 5.386 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc21 586890205 NUEGOTGFSVYCDB-HBTZZFSCSA-N 352.481 6.337 5 1 FKBF O=C(Nc1ccc2ccc3cccnc3c2n1)c1ccc(Cl)c(Cl)c1 28223652 COHQECSXMFWWRZ-UHFFFAOYSA-N 368.223 5.342 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(Oc4ccccc4)cc3)[C@@H]1C2 95560551 UOINMRRRFZHUJR-URXFXBBRSA-N 362.537 6.048 5 1 FKBF c1ccc2c(c1)CC[C@]21C[C@@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 586893475 ZKAUUNWUMYUZSE-KOSHJBKYSA-N 362.436 5.031 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3cccc(F)c3)c(-c3ccc(F)cc3)[nH]c2c1 587646307 ZZTZTEOLRPBYDE-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF CC1(C)CCc2c(c3ccccc3c3nc(-c4ccccc4[N+](=O)[O-])[nH]c23)O1 39179366 BUTTYKFUDAMDAQ-UHFFFAOYSA-N 373.412 5.395 5 1 FKBF COc1cc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2cc1Cl 587266306 YKEZXXNAMZEIMZ-UHFFFAOYSA-N 369.764 5.060 5 1 FKBF Cc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-n2ccnc2C(C)C)cc1C 587647861 SABXAJHHFCDCLV-UHFFFAOYSA-N 374.444 5.669 5 1 FKBF Cc1[nH]c2cccc([N+](=O)[O-])c2c1[C@@H]1CCCCCN1C(=O)OC(C)(C)C 587649379 TWUQDDKXMRPPKD-HNNXBMFYSA-N 373.453 5.237 5 1 FKBF CCC(CC)Nc1c([N+](=O)[O-])cc2c(c1[N+](=O)[O-])CCC[C@]2(C)C(C)C 103190315 XUAFPIOQGVRMOC-LJQANCHMSA-N 363.458 5.354 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2c(Cl)cc(Cl)cc12 169339354 DDSTWKISZLVRST-MGPUTAFESA-N 374.311 5.865 5 1 FKBF c1ccc2nc3cc4[nH]c([C@@]56CCC[C@@H]5[C@H]5CC[C@H]6C5)nc4cc3nc2c1 586890252 NWISBMGTJOCDEU-OBEAKCLQSA-N 354.457 5.127 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)c(Cl)cc3[nH]2)ccc1Cl 587047275 DWNZDTCESZOPNZ-RQOWECAXSA-N 368.607 5.602 5 1 FKBF C[n+]1c2ccccc2c(Nc2ccc(Cl)cc2)c2[nH]c3ccccc3c21 1772599799 KTWHTZXQBMYMOJ-UHFFFAOYSA-O 358.852 5.696 5 1 FKBF O=C(Cc1cc(Cl)ccc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587279774 AGXGLHXFKKYQCC-UHFFFAOYSA-N 350.157 5.073 5 1 FKBF CCCN(CCC)c1nc(O)c2c(ccc3c4ccccc4sc32)n1 1857603429 JAHDLJZNQDCPEW-UHFFFAOYSA-N 351.475 5.330 5 1 FKBF COc1nc(Cl)nc(N[C@H](C)c2c3ccccc3cc3ccccc23)n1 1661593 JGBQYJWIBDYWOM-GFCCVEGCSA-N 364.836 5.013 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2cccc(C(F)(F)F)c2c2ccccc12 169339012 CVESWPZWGKZHKO-QRWLVFNGSA-N 373.418 5.577 5 1 FKBF O=[N+]([O-])c1ccc(Nc2nccc(-c3ccc(Cl)c(Cl)c3)n2)cc1 103300969 UDMOBMKMUWYXTL-UHFFFAOYSA-N 361.188 5.102 5 1 FKBF O=c1c2ccc3ccccc3c2oc(=S)n1-c1ccc(Cl)cc1Cl 169323638 CUUNSZIKCMASEY-UHFFFAOYSA-N 374.248 5.773 5 1 FKBF Oc1cccc2c1OCC(c1nc3c4ccccc4c4ccccc4c3[nH]1)=C2 586907054 CLQORILRIPJXBR-UHFFFAOYSA-N 364.404 5.508 5 1 FKBF CCCCN(CCCC)C[C@H](O)c1c(C)c2ccccc2c2ccccc12 1559795 GHLMCLXOZMMLGT-DEOSSOPVSA-N 363.545 6.237 5 1 FKBF CC(C)(C)C1=NN(c2ccc(Cl)cc2)[C@H](c2ccc([N+](=O)[O-])cc2)C1 299832122 RUITXMDELYMDDO-KRWDZBQOSA-N 357.841 5.602 5 1 FKBF C[C@H](Sc1ncccn1)c1nc2c3ccccc3c3ccccc3c2[nH]1 586963329 HPXXYHWOFCNSEL-ZDUSSCGKSA-N 356.454 5.513 5 1 FKBF Oc1nc(O)c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)nc2n1 587561198 FFIZZDFBIUWXCC-UHFFFAOYSA-N 363.376 5.000 5 1 FKBF CC(C)(C)OC(=O)Nc1c(-c2ccccc2)[nH]c2cccc([N+](=O)[O-])c12 587646748 JTNNLMUIOYJGOP-UHFFFAOYSA-N 353.378 5.090 5 1 FKBF CCN(CC)CCCCCCn1c2ccccc2c2nc3ccccc3nc21 1772602386 BGACNVIGLPBGLJ-UHFFFAOYSA-N 374.532 5.640 5 1 FKBF Nc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c2ccccc2c1 587252553 ZFJYCJSJZTYCQU-UHFFFAOYSA-N 361.408 5.062 5 1 FKBF c1ccc(COCCc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587566202 AKISSRIJJUEUTD-UHFFFAOYSA-N 352.437 5.629 5 1 FKBF Cc1cc(Cl)cc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc12 587266174 WNEVULNJSXTHCS-UHFFFAOYSA-N 353.765 5.360 5 1 FKBF COc1ccccc1Nc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12 1772580667 VUBZNCOCWNGCNP-UHFFFAOYSA-O 354.433 5.051 5 1 FKBF O=C(c1cccc2ccccc12)c1c(C(F)F)[nH]c2cccc([N+](=O)[O-])c12 587646455 UAQSFPPDMKFLSQ-UHFFFAOYSA-N 366.323 5.398 5 1 FKBF CCCCn1c(=O)c2cc3c(cc2c2ccccc21)C(C)(C)CCC3(C)C 49069947 FRAKLRVSJGUVFA-UHFFFAOYSA-N 361.529 6.304 5 1 FKBF O=[N+]([O-])c1cc2nc(Cc3cccc(-c4ccccc4)c3)[nH]c2cc1Cl 587961585 LVOZBWQTMYLFMC-UHFFFAOYSA-N 363.804 5.382 5 1 FKBF C[C@@H](Oc1ccc(F)c(F)c1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587148452 AIILUWFRDOLPRN-CYBMUJFWSA-N 374.390 6.288 5 1 FKBF CC(C)c1[nH]c2cccc([N+](=O)[O-])c2c1-c1ccccc1Br 587643210 BVOBAFXUUMLIFH-UHFFFAOYSA-N 359.223 5.629 5 1 FKBF CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CO)C(C)(C)CCC1 33998097 NQOXNPMIVIPDNQ-PHPDKTIJSA-N 352.562 7.013 5 1 FKBF in-vitro N[C@@H](Cc1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccccc1Cl 587059576 SKSKNBRHBDJKJH-FQEVSTJZSA-N 371.871 5.765 5 1 FKBF Cc1ccc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c2c1C 587271571 GNNDZKMKRGKMSN-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c3ccccc3nc3ccc(C)cc13)O2 587395642 SXYQZTBXZDUEHR-QFIPXVFZSA-N 368.436 5.294 5 1 FKBF CC[C@H](C)c1ccc(NC(=O)c2c(C)[nH]c3cccc([N+](=O)[O-])c23)cc1 587647110 QCZIJGIWSCTFOD-LBPRGKRZSA-N 351.406 5.150 5 1 FKBF c1cc2ccc3cccc4c(NCCCCN5CCCCC5)cc(c1)c2c34 299834355 LFQLXJISNYLXLQ-UHFFFAOYSA-N 356.513 6.262 5 1 FKBF Cc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-c2ccc(Cl)cc2)cc1 587644595 GVJZUUSZPWRXMA-UHFFFAOYSA-N 362.816 6.372 5 1 FKBF O=C(c1ccc(Cl)s1)c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 587645350 RJUIRXUXRZXWJU-UHFFFAOYSA-N 374.727 5.041 5 1 FKBF COc1ccccc1[C@@H](C[N+](=O)[O-])c1c(-c2ccccc2)[nH]c2ccccc12 2382257735 RHDQEIKBUOYTCY-LJQANCHMSA-N 372.424 5.252 5 1 FKBF CCC(CC)Oc1cc(C)nc(Oc2c(C)cc(C)cc2C)c1[N+](=O)[O-] 14974964 UITHNGUMHJRZQS-UHFFFAOYSA-N 358.438 5.583 5 1 FKBF Oc1ccc2scc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)c2c1 587032386 JCOXUOVQBFOJSV-UHFFFAOYSA-N 368.421 5.247 5 1 FKBF C[C@H]1CCc2sc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2C1 587033125 DIXSODGEXSISQR-LBPRGKRZSA-N 370.481 5.513 5 1 FKBF CCCc1c(-c2ccc(Br)c(C)c2)[nH]c2cccc([N+](=O)[O-])c12 587642999 AOVTXCKYFPPKEQ-UHFFFAOYSA-N 373.250 5.767 5 1 FKBF Cc1cc(O)c(-c2ccc([C@@H](C)N(C)C)cc2)c2c1nc(O)c1ccccc12 1857552353 KBQRGBIDUBDEQP-OAHLLOKOSA-N 372.468 5.397 5 1 FKBF CC1(C)CC(C)(C)c2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)ccc2O1 1857771539 VPENLTJXHWVOAF-UHFFFAOYSA-N 369.421 5.078 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2cccc(F)c12 1857552100 DHBLMEZBOILHCY-KRWDZBQOSA-N 360.388 5.383 5 1 FKBF COc1cc2c(Cl)nc3c4ccccc4nc(Cl)c3c2cc1OC 66262670 ZENBXYQUVGBMGM-UHFFFAOYSA-N 359.212 5.260 5 1 FKBF CC(C)Oc1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2c1 587264500 GYQKYXNMVLIARC-UHFFFAOYSA-N 363.373 5.185 5 1 FKBF CC[C@H](C)n1cc(Cl)c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)n1 587079429 KBBSXADXFOXCRU-ZDUSSCGKSA-N 374.875 6.357 5 1 FKBF Fc1cccc([C@H]2C[C@@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1F 587152343 LZTSKJRZNBMKES-OLZOCXBDSA-N 372.378 5.209 5 1 FKBF O=Cc1ccc(OCCc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587566220 AWKGRERGSMOLIW-UHFFFAOYSA-N 366.420 5.303 5 1 FKBF CC(C=CC=CC=CC(=O)O)=CC=CC=C(C)C=CC=C(C)C=CC(=O)O 2356657519 JERYLJRGLVHIEW-UHFFFAOYSA-N 366.457 5.332 5 1 FKBF c1cnc2c(c1)c1nc([C@@H]3SCCc4sccc43)[nH]c1c1cccnc12 587037350 UGKGSONUZHWHQD-LJQANCHMSA-N 374.494 5.100 5 1 FKBF Cc1ccc2nc(-c3cc(-c4cccc(F)c4C)cc([N+](=O)[O-])c3)[nH]c2c1 587135463 BUNHZUWVFBPNON-UHFFFAOYSA-N 361.376 5.561 5 1 FKBF CC(C)=CCC/C(C)=C/C[N+](C)(C)CCOC1C2CC3CC(C2)CC1C3 169347383 XXHNTSYKNVAAAT-DJKKODMXSA-N 360.606 5.597 5 1 FKBF O=[N+]([O-])c1c(Br)ccc2[nH]c(-c3ccc(C4CCC4)cc3)nc12 586881832 WBUXTNJNORYFFL-UHFFFAOYSA-N 372.222 5.168 5 1 FKBF CC(=O)Nc1cccc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587242198 ISVSQQVSYRKSKC-UHFFFAOYSA-N 365.436 5.419 5 1 FKBF O=C(Nc1ccccc1)OCCN=c1c2ccccc2ccc2ccccc12 1643736 SOTOUCNBUATWGT-UHFFFAOYSA-N 368.436 5.142 5 1 FKBF Cc1ccc(SCc2nc3c4ccccc4c4ccccc4c3[nH]2)c(C)c1 586964542 GKTCMAVIJJGXGI-UHFFFAOYSA-N 368.505 6.778 5 1 FKBF CCCCN1C(=O)c2cccc3c2c(cc2c4ccccc4sc32)C1=O 95588645 YBEAPKQBWZSYBO-UHFFFAOYSA-N 359.450 5.604 5 1 FKBF CCCn1c2ccccc2c2c3c(c4c5ccccc5n(C)c4c21)C(=O)NC3 29571237 JWKXCNVBQKKSDL-UHFFFAOYSA-N 367.452 5.093 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2ccccc2c2cc(C(F)(F)F)ccc12 169339412 XNKDPYCWUQDKAX-HRAATJIYSA-N 373.418 5.577 5 1 FKBF c1cnc2c(c1)c1nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c1c1cccnc12 586892778 WJRFGRALIOBEMX-AJYHCQFMSA-N 354.457 5.127 5 1 FKBF CC(C)=CCc1c2c(c3[nH]c4ccccc4c(=O)c3c1O)C=CC(C)(C)O2 14697183 MQTBJPBDZOXQNG-UHFFFAOYSA-N 361.441 5.080 5 1 FKBF biogenic,in-vitro C[N+]12CCCC[C@@H]1[C@H](CC1c3ccccc3Sc3ccccc31)CCC2 71296071 BLIMBNCYWMKEGF-HKUCRGJHSA-N 364.578 6.082 5 1 FKBF O=C(c1ccc(Cl)s1)c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 587645398 UEGOWDGFBOTSEG-UHFFFAOYSA-N 374.727 5.041 5 1 FKBF O=[N+]([O-])c1cccc(-c2ccc3[nH]c(=S)n(Cc4ccccc4)c3c2)c1 26660716 RZKXRZWOXZPSBJ-UHFFFAOYSA-N 361.426 5.322 5 1 FKBF CCOC(=O)c1c(-c2ccccc2[N+](=O)[O-])[nH]c2ccc([C@H](C)CC)cc12 587643032 QRJAZQQPHQYGEV-CYBMUJFWSA-N 366.417 5.433 5 1 FKBF CC1=CC[C@H](C(C)C)c2cc(C)c(OC(=O)c3cccc([N+](=O)[O-])c3)cc21 1772617468 WSEPIYDROXMSRR-GOSISDBHSA-N 365.429 5.669 5 1 FKBF O=[N+]([O-])c1ccc(C(c2c[nH]c3ccccc23)c2c[nH]c3ccccc23)o1 59116536 YSNWZYCWQHYUNX-UHFFFAOYSA-N 357.369 5.331 5 1 FKBF O=C1c2ccoc2CC[C@H]1Cc1nc2c3ccccc3c3ccccc3c2[nH]1 586908778 VHCIHBFRAZQENK-AWEZNQCLSA-N 366.420 5.450 5 1 FKBF C[C@H]1CCCCN1CCCCn1c2ccccc2c2nc3ccccc3nc21 1772624065 OTZKKTYBTBWVTJ-SFHVURJKSA-N 372.516 5.392 5 1 FKBF CCCCCCC(C)(C)c1cc(O)c2c(c1)oc(=O)c1ccc(OC)cc12 1550866 ZAIKPEWFCSQNQB-UHFFFAOYSA-N 368.473 5.908 5 1 FKBF in-vivo Clc1ccccc1CCc1nc2cc3nc4ccccc4nc3cc2[nH]1 587058117 DKKAVUSXXFLNMR-UHFFFAOYSA-N 358.832 5.098 5 1 FKBF Cc1cc(C)cc(Nc2c(N)cccc2-c2nc3cccc([N+](=O)[O-])c3[nH]2)c1 587240679 HQDZJDVTOVPALI-UHFFFAOYSA-N 373.416 5.081 5 1 FKBF CCCc1c(O)ccc2c1O[C@H](c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2=O 587468947 FNPSFUAVTISJOI-FQEVSTJZSA-N 369.417 5.083 5 1 FKBF CC(C)c1c(-c2cccc(Br)c2)[nH]c2cc([N+](=O)[O-])ccc12 587642969 AIAWGJFNIPGTQK-UHFFFAOYSA-N 359.223 5.629 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(C(F)(F)Br)c(-c3ccccc3)c12 587644906 FLCKIRBUORNLKI-UHFFFAOYSA-N 367.149 5.187 5 1 FKBF O=C(Nc1ccc(Cl)cc1)Nc1cccc(-c2cccc([N+](=O)[O-])c2)c1 1772582045 JSKYMIIYLFUZTE-UHFFFAOYSA-N 367.792 5.559 5 1 FKBF Cc1ccc2c(c1)c(O)nc1c(C)cc(O)c(-c3ccc([C@@H](C)CN)cc3)c12 1857619201 PGWJMVXANDVSAJ-HNNXBMFYSA-N 372.468 5.145 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cc(-n4cccc4)ccc3Cl)[nH]c2cc1Cl 587051314 VOGYALNCYLLLGM-UHFFFAOYSA-N 373.199 5.236 5 1 FKBF O=C(c1cccc(OCc2ccccc2)c1)c1coc2cc([N+](=O)[O-])ccc12 587279685 ODVQKRNTOSKRTB-UHFFFAOYSA-N 373.364 5.151 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(CSCc3ccsc3)nc21 587026343 UEJVUSUGAWYDOD-UHFFFAOYSA-N 360.507 6.364 5 1 FKBF CCc1ccccc1NC(=O)c1nc2c3ccccc3c3ccccc3c2[nH]1 587240982 MTOOTARISDFJGX-UHFFFAOYSA-N 365.436 5.684 5 1 FKBF CCCOc1cccc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587778535 LVXZMUHFDSECJA-UHFFFAOYSA-N 366.464 6.249 5 1 FKBF CC(=O)c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])c4cccnc34)n2C)cc1 1857642930 ODUWUOZBBUENDO-UHFFFAOYSA-N 371.396 5.018 5 1 FKBF CC[n+]1cc(/C=C2\SC=CN2C)c(C)c2cc(OC)c3ccccc3c21 40972244 XQCWEZQINGVEGY-MTJSOVHGSA-N 363.506 5.066 5 1 FKBF Cc1cc2nc(-c3ccc4ccc(Cl)c(Cl)c4n3)[nH]c2cc1[N+](=O)[O-] 587083093 GCEVLEVBVKHOLE-UHFFFAOYSA-N 373.199 5.302 5 1 FKBF CC(=O)c1ccc(Oc2c3ccccc3nc3oc4ccccc4c23)cc1 45291173 OYVHJHNMZIYCAX-UHFFFAOYSA-N 353.377 6.129 5 1 FKBF O=[N+]([O-])c1ccc(/C=C/C2=NN(c3ccccc3)[C@H](c3ccco3)C2)cc1 971141 CZVIDOWCYBCYFZ-ZBWUASRJSA-N 359.385 5.209 5 3 FKBF O=C(C[C@@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1cccc(F)c1 49853568 IUZRAMZCEBNUIK-HXUWFJFHSA-N 370.424 5.368 5 1 FKBF CCCN1CCC(COc2nc3ccccc3c3cc(F)ccc23)CC1 95572738 FUAKKVJIUKYDQT-UHFFFAOYSA-N 352.453 5.028 5 1 FKBF Cc1ccc([C@@H](C)[C@H](O)c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 586887124 HLCIAMKNHDPAEJ-GYCJOSAFSA-N 366.464 6.015 5 1 FKBF CN(C)[C@@H](c1ccc(F)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587164063 QQOHWQZBYDCFGH-QHCPKHFHSA-N 369.443 5.659 5 1 FKBF CN1CCC[C@@H]1C[C@@H](O)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339377 YZENIFOTBGKBLX-IIBYNOLFSA-N 374.311 5.818 5 1 FKBF O=c1cc(-c2ccccc2Br)oc2ccc3ccccc3c12 1857767271 OLHAULFYTAWXJQ-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF Cc1[nH]c2ccccc2c1[C@H](Nc1ccccc1)c1ccc([N+](=O)[O-])cc1 84609912 SQOQCTLLQYSMCW-JOCHJYFZSA-N 357.413 5.586 5 1 FKBF O=C(c1cc(F)c(Cl)cc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280104 JENCHQLOGNZEOV-UHFFFAOYSA-N 354.120 5.018 5 1 FKBF CCCOc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 73239823 JVOFNFADGITXKS-UHFFFAOYSA-N 354.413 5.115 5 1 FKBF O=C(Oc1cccc2oc(-c3ccccc3)cc12)c1ccc([N+](=O)[O-])cc1 96911049 QWIWQLQHKGNURM-UHFFFAOYSA-N 359.337 5.227 5 1 FKBF Clc1ccc([C@@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724710 JNXFFUXXCQXBBG-FCHUYYIVSA-N 356.856 7.285 5 1 FKBF Clc1ccc([C@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71315915 CMPJCHPQDIBNCS-OAQYLSRUSA-N 356.856 6.085 5 1 FKBF C=CC(=O)Nc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587244194 MXESPIVRQGFALP-UHFFFAOYSA-N 363.420 5.661 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c3ccccc3cc3ccccc13)O2 587405484 LLEDXGLHYFURJI-JOCHJYFZSA-N 353.421 5.590 5 1 FKBF O=[N+]([O-])c1ccc([C@@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724702 MNHOJKHCVKBGIQ-FCHUYYIVSA-N 367.408 6.540 5 1 FKBF Cc1ccc2c3c(cc(-c4ccccc4[N+](=O)[O-])nc13)-c1ccccc1C2=O 587096910 DHIXWJXHKJBZTB-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF CC(=O)S[C@H]1CC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 1857569394 FUWOOYFXEWDHNG-IYBDPMFKSA-N 352.455 5.252 5 1 FKBF Fc1cccc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)n[nH]c12 587177659 SFDWNIBPCBQZOD-UHFFFAOYSA-N 352.372 5.552 5 1 FKBF CCCOc1cccc(Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587777585 BAZCJORZFVQPID-UHFFFAOYSA-N 368.440 5.039 5 1 FKBF CCC[C@H](C)[C@@H]1CCc2c1ccc1c2ccc2c3cccc(C)c3ccc12 2356605339 BUQMYMPMZDOPMU-HKUYNNGSSA-N 352.521 7.921 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccccc2c2c(C(F)(F)F)cccc12 169338953 RJPPUDBSXRWQTA-FOIQADDNSA-N 373.418 5.577 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc3ccc4ccccc4c3c1)O2 587406125 PEUPDTRJOPMQOR-VWLOTQADSA-N 367.448 5.764 5 1 FKBF C[C@@]1(c2ccc(Cl)cc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587499380 IQGQPXRMKGOVLZ-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF CCCc1c(-c2ccc(Br)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587643372 DSJHKKHAGFUNRB-UHFFFAOYSA-N 359.223 5.458 5 1 FKBF NC(=O)Nc1cccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587242624 WCLJJWMMCJQIEG-UHFFFAOYSA-N 352.397 5.027 5 1 FKBF CCC(C)(C)c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 586882229 WQSZIVHWYGDIMQ-UHFFFAOYSA-N 366.468 6.014 5 1 FKBF O=C(C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1)c1ccccc1 49816767 SGJHGBRSGXOPCU-HXUWFJFHSA-N 364.376 5.160 5 1 FKBF CC(=O)c1ccc(Nc2c3ccccc3nc3oc4ccccc4c23)cc1 45288430 FRLSEASONDEFOD-UHFFFAOYSA-N 352.393 6.080 5 1 FKBF O=[N+]([O-])c1ccc(SN2c3ccccc3Sc3ccccc32)cc1 84605024 AMACFGZKRFFPKG-UHFFFAOYSA-N 352.440 5.905 5 1 FKBF CC[C@H](Oc1ccccc1F)c1nc2c3ccccc3c3ccccc3c2[nH]1 587155848 NLEKUKQWIBSMRP-FQEVSTJZSA-N 370.427 6.539 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2cc(C(F)(F)F)ccc2c2ccccc12 169337921 YXHWJZHHIPINPC-KKSFZXQISA-N 373.418 5.577 5 1 FKBF Cc1cc2[nH]c([C@H](Cc3ccccc3)c3ccccc3)nc2cc1[N+](=O)[O-] 587956397 ZNGRPUIOEKEDIQ-GOSISDBHSA-N 357.413 5.154 5 1 FKBF CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587953063 ZAAMADPLWHZJOH-GDLVEWKHSA-N 351.834 5.171 5 1 FKBF CC(C)c1c(Cc2ccc(Cl)cc2Cl)[nH]c2cc([N+](=O)[O-])ccc12 587645099 VJNWPFMSXBMSLI-UHFFFAOYSA-N 363.244 6.097 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccc(F)cc12 1857597092 UXTTYRLYUHMJFU-IBGZPJMESA-N 360.388 5.383 5 1 FKBF C(=Cc1ccco1)c1ccc2cc3ccc(C=Cc4ccco4)nc3cc2n1 2356844729 NYOUGZJXSQNNDR-UHFFFAOYSA-N 364.404 6.310 5 1 FKBF CC(C)=CCC/C(C)=C/CC[C@@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1 66104208 LIQXVRBBAVQORU-AXTVGJDGSA-N 368.905 5.297 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c([C@@H]3SCCc4sccc43)nc21 587036780 NAKYXEJEJDMZTR-OAQYLSRUSA-N 372.518 6.310 5 1 FKBF COc1ccc(Cc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1OC 587925798 HTVPDGJKRYFDOO-UHFFFAOYSA-N 368.436 5.477 5 1 FKBF O=C(c1ccccc1C(F)(F)F)c1cc2c(ccc3ccccc32)oc1=O 40950199 MLFBVJOBSNCHIY-UHFFFAOYSA-N 368.310 5.196 5 1 FKBF CCCCn1c(-c2c(O)ccc3ccccc23)nc2ccc([N+](=O)[O-])cc21 103179255 GFLDPINBGRKMHC-UHFFFAOYSA-N 361.401 5.270 5 1 FKBF CC(/C=C/C=C/C=C/C(=O)O)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C(=O)O 238776270 JERYLJRGLVHIEW-VAGPMXNHSA-N 366.457 5.332 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3c[nH]c4ccc(F)cc34)c(C(F)(F)F)c12 587646021 ICLFDMUWQKCPCO-UHFFFAOYSA-N 363.270 5.382 5 1 FKBF C[N+]1(C)CCC[C@@H]1c1ccc([C@](O)(c2ccccc2)C2CCCCC2)o1 45256749 AVNRDCQRRUOTCC-OFNKIYASSA-N 354.514 5.007 5 1 FKBF Cc1ccccc1-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 95564505 RWZFUZZUQDYACO-ZCYQVOJMSA-N 360.565 6.231 5 1 FKBF O=C(C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1)c1ccccc1 49816766 SGJHGBRSGXOPCU-FQEVSTJZSA-N 364.376 5.160 5 1 FKBF c1ccc2nc3cc4[nH]c([C@@H]5SCCc6sccc65)nc4cc3nc2c1 587036568 GGIAENPIEKERPS-LJQANCHMSA-N 374.494 5.100 5 1 FKBF O=C(c1c(-c2cccc(Cl)c2)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F 587644866 FFUUSALTJNHQHC-UHFFFAOYSA-N 368.698 5.142 5 1 FKBF CCCCN(CCCC)C[C@@H](O)c1c(C)c2ccccc2c2ccccc12 5783528 GHLMCLXOZMMLGT-XMMPIXPASA-N 363.545 6.237 5 1 FKBF c1ccc2c(c1)nc1c3nc4ccccc4c4ccnc(c5cncc2c51)c43 238764915 XUOINYZLTRPKFA-UHFFFAOYSA-N 356.388 5.624 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3ccccc3c3ccccc13)O2 587407091 WZXRZYPGIKWDBW-HSZRJFAPSA-N 353.421 5.590 5 1 FKBF CC(C)(C)Nc1c(-c2c3ccccc3cc3ccccc23)nc2cnccn12 95558813 HDLUJJCNTDBGQQ-UHFFFAOYSA-N 366.468 5.913 5 1 FKBF Cn1c2ccccc2c(=Nc2ccc(Cl)cc2)c2oc3ccccc3c21 1772619664 VAVMXONLICVZCQ-UHFFFAOYSA-N 358.828 5.964 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4cccc(O)c4)cc3)[C@@H]1C2 95561525 WEHFQRNZOSJWAC-UPVQGACJSA-O 362.537 5.628 5 1 FKBF c1ccc2c(c1)C[C@@H](c1nc3c4cccnc4c4ncccc4c3[nH]1)S2 587043903 XAXFNNIIEBTAJG-INIZCTEOSA-N 354.438 5.049 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(-c3ccc([N+](=O)[O-])cc3)c(OC(C)=O)c2c1 587641504 GPIJZPNWTOUKSW-GFCCVEGCSA-N 352.390 5.182 5 1 FKBF COc1ccc2[nH]c3ccc4ccc(NCCN5CCCCC5)cc4c3c2c1 26171006 WFORROBGTZAJNX-UHFFFAOYSA-N 373.500 5.381 5 1 FKBF O=C1NC(=O)c2c1c1c3ccccc3sc1c1sc3ccccc3c21 35242301 CQEVJRRZNCUCAW-UHFFFAOYSA-N 359.431 5.306 5 1 FKBF CN(C)[C@@H]1CCc2c(cccc2-c2c3ccccc3cc3ccccc23)C1 1911579452 DBUFMYHPGGUVEP-OAQYLSRUSA-N 351.493 6.079 5 1 FKBF O=C(C[C@@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1ccccc1 49807775 PONOGVXIIRSESP-HXUWFJFHSA-N 352.434 5.229 5 1 FKBF CC(C)c1[nH]c2cc([N+](=O)[O-])ccc2c1-c1ccccc1Br 587643628 HCMDHYMKKREBRC-UHFFFAOYSA-N 359.223 5.629 5 1 FKBF C[N@+]12CCCC[C@@H]1[C@H](CC1c3ccccc3Sc3ccccc31)CCC2 254100905 BLIMBNCYWMKEGF-QRJOEMBSSA-N 364.578 6.082 5 1 FKBF Cc1ccc(C2=Cc3ccccc3[C@@H](C[N+](=O)[O-])N2c2ccc(F)cc2)cc1 653801293 LDQOCFLBPYPPMH-HSZRJFAPSA-N 374.415 5.470 5 1 FKBF Cc1cc(C)cc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)c1 1772610964 UWKGDDAFAPMQRG-UHFFFAOYSA-N 352.437 5.927 5 1 FKBF CCc1ccc([C@@H](Nc2ccc(C)c([N+](=O)[O-])c2)[C@H]2CCCCC2=O)cc1 66262523 WJZLDUFERLJEHF-SIKLNZKXSA-N 366.461 5.378 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C\c3ccccc3Oc3ccccc3)[nH]c12 587951380 ZDJNUDHIOKHHBC-YPKPFQOOSA-N 357.369 5.434 5 1 FKBF O=c1cc(Nc2ccccc2Br)c2ccc3ccccc3c2o1 53295551 BLRQTFRKQKWEKS-UHFFFAOYSA-N 366.214 5.452 5 1 FKBF O=[N+]([O-])c1cc2[nH]c(-c3sccc3-c3ccc(F)cc3)nc2cc1Cl 587164865 XOPPOFKUDKVCNN-UHFFFAOYSA-N 373.796 5.659 5 1 FKBF C[C@@H](Sc1ncccn1)c1nc2c3ccccc3c3ccccc3c2[nH]1 586963328 HPXXYHWOFCNSEL-CYBMUJFWSA-N 356.454 5.513 5 1 FKBF Fc1ccc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)coc2c1 587174701 LSBNRXIKJGNJKN-UHFFFAOYSA-N 352.368 6.422 5 1 FKBF CC[C@@H](C)c1ccc(NC(=O)c2c(C)[nH]c3cccc([N+](=O)[O-])c23)cc1 587647109 QCZIJGIWSCTFOD-GFCCVEGCSA-N 351.406 5.150 5 1 FKBF c1ccc([C@@H]2C[C@H]2Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1 587958969 ANTQCVSHLQRNOT-HOTGVXAUSA-N 350.425 5.006 5 1 FKBF O=C(C[C@@H](Sc1ccccc1)c1ccccc1)c1cccc([N+](=O)[O-])c1 72113591 WAXQEVWFMAESHV-OAQYLSRUSA-N 363.438 5.701 5 1 FKBF Cc1[nH]c2ccc(F)c(Cl)c2c1-c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 587629892 MNZSKYJVZXJVDZ-UHFFFAOYSA-N 372.705 5.863 5 1 FKBF Brc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)o1 587006169 DTXXQIJVEUTXHJ-UHFFFAOYSA-N 363.214 5.892 5 1 FKBF Cc1c(Cl)ccc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 587269840 HLSNRAGNSPEPRW-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c3ccccc3nc3ccc(C)cc13)O2 587395641 SXYQZTBXZDUEHR-JOCHJYFZSA-N 368.436 5.294 5 1 FKBF Oc1ccc2ccccc2c1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 98084292 FVZXIBDNPCXQPN-UHFFFAOYSA-N 362.392 5.185 5 1 FKBF COc1ccc(-c2oc3ccccc3c2C(=O)c2ccc([N+](=O)[O-])cc2)cc1 96922062 NNVGMRQPYRCFCT-UHFFFAOYSA-N 373.364 5.248 5 1 FKBF CCCCn1c(=O)c2ccccc2c2cc3c(cc21)C(C)(C)CCC3(C)C 49113055 RABUNQZSAUTDKL-UHFFFAOYSA-N 361.529 6.304 5 1 FKBF FC(F)(F)c1cccc2c(-c3ccccc3)c3cc4ccccc4cc3nc12 1772574187 OAEGFFFYKAJSNE-UHFFFAOYSA-N 373.377 7.227 5 1 FKBF OC[C@H]1C[C@H](c2c3ccccc3cc3ccccc23)N(Cc2ccccc2)O1 28567611 MSTYJZCYVYXJAT-ZJSXRUAMSA-N 369.464 5.233 5 1 FKBF CCCc1c(-c2ccc(Br)cc2)[nH]c2cccc([N+](=O)[O-])c12 587643871 JZTSMCVKSXPMDV-UHFFFAOYSA-N 359.223 5.458 5 1 FKBF CC[C@@H](Oc1ccccc1F)c1nc2c3ccccc3c3ccccc3c2[nH]1 587155850 NLEKUKQWIBSMRP-HXUWFJFHSA-N 370.427 6.539 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2c3cccnc3c3ncccc3c2[nH]1 587951592 HMEFICSQXIUBMU-RKVPGOIHSA-N 374.488 5.706 5 1 FKBF O=C(c1ccc([N+](=O)[O-])cc1)c1c(-c2ccccc2)sc2c1CCCC2 1772641040 QIGPGYOTNASDLC-UHFFFAOYSA-N 363.438 5.433 5 1 FKBF Cc1cccc2c(Cl)c3cnc4c(c(C)nn4-c4ccccc4)c3nc12 28975815 UIRLCDNMNRICJY-UHFFFAOYSA-N 358.832 5.392 5 1 FKBF O[C@@H](c1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccccc1Cl 587059514 RJSHXQAWOJDZEN-OAQYLSRUSA-N 358.828 5.604 5 1 FKBF CC[N+](CC)(CC)Cc1ccc2c(=O)cc(-c3ccc(Cl)cc3)oc2c1 103219218 JGCRVIGORQJMKA-UHFFFAOYSA-N 370.900 5.490 5 1 FKBF O[C@H](C[C@@H]1CCCCN1)c1cc2cc(C(F)(F)F)ccc2c2ccccc12 169337922 YXHWJZHHIPINPC-HRAATJIYSA-N 373.418 5.577 5 1 FKBF COc1cc(C)c(N)c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587248700 FPCQKZSFRHAWHC-UHFFFAOYSA-N 353.425 5.436 5 1 FKBF C[C@@]1(c2c(Cl)cccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587504981 KDEHRQINKFNKGM-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF Cc1ccc(N=c2c3ccccc3n(C)c3c2oc2ccccc23)cc1C 1772619970 SHURXBPOXFKSBY-UHFFFAOYSA-N 352.437 5.927 5 1 FKBF CC12c3ccccc3C(C)(c3ccccc31)[C@@H](c1ccccc1)[C@@H]2[N+](=O)[O-] 34133357 VCZAJAOFTQXHQO-WOLZVPSQSA-N 355.437 5.055 5 1 FKBF biogenic Oc1ccc(C2(c3nc4c5ccccc5c5ccccc5c4[nH]3)CC2)cc1 586898392 KAFCFGXXLPTQEN-UHFFFAOYSA-N 350.421 5.655 5 1 FKBF Cc1cc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c2cc1C 587273029 YZQNDAGMDHPZJG-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF O=[N+]([O-])c1cccc(/C=C/c2ccc3c(Cl)cc(Cl)c(O)c3n2)c1 1857542000 DUCSSZTVNIIKSH-SNAWJCMRSA-N 361.184 5.326 5 1 FKBF Oc1ccc2ccccc2c1-c1cc2nc3ncccc3nc2c2ccccc12 72110814 ANXDFMABKXTRII-UHFFFAOYSA-N 373.415 5.857 5 1 FKBF Cc1cc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2cc1C 586968697 HTMSTGMOHSGBHU-UHFFFAOYSA-N 355.463 5.503 5 1 FKBF Cc1nc2c(nc1Cl)nc(Oc1ccc(Cl)cc1)c1ccccc12 13220970 VUYQLOWHSTYYTL-UHFFFAOYSA-N 356.212 5.586 5 1 FKBF CCCCCCc1ccc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 45335775 DFISYKPKHKQYLN-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF CNC(=O)OCc1ccc(Sc2c3ccccc3nc3ccccc23)cc1 13603441 IGLYFURJTBUHMM-UHFFFAOYSA-N 374.465 5.395 5 1 FKBF COC(=O)CCc1nc2c(o1)c1c(C)coc1c1ccc3c(C)cccc3c12 38279210 GPXRNFPBXPTCPZ-UHFFFAOYSA-N 373.408 5.603 5 1 FKBF biogenic CC(C)(C)CC(C)(C)c1ccc(O)c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 45188428 LCVZENCPHQSOEO-UHFFFAOYSA-N 370.449 5.267 5 1 FKBF C[C@@]1(c2ccc(Cl)c([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587501385 AMRFPYNFKJMJPL-FQEVSTJZSA-N 371.820 5.008 5 1 FKBF FC(F)=C(C[C@H]1CCCN1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587087107 BBFPXBAODLQGID-CYBMUJFWSA-N 363.411 5.619 5 1 FKBF COc1c(F)ccc(F)c1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587132632 GHYCLFIDDLCVDB-UHFFFAOYSA-N 360.363 5.823 5 1 FKBF O=[N+]([O-])c1ccc(SN2Cc3ccccc3Oc3ccccc32)cc1 84597102 AENXDILWWKHDSW-UHFFFAOYSA-N 350.399 5.414 5 1 FKBF O=[N+]([O-])c1cccc2nc(Cc3ccc(-c4ccccc4Cl)cc3)[nH]c12 587063427 UZPSCCLJUHBSPL-UHFFFAOYSA-N 363.804 5.382 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2cc(C(F)(F)F)ccc2c2ccccc12 169337923 YXHWJZHHIPINPC-IERDGZPVSA-N 373.418 5.577 5 1 FKBF C[C@@H]1CCc2sc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2C1 587033120 DFKGBFBAYXNSME-CQSZACIVSA-N 368.505 6.723 5 1 FKBF CNc1cc(Cl)ccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1 587066048 FRJSODYTENGEEJ-UHFFFAOYSA-N 359.820 5.021 5 1 FKBF CC/C(=C/c1nc2cc3nc4ccccc4nc3cc2[nH]1)c1ccc(C)cc1 587968560 USLIVDLPJBDVKX-VBKFSLOCSA-N 364.452 5.918 5 1 FKBF O[C@@H](C[C@H]1CCCCN1)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169338478 CYSYOXUUGZRCBN-IERDGZPVSA-N 374.311 5.865 5 1 FKBF O=[N+]([O-])C[C@@H](c1cccc(F)c1)c1c(-c2ccccc2)[nH]c2ccccc12 1857578359 XBRWORUVWLBYAO-IBGZPJMESA-N 360.388 5.383 5 1 FKBF CC(C)(C)c1cc2[nH]c1ccc1nc(c3ccc(ccc4nc2C=C4)[nH]3)C=C1 2382256356 NULKWLRZJNWSOJ-UHFFFAOYSA-N 366.468 5.953 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587160739 GAFQDEHGQLELLR-SFTDATJTSA-N 352.412 6.280 5 1 FKBF C[C@]1(c2c(Cl)cccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587504982 KDEHRQINKFNKGM-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF O=C(O)C[C@@H](CC(=O)c1ccc2c(ccc3ccccc32)c1)c1ccccc1 95572898 DHMDGIGCHWMDAE-OAQYLSRUSA-N 368.432 5.824 5 1 FKBF CN1CCC[C@@H]1C[C@H](O)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 221611154 YZENIFOTBGKBLX-IERDGZPVSA-N 374.311 5.818 5 1 FKBF FC(F)(F)[C@](F)(Cl)c1nc2c3ccccc3c3ccccc3c2[nH]1 587089911 IQRUMUJUDQCNGY-INIZCTEOSA-N 352.718 5.793 5 1 FKBF Cc1c(NC(N)=O)cccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587238865 GNDQOGMDUOIZIH-UHFFFAOYSA-N 366.424 5.335 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3c4c(ccc3[nH]2)CCCC4)o1 587264965 KQUOVWFERHUTAL-UHFFFAOYSA-N 359.385 5.277 5 1 FKBF Cc1nc2c(Sc3ccc(Cl)cc3)cc(Cl)cn2c1[N+](=O)[O-] 2382242114 DCPSCTJYTUWUNG-UHFFFAOYSA-N 354.218 5.009 5 1 FKBF CC/N=c1/cc2oc3cc(N)c4cc5ccccc5cc4c3nc-2cc1C 29059170 GIJPBOOGNBSIAO-PLRJNAJWSA-N 353.425 5.050 5 1 FKBF Fc1ccc2c(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)coc2c1 587175928 YHBSSXIMDZLHOI-UHFFFAOYSA-N 354.344 5.212 5 1 FKBF O[C@H]1C[C@H](c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586903086 NIGNKJPYSPIWGU-SFTDATJTSA-N 350.421 5.438 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3ccc(C(F)(F)F)cc3[nH]2)ccc1Cl 587048058 PMKDVLUAIVVQGZ-QHHAFSJGSA-N 367.714 5.314 5 1 FKBF Cc1ccc(/C=C\c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1F 587146893 ZWXIKTWQSSZMGG-SEYXRHQNSA-N 352.412 6.487 5 1 FKBF CC(C)(C)OC(=O)N1CCC[C@H]1c1c(C2CC2)[nH]c2cc([N+](=O)[O-])ccc12 587648556 IIXLFFBBQBPNDS-INIZCTEOSA-N 371.437 5.026 5 1 FKBF CC/C(=C\c1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccc(C)cc1 587965738 DINMKVACGXLLMB-FBMGVBCBSA-N 362.476 7.128 5 1 FKBF CC[C@H](C)c1ccc2[nH]c(C)c(-c3cc(OC)c(OC)cc3[N+](=O)[O-])c2c1 587643560 VEQVHBADBJLLTN-LBPRGKRZSA-N 368.433 5.582 5 1 FKBF O=c1[nH]ccc2c3[nH]c(-c4cccc(Cl)c4)nc3c3ccc(F)cc3c12 29135961 FXXDMZILWKTCLN-UHFFFAOYSA-N 363.779 5.017 5 1 FKBF CCc1ccc([C@H](Nc2ccc(C)c([N+](=O)[O-])c2)[C@@H]2CCCCC2=O)cc1 66262516 WJZLDUFERLJEHF-KNQAVFIVSA-N 366.461 5.378 5 1 FKBF Cc1ccc(SCc2nc3cc4nc5ccccc5nc4cc3[nH]2)c(C)c1 586964925 ONRZUDVTXHPUDK-UHFFFAOYSA-N 370.481 5.568 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3ccc4c(c3[nH]2)CCCC4)ccc1Cl 587048815 YUBSJAAGABWCBP-POHAHGRESA-N 353.809 5.174 5 1 FKBF FC(F)Oc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 587130805 RYAQDNSFONLYDC-UHFFFAOYSA-N 360.363 6.138 5 1 FKBF Cc1cc(-c2ccc(OC(F)(F)F)cc2)cc2c3ccccc3c[n+](C)c12 1857537128 UBKVEOBVXUUDBK-UHFFFAOYSA-N 368.378 5.692 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1F)c1c(-c2ccccc2)[nH]c2ccccc12 1857560765 WKZAFOINPWVCDN-GOSISDBHSA-N 360.388 5.383 5 1 FKBF O=[N+]([O-])c1ccc2nc(Cc3ccc(-c4ccccc4Cl)cc3)[nH]c2c1 587063075 NELMVDJGKHMGPW-UHFFFAOYSA-N 363.804 5.382 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1F 587153220 WYTMEAVTZAAHHJ-RTBURBONSA-N 370.402 6.419 5 1 FKBF O=C(c1sc2ccccc2c1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280803 YXHOKPUFEDTHNW-UHFFFAOYSA-N 357.774 5.440 5 1 FKBF O=c1cc(-c2ccccc2Br)oc2c1ccc1ccccc12 1772593488 NWAKBKFXVSJYCC-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF CC[n+]1c2c3c(nc(-c4ccccc4)cc3c3ccccc31)-c1ccccc1-2 1772611464 YSGYMVVVPSQKBF-UHFFFAOYSA-N 359.452 6.010 5 1 FKBF Cc1ccc2c([C@H](C[N+](=O)[O-])c3cccs3)c(C3CCCC3)[nH]c2c1 1857588964 NMGLDBDXFHOHON-MRXNPFEDSA-N 354.475 5.604 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2cc(F)ccc12 1857597015 GJZMAVHJIVDKDJ-LJQANCHMSA-N 360.388 5.383 5 1 FKBF CC(C)Oc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 73224860 OAMOZFLCWXZHHE-UHFFFAOYSA-N 354.413 5.114 5 1 FKBF C[C@@H]1CCc2sc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)cc2C1 587033179 GKASSYWWGPFXJP-GFCCVEGCSA-N 370.481 5.513 5 1 FKBF O=C(Nc1nc2c(ccc3ccccc32)s1)Nc1ccccc1[N+](=O)[O-] 103293632 PBIIZYJLDGWPAS-UHFFFAOYSA-N 364.386 5.002 5 1 FKBF O=C(c1cc(Cl)ccc1C(F)(F)F)c1coc2cc([N+](=O)[O-])ccc12 587280194 NFSLAKQKVCZIKW-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF COC(=O)[C@H](c1ccc(Cl)cc1)c1c2ccccc2nc2ccccc12 26816014 DRTRYUZPVGYJKT-HXUWFJFHSA-N 361.828 5.346 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc3c(ccc4ccccc43)c1)O2 587406483 RSEPFTQNHFOXPT-RUZDIDTESA-N 367.448 5.764 5 1 FKBF C[C@H](Oc1ccc(F)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587169130 TUMRNWDFGDXDHP-AWEZNQCLSA-N 356.400 6.148 5 1 FKBF CCCNc1nc2ccccc2c2c(=O)c3c(Cl)cccc3sc12 2382244874 XJCACHQEIUKOLI-UHFFFAOYSA-N 354.862 5.438 5 1 FKBF Cn1c2ccccc2c(=Nc2ccc(F)cc2F)c2oc3ccccc3c21 1772626249 TVPYHLRPLTXJEF-UHFFFAOYSA-N 360.363 5.588 5 1 FKBF Fc1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)c(F)c1 587151257 RGRNABOZUOMDBZ-ZRDIBKRKSA-N 356.375 6.318 5 1 FKBF O=[N+]([O-])c1c(Cl)cc2c(c1Cl)Oc1cc(Cl)c(Cl)cc1O2 6091476 YCAPHOOJTVTGBO-UHFFFAOYSA-N 366.971 6.106 5 1 FKBF O=C(C[C@H](Sc1ccccc1)c1ccccc1)c1cccc([N+](=O)[O-])c1 72113592 WAXQEVWFMAESHV-NRFANRHFSA-N 363.438 5.701 5 1 FKBF COc1cccc2c1ccc1c(/C=C/c3ccc([N+](=O)[O-])cc3)cc(=O)oc12 1857598413 AACBVKMYDLRZGC-VMPITWQZSA-N 373.364 5.033 5 1 FKBF COc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-c2cccc(F)c2)cc1 587645563 CRHDVNVFPHNHQJ-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=NCc3ccc(F)cc3)c2c1 653717079 LVVAUUDESUCNAY-UHFFFAOYSA-N 366.823 5.223 5 1 FKBF Fc1ccc2c(-c3nc4c5cccnc5c5ncccc5c4[nH]3)coc2c1 587175975 YYMJFBVNXJLESB-UHFFFAOYSA-N 354.344 5.212 5 1 FKBF CN1CCC[C@H]1C[C@@H](O)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339379 YZENIFOTBGKBLX-HRAATJIYSA-N 374.311 5.818 5 1 FKBF CCCCC(=O)OCn1ccc2c(C)c3nc4ccccc4c3c(C)c2c1 377841287 NPZRSNNJSGJLOW-UHFFFAOYSA-N 360.457 5.650 5 1 FKBF CCc1oc2ccccc2c1-c1nc2c3ccccc3c3ccccc3c2[nH]1 586904395 VBBLNKDTDWCCBH-UHFFFAOYSA-N 362.432 6.845 5 1 FKBF C[N+]12C=CC=C1[C@@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 31871178 WPEKCJPMSAXMJK-HWYAHNCWSA-N 355.914 5.567 5 1 FKBF Cc1ccc(Cc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1C(F)(F)F 587095172 RFCXSRLOKMEQEO-UHFFFAOYSA-N 369.730 5.043 5 1 FKBF O=C(c1c(-c2cc3ccccc3o2)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F 587645170 JVNSCSGBAJCKHY-UHFFFAOYSA-N 374.274 5.234 5 1 FKBF CC1(C)CCc2c(c3ccccc3c3nc(-c4cccc([N+](=O)[O-])c4)[nH]c23)O1 39142766 PKHFLMYHIJMITF-UHFFFAOYSA-N 373.412 5.395 5 1 FKBF O=[N+]([O-])c1cccc([C@@H]2C[C@H](c3c4ccccc4cc4ccccc34)N=N2)c1 169724734 FKKDTPXDJPVDEE-FCHUYYIVSA-N 367.408 6.540 5 1 FKBF Cn1c2ccccc2c2ccc(C[N+](C)(C)CC3=CC[C@H]4C[C@@H]3C4(C)C)cc21 95562882 ADJZEARNEOEAPU-REWPJTCUSA-N 373.564 5.900 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2ccc(C(F)(F)F)cc2c2ccccc12 169339404 IMIVAWPBXCYUSL-IIBYNOLFSA-N 373.418 5.577 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc3ccc4ccccc4c3c1)O2 587406124 PEUPDTRJOPMQOR-RUZDIDTESA-N 367.448 5.764 5 1 FKBF COc1cc(/C=C/c2cc(=O)oc3c2ccc2ccccc23)cc(OC)c1 1857578082 OKKFNKQVBBYKFT-BQYQJAHWSA-N 358.393 5.134 5 1 FKBF O=[N+]([O-])c1ccc([C@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71317429 GQZDURBFXSVNIJ-OAQYLSRUSA-N 367.408 5.340 5 1 FKBF CC(C)(C)c1[nH]c2cc(F)ccc2c1Oc1ccc([N+](=O)[O-])cc1Cl 587632461 CPVFPCBIMCTIOJ-UHFFFAOYSA-N 362.788 5.958 5 1 FKBF COc1cccc([C@@H](C)Cc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587931925 PHLGBYNVPHNALK-INIZCTEOSA-N 366.464 6.224 5 1 FKBF O=C(c1ccc(SC(F)(F)F)cc1)c1coc2cc([N+](=O)[O-])ccc12 587280182 MVXAPESMEMCQHD-UHFFFAOYSA-N 367.304 5.184 5 1 FKBF Cc1ccc2c([C@@H](C[N+](=O)[O-])c3cccs3)c(C3CCCC3)[nH]c2c1 1857588963 NMGLDBDXFHOHON-INIZCTEOSA-N 354.475 5.604 5 1 FKBF CCC(=O)c1c(-c2ccc(Br)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587643783 JJHYONLQDXEQCV-UHFFFAOYSA-N 373.206 5.098 5 1 FKBF c1ccc(NCCNCc2ccc3ccc4cccc5ccc2c3c45)cc1 26481280 FXAYKAZQZSPWPK-UHFFFAOYSA-N 350.465 5.786 5 1 FKBF Oc1ccc2scc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)c2c1 587031611 JDSJTTVUYYDSFG-UHFFFAOYSA-N 368.421 5.247 5 1 FKBF Cn1c(-c2c(-c3ccccc3)[nH]c3cccc([N+](=O)[O-])c23)nc2ccccc21 587647939 USFDOQCDBJSYMP-UHFFFAOYSA-N 368.396 5.297 5 1 FKBF O=c1[nH]ccc2c3[nH]c(-c4ccc(Cl)cc4)nc3c3ccc(F)cc3c12 29135956 BFENOKRJCQHOIW-UHFFFAOYSA-N 363.779 5.017 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c3ccccc3c(C)c3ccccc13)O2 587404618 GEVKYFDQZLIIQM-QHCPKHFHSA-N 367.448 5.899 5 1 FKBF Oc1ccc(CCNc2nc3ccccc3c3[nH]c4ccccc4c23)cc1 45374640 VREWPBBKZDUFKM-UHFFFAOYSA-N 353.425 5.230 5 1 FKBF O=C(O)c1ccc2c(c1)nc(Sc1cccc(Cl)c1)c1ccncc12 73240665 GOLCMMMGBUKKTR-UHFFFAOYSA-N 366.829 5.286 5 1 FKBF O=C(/C=C/c1nc2c3ccccc3c3ccccc3c2[nH]1)Nc1ccccc1 587243137 BHTAULDLUJQWBP-CCEZHUSRSA-N 363.420 5.521 5 1 FKBF Cc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cccc1[N+](=O)[O-] 587260668 AAPFRUFDXWVDON-UHFFFAOYSA-N 353.381 5.753 5 1 FKBF O=C(c1cccc(C(F)(F)F)c1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280026 HDSXOKWSLJNVQK-UHFFFAOYSA-N 369.682 5.244 5 1 FKBF CC(C)=CCC[C@@H](C)c1c2nc3ccccc3sc-2c(C)c(=O)c1O 5930294 HYGPINLHBUGQMF-CYBMUJFWSA-N 353.487 5.625 5 1 FKBF Cc1cc(C)cc(Nc2c(N)cccc2-c2nc3ccc([N+](=O)[O-])cc3[nH]2)c1 587240739 JLVDKTDLSBJZQQ-UHFFFAOYSA-N 373.416 5.081 5 1 FKBF CCCCN(CCCC)CC[C@H](O)c1cc2ccccc2c2ccccc12 1640925 VYBIDWRZDLBYHD-VWLOTQADSA-N 363.545 6.319 5 1 FKBF CCCN1CCC(COc2nc3ccc(Cl)cc3c3ccccc23)CC1 95576886 LALHOIKJKWWBSQ-UHFFFAOYSA-N 368.908 5.542 5 1 FKBF Cc1cc(Cl)ccc1O[C@H](C)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587066111 IWMOBLFBVSOUAW-SECBINFHSA-N 366.204 5.226 5 1 FKBF O=C(O)C[C@H](CC(=O)c1ccc2c(ccc3ccccc32)c1)c1ccccc1 95572897 DHMDGIGCHWMDAE-NRFANRHFSA-N 368.432 5.824 5 1 FKBF CSc1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2c1 587264122 BTSSWDILTOLFQL-UHFFFAOYSA-N 351.387 5.120 5 1 FKBF CCc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2C(=O)C(F)(F)F)cc1 587645309 PEFMVYCNSJSABA-UHFFFAOYSA-N 362.307 5.051 5 1 FKBF CC(C)(C)c1ccc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c2c1 587270434 OXPKGWVWRVZKJX-UHFFFAOYSA-N 372.428 5.498 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169338474 CYSYOXUUGZRCBN-KKSFZXQISA-N 374.311 5.865 5 1 FKBF CCOc1ccccc1-c1cccc(-c2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)c1 587779866 HHWBSSCBPPWVJS-UHFFFAOYSA-N 373.412 5.512 5 1 FKBF CCN(CC)CCn1cc2c([N+](=O)[O-])ccc3sc4ccccc4c1c32 71341876 OZJIAUAVZUJIDL-UHFFFAOYSA-N 367.474 5.259 5 1 FKBF O=c1cc(-c2cc(F)cc(C(F)(F)F)c2)oc2ccc3ccccc3c12 1857767960 UNQORMKIZPBQLL-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF Cc1ccccc1[C@@H](C[N+](=O)[O-])c1c(-c2ccccc2)[nH]c2ccccc12 2382249410 YETFDRBZGXBULL-HXUWFJFHSA-N 356.425 5.552 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3ccc(C(F)(F)F)cc3[nH]2)ccc1Cl 587048057 PMKDVLUAIVVQGZ-KXFIGUGUSA-N 367.714 5.314 5 1 FKBF O=C(/C=C\c1nc2c3ccccc3c3ccccc3c2[nH]1)Nc1ccccc1 587243138 BHTAULDLUJQWBP-PFONDFGASA-N 363.420 5.521 5 1 FKBF Cc1[nH]c2cc([N+](=O)[O-])ccc2c1[C@@H]1CCCCCN1C(=O)OC(C)(C)C 587648347 DMJCKAFURBYNLF-KRWDZBQOSA-N 373.453 5.237 5 1 FKBF CC(C)=CCC/C(C)=C/CCC1=C[C@H](c2ccccc2[N+](=O)[O-])OC1=O 1857760450 SELHHTJXIAXVRF-NXZBIGBUSA-N 355.434 5.592 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2cccc(C(F)(F)F)c2c2ccccc12 169339015 CVESWPZWGKZHKO-FOIQADDNSA-N 373.418 5.577 5 1 FKBF Cc1ccc(CCc2nc3c4ccccc4c4ccccc4c3[nH]2)cc1N 587250753 OZMAAXNTGGOERZ-UHFFFAOYSA-N 351.453 5.545 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc3cc4ccccc4cc3c1)O2 587406116 PDMYYOHZCOSQRE-RUZDIDTESA-N 367.448 5.764 5 1 FKBF O=c1c2ccc(Nc3ccc(Cl)cc3)cc2[nH]c2cc(F)cc(F)c12 1911579718 LWZFHCDFDPKKNA-UHFFFAOYSA-N 356.759 5.357 5 1 FKBF COc1ccc([C@@H]2c3cccc([N+](=O)[O-])c3N[C@H](c3ccccc3)[C@H]2C)cc1 96913186 DFLRECUYWXEQEA-ARBPTSGCSA-N 374.440 5.538 5 1 FKBF O[C@H](c1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccccc1Cl 587059511 RJSHXQAWOJDZEN-NRFANRHFSA-N 358.828 5.604 5 1 FKBF O=[N+]([O-])c1ccc(Nc2nccc(-c3ccc(Cl)cc3Cl)n2)cc1 103300937 SHRSCPGVKMSERI-UHFFFAOYSA-N 361.188 5.102 5 1 FKBF CC(C)(C)c1cc(Cc2ccc([N+](C)(C)C)cc2)c(O)c(C(C)(C)C)c1 1618965 DLLSTYZWGWLOSR-UHFFFAOYSA-O 354.558 5.775 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1F 587152344 LZTSKJRZNBMKES-QWHCGFSZSA-N 372.378 5.209 5 1 FKBF c1ccc(COc2cccc3[nH]c4c5c6ccccc6nc-5c[nH]c4c23)cc1 100660644 MRELIRRRQGVAQX-UHFFFAOYSA-N 363.420 5.881 5 1 FKBF Cc1cc(C)c2[nH]c(-c3cc([N+](=O)[O-])ccc3SCC(C)C)nc2c1 586969436 ROIAIAHBISEETN-UHFFFAOYSA-N 355.463 5.503 5 1 FKBF O=[N+]([O-])c1cccc([C@@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)c1 71319259 MUOLZTFDKQBWFE-NRFANRHFSA-N 367.408 5.340 5 1 FKBF Oc1nc2ccccc2c2cc(-c3ccco3)cc(Nc3ccc(F)cc3)c12 2382247130 BKJJBIMJHOWHDY-UHFFFAOYSA-N 370.383 6.236 5 1 FKBF Cc1c2cc[n+](C)cc2c(C)c2c1[nH]c1ccc(Oc3ccccc3)cc12 1632159 SVFAVBKJSSNSBI-UHFFFAOYSA-O 353.445 5.708 5 1 FKBF CN(C)[C@H]1CCc2c(cccc2-c2c3ccccc3cc3ccccc23)C1 1911579451 DBUFMYHPGGUVEP-NRFANRHFSA-N 351.493 6.079 5 1 FKBF CC(C)=CCc1cccc2c(=O)c3c(O)cc4c(c3oc12)C=CC(C)(C)O4 35032241 BCILHNDVVWKDBW-UHFFFAOYSA-N 362.425 5.345 5 1 FKBF biogenic Fc1cccc([C@H]2C[C@@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587160738 GAFQDEHGQLELLR-RTWAWAEBSA-N 352.412 6.280 5 1 FKBF Cc1cc(C)cc(OCc2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587563737 AEFUYPDNZJPPHE-UHFFFAOYSA-N 352.437 6.065 5 1 FKBF O=[N+]([O-])c1cccc(Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)c1 68584008 BZFJSSFXLMMODT-UHFFFAOYSA-N 373.437 6.129 5 1 FKBF biogenic CC(C)(C)Nc1c(-c2c3ccccc3cc3ccccc23)nc2ccccn12 95558803 CXPWBKLAVYVWGI-UHFFFAOYSA-N 365.480 6.518 5 1 FKBF O[C@H](C[C@H]1CCCCN1)c1cc2cc(C(F)(F)F)ccc2c2ccccc12 169337925 YXHWJZHHIPINPC-IIBYNOLFSA-N 373.418 5.577 5 1 FKBF CC[N+](CC)(CC)CCCCOc1ccc(/C=C/c2ccccc2)cc1 1857538423 IUEKLDYMAHZDFO-CCEZHUSRSA-N 352.542 5.893 5 1 FKBF C[N@@+]12C=CC=C1[C@@H](N1CCCC1)c1sc(-c3ccc(Cl)cc3)cc12 254194040 WPEKCJPMSAXMJK-AUSIDOKSSA-N 355.914 5.567 5 1 FKBF Fc1cccc([C@@H]2C[C@@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587160528 CXMQVYVNXRKJHF-IRXDYDNUSA-N 354.388 5.070 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C/c3ccccc3Oc3ccccc3)[nH]c2c1 587951021 VCLOZFBBACDFCX-JLHYYAGUSA-N 357.369 5.434 5 1 FKBF O=[N+]([O-])c1ccc2oc3nccc(NCc4cccc(Cl)c4)c3c2c1 1857753294 OICVFHJYMOMCRW-UHFFFAOYSA-N 353.765 5.155 5 1 FKBF Cc1cccc([C@H](C[N+](=O)[O-])c2c(-c3ccccc3)[nH]c3ccccc23)c1 2382231645 RLECFWKZCDJCDQ-FQEVSTJZSA-N 356.425 5.552 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3c4ccccc4c4ccccc4c3[nH]2)c1 587160736 GAFQDEHGQLELLR-LEWJYISDSA-N 352.412 6.280 5 1 FKBF CCOc1ccccc1-c1cccc(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)c1 587780066 LDNKJGLPYSOYHN-UHFFFAOYSA-N 359.385 5.204 5 1 FKBF CCC[C@@H](C)[C@H]1CCc2c1ccc1c2ccc2c3cccc(C)c3ccc12 2356605340 BUQMYMPMZDOPMU-IEBWSBKVSA-N 352.521 7.921 5 1 FKBF COc1cc(-c2ccccc2C(F)(F)F)cc2c3ccccc3c[n+](C)c12 1857537119 RGVJPUAQVAHGHX-UHFFFAOYSA-N 368.378 5.512 5 1 FKBF O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1coc2ccc(Cl)cc12 587278508 PEAFWMCKRALYAH-UHFFFAOYSA-N 367.744 5.485 5 1 FKBF O=C(c1sc2cc([N+](=O)[O-])ccc2c1Cl)c1coc2ccccc12 587280873 FIFWDJQCXNJEET-UHFFFAOYSA-N 357.774 5.440 5 1 FKBF COc1ccccc1[C@H](C[N+](=O)[O-])c1c(-c2ccccc2)[nH]c2ccccc12 2382257734 RHDQEIKBUOYTCY-IBGZPJMESA-N 372.424 5.252 5 1 FKBF Cc1ccc2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc2c1C 587271401 BPGKBYRSSJTHIP-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF CC(=O)S[C@H]1CCC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)C1 1857540811 ZSWCOOZXTUENRV-HOTGVXAUSA-N 352.455 5.252 5 1 FKBF Brc1ccc2cc3c4ccccc4nc(-c4ccco4)c3n2c1 1857746525 HQDGMBNIYQKIFQ-UHFFFAOYSA-N 363.214 5.663 5 1 FKBF COc1ccccc1NCc1cccc2c(=O)c3ccc(Cl)cc3oc12 5581443 CEYMTGCCJDAXAE-UHFFFAOYSA-N 365.816 5.220 5 1 FKBF C[N+]1(C)CCC[C@H]1c1ccc([C@@](O)(c2ccccc2)C2CCCCC2)o1 45256747 AVNRDCQRRUOTCC-NZQKXSOJSA-N 354.514 5.007 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c3ccccc3cc3ccccc13)O2 587405485 LLEDXGLHYFURJI-QFIPXVFZSA-N 353.421 5.590 5 1 FKBF O=c1cc(-c2cc(F)ccc2C(F)(F)F)oc2ccc3ccccc3c12 1857653081 NFCNUEKSFMCIGO-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF Fc1ccc(/C=C/c2nc3cc4nc5ccccc5nc4cc3[nH]2)c(F)c1 587152042 YEQAVQJEOBUSBV-SOFGYWHQSA-N 358.351 5.108 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1F)c1c(-c2ccccc2)[nH]c2ccccc12 1857560766 WKZAFOINPWVCDN-SFHVURJKSA-N 360.388 5.383 5 1 FKBF COc1cc2c3cc(Cl)ccc3[n+](C)c3c4ccccc4n(C)c(c1)c23 29135085 SNIXRPHTLUHDLA-UHFFFAOYSA-N 361.852 5.124 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@H]1c1nc2c3ccccc3c3ccccc3c2[nH]1 586887990 JYPBVGHUJZKAFY-BKMJKUGQSA-N 360.460 6.241 5 1 FKBF COc1cc2c3ccccc3[n+](C)c3c4ccc(Cl)cc4n(C)c(c1)c23 29135087 DNDZHNGOVKCXHX-UHFFFAOYSA-N 361.852 5.124 5 1 FKBF O=c1cc(Nc2ccc(Br)cc2)c2ccc3ccccc3c2o1 53244110 GYDNTJLKGIPEFV-UHFFFAOYSA-N 366.214 5.452 5 1 FKBF O=[N+]([O-])c1ccc(Nc2c3ccccc3nc3c2[nH]c2ccccc23)cc1 141777907 YONCUZCTZLKYOG-UHFFFAOYSA-N 354.369 5.521 5 1 FKBF CCN(CC)CCCNc1ncc(C)c2c1c1c3ccccc3ccc1n2C 29320015 FOUDPZLFOSYNBT-UHFFFAOYSA-N 374.532 5.332 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2ccc(Cl)cc2c2cc(Cl)ccc12 169339367 PKKNIAXJILSMLH-KKSFZXQISA-N 374.311 5.865 5 1 FKBF O=C(OCc1ccc([N+](=O)[O-])cc1)N1c2ccccc2Oc2ccccc21 95577927 AWKSQZJAWHAAQC-UHFFFAOYSA-N 362.341 5.175 5 1 FKBF CC1(C)COc2c(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cccc21 586910812 BKYKPJRQEFQCAJ-UHFFFAOYSA-N 364.448 6.206 5 1 FKBF Cc1ccc2[nH]c(-c3ccccc3)c([C@H](C[N+](=O)[O-])c3cccs3)c2c1 1857569611 BAYYZHGISOMSMK-QGZVFWFLSA-N 362.454 5.613 5 1 FKBF CCN(CC)CCCNc1ncc(C)c2c1c1ccc3ccccc3c1n2C 29334051 ISGFMQIZTMIGMA-UHFFFAOYSA-N 374.532 5.332 5 1 FKBF O=C(C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1ccccc1)c1ccccc1 72113469 MNEXHRFTJIQXRK-NRFANRHFSA-N 363.438 5.701 5 1 FKBF CC(C)(C)c1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 587048623 XUMBQFQDZHFIQO-UITAMQMPSA-N 355.825 5.592 5 1 FKBF Clc1ccccc1NCc1nc2c3ccccc3c3ccccc3c2[nH]1 587061876 KPHRYGMXXXYTJR-UHFFFAOYSA-N 357.844 6.135 5 1 FKBF O=C(c1cc2c(ccc3ccccc32)oc1=O)c1coc2ccc(Cl)cc12 587279047 UUZQQZSKSVKVGP-UHFFFAOYSA-N 374.779 5.577 5 1 FKBF O=c1c2ccccc2oc2cc(-c3ccccc3)c(-c3ccc(O)cc3)cc12 64451025 NFSOIZHTFUGWJJ-UHFFFAOYSA-N 364.400 5.986 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cccc(-c4ccccc4F)c3)[nH]c2cc1F 587152925 IHPIPLIOKFKBQW-UHFFFAOYSA-N 351.312 5.083 5 1 FKBF Clc1[nH]c2ccccc2c1-c1nc2c3cccnc3c3ncccc3c2[nH]1 136574064 DCLAZBFBKSOKKR-UHFFFAOYSA-N 369.815 5.461 5 1 FKBF COc1ccc(NCCNc2cc(C)nc3c2ccc2ccccc23)cc1 2488826 YUMAWZYSJONGLE-UHFFFAOYSA-N 357.457 5.229 5 1 FKBF O=C1c2ccccc2-c2nc(-c3cccnc3)cc3c2c1nc1ccccc13 13222900 DKOYOHXCFYFCDU-UHFFFAOYSA-N 359.388 5.056 5 1 FKBF O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)cc(F)c3[nH]2)ccc1Cl 587047506 JIBAEUYCXLJQSI-RQOWECAXSA-N 352.152 5.087 5 1 FKBF c1ccc2c(c1)N[C@@H](c1cc3ccccc3c3ccccc13)[C@@H]1CCCO[C@@H]21 95571891 UOVBAOZXTRRJFJ-DFCKQENNSA-N 365.476 6.628 5 1 FKBF c1ccc2c(c1)c1ccccc1c1[nH]c(-c3csc4c3CCOC4)nc21 587032558 YIYFDDALFWKSMV-UHFFFAOYSA-N 356.450 5.671 5 1 FKBF Cc1ccc2c3c(cc(-c4cccc([N+](=O)[O-])c4)nc13)-c1ccccc1C2=O 587098296 PUOCTRSWACNEOP-UHFFFAOYSA-N 366.376 5.330 5 1 FKBF O=c1oc2ccc3ccccc3c2c(O)c1Cc1cccc2ccccc12 62242507 XRXVHLCYAMOMGC-UHFFFAOYSA-N 352.389 5.396 5 1 FKBF COc1cc2c3c(c1)O[C@@H](c1cccc4ccc5ccccc5c14)[C@@H](C2)C3=O 587447342 QJTBEXWCDPSPRS-CPJSRVTESA-N 366.416 5.490 5 1 FKBF O=c1cc(-c2c(F)cccc2C(F)(F)F)oc2ccc3ccccc3c12 1857648572 HNYYGSOMYZVCAW-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF Cc1c2cnccc2c(C)c2c1c1ccccc1n2CCN1CCCCC1 28760995 GOWONIROOXILCJ-UHFFFAOYSA-N 357.501 5.445 5 1 FKBF COc1ccc(CCNc2nc3ccccc3c3ccccc23)cc1OC 169350069 RIRMLGMRPCXAKH-UHFFFAOYSA-N 358.441 5.060 5 1 FKBF Cc1c(-c2ccc(Cl)c(Br)c2)[nH]c2cccc([N+](=O)[O-])c12 587644190 PIUAIPPIERUYLM-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF Fc1cccc([C@H]2C[C@@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1F 587149719 AHHFBEQTFYGDBP-CABCVRRESA-N 372.378 5.209 5 1 FKBF c1ccc2c(c1)CC[C@@]21C[C@@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 586891146 SVBBODWWPHRPFU-VOIUYBSRSA-N 362.436 5.031 5 1 FKBF COc1ccc([C@@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71316999 JMDNXKAWMPEATG-QFIPXVFZSA-N 352.437 5.440 5 1 FKBF c1ccc(COc2ccc3c(c2)[nH]c2c4c5ccccc5nc-4c[nH]c23)cc1 100660662 LEGPDWOWUFGLMP-UHFFFAOYSA-N 363.420 5.881 5 1 FKBF COc1cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc(Cl)c1O 587045682 BYXIBEPTJWZUNF-UHFFFAOYSA-N 374.827 5.904 5 1 FKBF Cc1cc2[nH]c(-c3cnc4ccc(C(F)(F)F)cc4c3)nc2cc1[N+](=O)[O-] 587112659 PJWBUYHWZBSSNC-UHFFFAOYSA-N 372.306 5.014 5 1 FKBF CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccc([N+](=O)[O-])cc21 28571389 YBLHYQJAYABBGT-SJCJKPOMSA-N 351.233 5.088 5 1 FKBF COc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-c2ccc(F)cc2)cc1 587646202 WTCZGUMMRWAMBF-UHFFFAOYSA-N 362.360 5.558 5 1 FKBF Cc1ccc2c([C@@H](C[N+](=O)[O-])c3nccs3)c(-c3ccccc3)[nH]c2c1 2382244091 QBUCGGZWSKCNDL-MRXNPFEDSA-N 363.442 5.008 5 1 FKBF CCNc1ccc2nc3c4ccccc4/c(=N/c4ccncc4)cc-3oc2c1 169331628 RGYTVKKFBBKDEN-LHLOQNFPSA-N 366.424 5.145 5 1 FKBF CCCCN(CCCC)C[C@H](O)c1cc2ccc(F)cc2c2ccccc12 169332940 PDOVKIIJVOJOPF-DEOSSOPVSA-N 367.508 6.068 5 1 FKBF C[N@+]12CCCC[C@@H]1[C@H](CN1c3ccccc3Sc3ccccc31)CCC2 254103654 WHBJMLSMNQEBKY-NXQMDHLFSA-N 365.566 5.698 5 1 FKBF COc1ccc2[nH]c3cc(Cl)ccc3c(=Nc3ccc(C)cc3C)c2n1 1772598670 UOCVMRYTYPYLTQ-UHFFFAOYSA-N 363.848 5.227 5 1 FKBF O=[N+]([O-])c1ccc(SCc2ccccc2Br)c(Cl)c1 299832580 JVVCCVUVGMAACN-UHFFFAOYSA-N 358.644 5.303 5 1 FKBF CC(C)=CCOc1cccc2c(=O)c3c(OCC=C(C)C)cccc3oc12 140125456 HTOQJHACSVETFN-UHFFFAOYSA-N 364.441 5.636 5 1 FKBF CCC(C)(C)c1ccc(OCc2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)cc1 587565537 LEFYFMGSICABRY-UHFFFAOYSA-N 353.422 5.046 5 1 FKBF O=[N+]([O-])c1ccc2[nH]c(-c3ccc(-c4cc(Cl)ccc4Cl)o3)nc2c1 587051621 QECKOPHSCDTCPH-UHFFFAOYSA-N 374.183 5.705 5 1 FKBF CNc1cc(Cl)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587067066 ZXKGNAIKECNGOL-UHFFFAOYSA-N 357.844 6.231 5 1 FKBF O=[N+]([O-])c1cc(Nc2nc(-c3ccccc3)nc3ccccc23)ccc1F 95574354 NWQABMRHECPKCG-UHFFFAOYSA-N 360.348 5.088 5 1 FKBF CC[C@H](Oc1ccccc1Cl)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587061455 GYDAQNICBATWRT-AWEZNQCLSA-N 366.204 5.308 5 1 FKBF CC(C)(C)c1[nH]c2cccc(F)c2c1Oc1ccc([N+](=O)[O-])cc1Cl 587633303 YYQXKGUHGBOTOK-UHFFFAOYSA-N 362.788 5.958 5 1 FKBF c1cc2c(c(-c3c4ccccc4nc4ccccc34)c1)CC1(CC2)OCCO1 5582644 XBVXJUKNZXNVRB-UHFFFAOYSA-N 367.448 5.287 5 1 FKBF Cc1ccc(C(=O)C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C2CCCCC2)cc1 49807448 AWYOCGCIYQEWJB-OAQYLSRUSA-N 366.461 5.537 5 1 FKBF CC[C@@H](C)c1ccc2[nH]c(-c3ccccc3)c(-n3cc([N+](=O)[O-])cn3)c2c1 587640931 CQVKPODIHMPBNQ-CQSZACIVSA-N 360.417 5.442 5 1 FKBF Cc1cccc2ccc3c4c(ccc3c12)[C@](C)([C@H](C)CCCC(C)C)CC4 111475564 UKMKQDKERXPFHR-HRFSGMKKSA-N 358.569 7.968 5 1 FKBF biogenic CC(C)=CCC/C(C)=C\CC[C@@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1 209160832 LIQXVRBBAVQORU-XJRANTTPSA-N 368.905 5.297 5 1 FKBF C[C@@H](N)c1ccc(-c2c(O)cc(Cl)c3nc(O)c4ccccc4c23)cc1 1857542002 DZVIZOWGFWXHGP-LLVKDONJSA-N 364.832 5.139 5 1 FKBF COc1cc2c3c(c1)O[C@H](c1c4ccccc4cc4ccccc14)[C@@H](C2)C3=O 587447061 KSQDDHCNTYJBCE-CPJSRVTESA-N 366.416 5.490 5 1 FKBF CCOC(=O)c1c(-c2ccc([N+](=O)[O-])cc2)[nH]c2ccc([C@@H](C)CC)cc12 587642458 MAAVZGRBBQTLDD-ZDUSSCGKSA-N 366.417 5.433 5 1 FKBF CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587951282 GRUXYORBFKLKHO-GTQRCTGISA-N 374.488 5.706 5 1 FKBF CCO/C(O)=C1\C(C)=Nc2ccccc2S[C@H]1c1cccc([N+](=O)[O-])c1 100961856 QKOUSCYOFWEEGH-GHNGSUTGSA-N 370.430 5.340 5 1 FKBF O=C1O/C(=C\c2nc3c4ccccc4c4ccccc4c3[nH]2)c2ccccc21 586907239 VFZTXTLIEXUNPI-MOSHPQCFSA-N 362.388 5.538 5 1 FKBF Cc1ccccc1C(=O)c1ccc(Nc2ccccc2[N+](=O)[O-])cc1Cl 13531279 WOUBHHLWOZLESX-UHFFFAOYSA-N 366.804 5.531 5 1 FKBF Nc1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)ccc2ccccc12 587253940 UADNRANCZMCEBR-UHFFFAOYSA-N 361.408 5.062 5 1 FKBF O=c1cc(-c2cccc(OC(F)(F)F)c2)oc2c1ccc1ccccc12 1772582410 KGKDFZTYVUPCMT-UHFFFAOYSA-N 356.299 5.512 5 1 FKBF C[C@]1(c2ccc([N+](=O)[O-])cc2Cl)CC(=O)c2ccc3c(c2O1)CCCC3 587510339 YPKJKIVBGXRZTB-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3ccccc3F)c(Cc3ccccc3F)[nH]c2c1 587646071 SMRLEHQQCXONSO-UHFFFAOYSA-N 364.351 5.612 5 1 FKBF N[C@H](Cc1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccccc1Cl 587059577 SKSKNBRHBDJKJH-HXUWFJFHSA-N 371.871 5.765 5 1 FKBF Cc1c(-c2nc3ccc(OCc4ccccc4)cc3[nH]2)cccc1[N+](=O)[O-] 587261029 QAFXVCLJMKRNQU-UHFFFAOYSA-N 359.385 5.026 5 1 FKBF O=c1oc2ccccc2c2nc3c(ccc4cc[nH]c43)c(-c3ccccn3)c12 1911579805 PZGWMTPCHCHAJS-UHFFFAOYSA-N 363.376 5.038 5 1 FKBF CCOc1cc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)ccc1C 587778312 LGUGMKZUTUXYLU-UHFFFAOYSA-N 354.413 5.033 5 1 FKBF N[C@@]1(c2nc3c4ccccc4c4ccccc4c3[nH]2)C[C@@H]1c1ccccc1F 587154366 DRZRKISNQXAFSH-DVECYGJZSA-N 367.427 5.350 5 1 FKBF CC[C@H](CC[C@H](C)[C@@]1(C)CCc2c1ccc1c2ccc2ccccc21)C(C)C 2356622369 DOOKGIUHXBYNAK-BALWLHIASA-N 372.596 8.295 5 1 FKBF CCc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)CN1CCC[C@H]1C3 72123075 DNMKNJMEPLEWEL-INIZCTEOSA-N 361.485 5.093 5 1 FKBF CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC[N+](C)(C)C 85589833 FDCFEKFQGUEBOI-UTJQPWESSA-N 366.610 6.049 5 1 FKBF endogenous,in-man C[C@H]1CCc2sc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2C1 587033119 DFKGBFBAYXNSME-AWEZNQCLSA-N 368.505 6.723 5 1 FKBF FC(F)(F)c1cccnc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587108349 JDJQTQSPCBVFQH-UHFFFAOYSA-N 363.342 5.950 5 1 FKBF Cc1ccc(C)c2[nH]c(-c3cc([N+](=O)[O-])ccc3SCC(C)C)nc12 586968282 BOBBDIAEVXRTIK-UHFFFAOYSA-N 355.463 5.503 5 1 FKBF Cc1cc2[nH]c(Cc3ccccc3Oc3ccccc3)nc2cc1[N+](=O)[O-] 587949639 JNEDWPDBEWRVSU-UHFFFAOYSA-N 359.385 5.163 5 1 FKBF CCCCN(CCCC)c1nc(O)c2c(ccc3c4ccccc4oc32)n1 653699871 CDUOIYOCNHXWRV-UHFFFAOYSA-N 363.461 5.641 5 1 FKBF O=c1cc(Cc2c3ccccc3nc3ccccc23)c2cc(Cl)ccc2o1 64527821 NVLQRQDZVLQPQU-UHFFFAOYSA-N 371.823 5.739 5 1 FKBF CCCCn1c(=O)c2ccc3sc4ccccc4c4ccc(c1=O)c2c34 95589397 DPBUCSNNJACUPE-UHFFFAOYSA-N 359.450 5.121 5 1 FKBF O=[N+]([O-])c1cc(Cl)cc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)c1F 587139965 ULYURZWZLIVFSM-UHFFFAOYSA-N 360.559 5.237 5 1 FKBF CC(C)(C)[C@@H]1CC[C@@H](c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)C1 587969316 LTEPVLCGITXHAD-NXEZZACHSA-N 366.259 5.163 5 1 FKBF CCCn1c2cccc3oc4cccc5c4c(c32)c2c1cccc2[n+]5CCC 1857543377 DENZCYZAOYAODH-UHFFFAOYSA-N 367.472 6.392 5 1 FKBF Cc1cc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c2cc1F 587274313 ZEOJDEDYAKLQJC-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF Cc1cc(Cl)ccc1OCCCC(=O)c1coc2cc([N+](=O)[O-])ccc12 587280098 IYJFPCNLFPJXBB-UHFFFAOYSA-N 373.792 5.345 5 1 FKBF C[C@]1(c2cc(Cl)ccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587498731 GHJOMMAKNSDYCC-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF O=C(c1c(-c2ccc(Cl)s2)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F 587645351 RKXUQPFNSFDQDR-UHFFFAOYSA-N 374.727 5.203 5 1 FKBF COc1cc2cc(CN3CCCC[C@@H]3C)c3ccc(O)cc3c2cc1OC 28565708 LGGSFSLBLIQBAZ-HNNXBMFYSA-N 365.473 5.090 5 1 FKBF C[N@@+]12CCCC[C@@H]1[C@H](CC1c3ccccc3Sc3ccccc31)CCC2 254100352 BLIMBNCYWMKEGF-FKRCVWNDSA-N 364.578 6.082 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3[nH]c4ccc(F)cc4c3Cl)[nH]c2cc1Cl 587175315 YBOBNLVHSVHNKZ-UHFFFAOYSA-N 365.151 5.065 5 1 FKBF CCCCCC(=O)OCn1ccc2c(C)c3nc4ccccc4c3c(C)c2c1 377840978 JZIYVSNJFQPXPR-UHFFFAOYSA-N 374.484 6.041 5 1 FKBF c1ccc2c(c1)CC[C@]21C[C@@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 586891140 SVBBODWWPHRPFU-GYCJOSAFSA-N 362.436 5.031 5 1 FKBF Fc1ccc(/C=C\c2nc3c4cccnc4c4ncccc4c3[nH]2)c(F)c1 587149054 CNBSFPQFPAERBQ-VURMDHGXSA-N 358.351 5.108 5 1 FKBF CC(C)(C)OC(=O)N1CCC[C@@H]1c1c(C2CC2)[nH]c2cc([N+](=O)[O-])ccc12 587648557 IIXLFFBBQBPNDS-MRXNPFEDSA-N 371.437 5.026 5 1 FKBF CC(C)=CCC[C@@H](C)/C=C/C=C(\C)C(=O)NC[C@@H]1CC[N+]2(C)CCCC[C@H]12 33985276 OIRGOJBSVAJDRX-DFJWXUFXSA-O 373.605 5.007 5 1 FKBF O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4cc(F)cc(F)c4[nH]3)c2)cc1 587271462 CZZXEFVZCFHWSF-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF Cc1nc2c3ccccc3ccc2c2nc3c(ccc4ccccc43)c(C)c12 103299548 LSNJQTOJPQWQPP-UHFFFAOYSA-N 358.444 6.859 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3ccccc3-c3ccc(O)cc3)[nH]c2cc1Cl 586898317 GGVIUPNVYHSGFH-UHFFFAOYSA-N 365.776 5.164 5 1 FKBF Cc1ccc2c(O)nc3c(C)cc(O)c(-c4ccc([C@@H](C)CN)cc4)c3c2c1 1857553796 RABYQTQIXKIMHR-HNNXBMFYSA-N 372.468 5.145 5 1 FKBF Cc1cc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2cc1F 586968819 JOYNPVGLVMTQFL-UHFFFAOYSA-N 359.426 5.334 5 1 FKBF N[C@H](c1nc2c3ccccc3c3ccccc3c2[nH]1)c1ccc(F)cc1F 587151887 WKEJYGKYWYYMSL-IBGZPJMESA-N 359.379 5.196 5 1 FKBF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@@H]([N+](=O)[O-])CCC3)c1 587362666 JBEDFBFWAWSUCV-KRWDZBQOSA-N 374.396 5.311 5 1 FKBF CCCCN(CCCC)C[C@H](O)c1cc2ccccc2c2cc(F)ccc12 169339635 QVQZRVQEYOVBDW-DEOSSOPVSA-N 367.508 6.068 5 1 FKBF C[C@H]1CCc2sc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)cc2C1 587033180 GKASSYWWGPFXJP-LBPRGKRZSA-N 370.481 5.513 5 1 FKBF O=C(c1cc2cc([N+](=O)[O-])ccc2s1)c1coc2ccc(Cl)cc12 587278662 IUPHIQUSMCYZLT-UHFFFAOYSA-N 357.774 5.440 5 1 FKBF COc1ccc(Nc2nc3ccccc3c3[nH]c4ccccc4c23)c(OC)c1 169309452 PSOIZTUENMMGJY-UHFFFAOYSA-N 369.424 5.630 5 1 FKBF O=[N+]([O-])c1cccc2nc(/C=C\c3ccc(SC(F)(F)F)cc3)[nH]c12 587125499 RENHFUHCQYEOBR-TWGQIWQCSA-N 365.336 5.253 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc3ccc4ccccc4c13)O2 587403927 APINRBXFYGXUSI-JOCHJYFZSA-N 353.421 5.590 5 1 FKBF O=c1c2cc3ccccc3cc2nc2c3ccccc3nc(-c3ccccc3)n12 1857631601 CJICZMGJYKAZJN-UHFFFAOYSA-N 373.415 5.216 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(Cc3ccccc3F)c(-c3ccccc3F)c12 587645600 FLJYYCGFXTXFHZ-UHFFFAOYSA-N 364.351 5.612 5 1 FKBF O=C(c1c(-c2ccc(Cl)s2)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F 587644950 GKDGPFLNJADCRF-UHFFFAOYSA-N 374.727 5.203 5 1 FKBF O=C(c1cc2ccccc2o1)c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 587645597 ZFRYBPPXPSBIDO-UHFFFAOYSA-N 374.274 5.072 5 1 FKBF CC(C)(C)[C@@H]1CC[C@@H](c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)C1 587968914 IMRBBDNTLGXJGO-NXEZZACHSA-N 366.259 5.163 5 1 FKBF O=C1CC[C@@H](N(Cc2ccc([N+](=O)[O-])cc2)C2CCCC2)c2ccccc21 40847591 DPYYBAUSNAALQN-OAQYLSRUSA-N 364.445 5.057 5 1 FKBF CCCCN(CCCC)C[C@H](O)c1ccc2ncc3ccccc3c2c1 25972791 RVRFJHDQNNPXMJ-QHCPKHFHSA-N 350.506 5.324 5 1 FKBF c1ccc2c(c1)N[C@@H](c1cc3ccccc3c3ccccc13)[C@H]1CCCO[C@H]21 95571890 UOVBAOZXTRRJFJ-DNRSQYFGSA-N 365.476 6.628 5 1 FKBF Fc1cccc([C@@H]2C[C@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587160521 CXMQVYVNXRKJHF-DLBZAZTESA-N 354.388 5.070 5 1 FKBF c1ccc2c(c1)CC[C@]21C[C@H]1c1nc2c3ccccc3c3ccccc3c2[nH]1 586887993 JYPBVGHUJZKAFY-NVQXNPDNSA-N 360.460 6.241 5 1 FKBF c1cnc2c(c1)c1nc(-c3ccc(OC4CCC4)cc3)[nH]c1c1cccnc12 587952018 WETPWEADOIYYBR-UHFFFAOYSA-N 366.424 5.258 5 1 FKBF c1cc2ccc3cccc4c(NCCCCCN5CCCCC5)cc(c1)c2c34 299841243 YTJVVTGUYARBJK-UHFFFAOYSA-N 370.540 6.652 5 1 FKBF CCOc1ccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)cc1 1772650436 AFGUNFMSXWZKAP-UHFFFAOYSA-O 368.460 5.441 5 1 FKBF Cc1ccc(-c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)o1 586905619 VYRNSLAQXVRCKE-UHFFFAOYSA-N 374.443 7.105 5 1 FKBF Cc1[nH]c2cccc([N+](=O)[O-])c2c1-c1ccc(Cl)cc1Br 587643186 BREOWOMUBJYXTM-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF Cc1cc(C)cc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)c1 1772596820 NFDHXERVXJWREI-UHFFFAOYSA-O 352.461 5.659 5 1 FKBF O=[N+]([O-])c1cccc(C(n2ccc3ccccc32)n2ccc3ccccc32)c1 1772587377 NTZJBGFAPGRRDX-UHFFFAOYSA-N 367.408 5.599 5 1 FKBF Cc1c2ccn(C)cc2c(C)c2c1nc1ccc(Oc3ccccc3)cc12 377428799 SVFAVBKJSSNSBI-UHFFFAOYSA-N 352.437 6.289 5 1 FKBF COc1cccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)c1 1772606718 AYXJLXKBYNMIGD-UHFFFAOYSA-O 354.433 5.051 5 1 FKBF O=[N+]([O-])C[C@H](c1cccc(F)c1)c1c(-c2ccccc2)[nH]c2ccccc12 1857578360 XBRWORUVWLBYAO-LJQANCHMSA-N 360.388 5.383 5 1 FKBF CC(C)c1cccc(C(C)C)c1NC(=O)Nc1ccc([N+](=O)[O-])cc1O 45391285 HOWRVBLEEPYBSQ-UHFFFAOYSA-N 357.410 5.191 5 1 FKBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3ccccc3c3ccccc13)O2 587407092 WZXRZYPGIKWDBW-QHCPKHFHSA-N 353.421 5.590 5 1 FKBF FC(F)(F)c1cccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587113613 QMMNWIJBJJDXEA-UHFFFAOYSA-N 364.330 5.345 5 1 FKBF CC(C)Cc1[nH]c2cccc([N+](=O)[O-])c2c1-c1ccc(Cl)cc1Cl 587644875 PIHFBZXVFSFXIO-UHFFFAOYSA-N 363.244 6.248 5 1 FKBF FC(F)(F)c1ccc2nc3cc4ccccc4cc3c(-c3ccccc3)c2c1 1772592278 FGVRCQBCKLGWIP-UHFFFAOYSA-N 373.377 7.227 5 1 FKBF CCC(C)(C)c1ccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1 586882012 QQAWZQNOSQWIML-UHFFFAOYSA-N 366.468 6.014 5 1 FKBF O=c1cc(Nc2cccc(Br)c2)c2ccc3ccccc3c2o1 53294801 DWAKHDXCPDRESW-UHFFFAOYSA-N 366.214 5.452 5 1 FKBF Cc1cc(Cl)cc2c(NC(=O)c3ccc([N+](=O)[O-])cc3)c(C(C)C)[nH]c12 587626634 GQEXKFFXARDXNH-UHFFFAOYSA-N 371.824 5.414 5 1 FKBF COc1cccc2c(=O)c3ccccc3n(CCCCOc3ccccc3)c12 43022861 BDAAWGVSAXUJHP-UHFFFAOYSA-N 373.452 5.023 5 1 FKBF Cc1ccc(-c2ccc(-c3nc4cc(Cl)c([N+](=O)[O-])cc4[nH]3)cc2)o1 586902544 FWPLSOYEMCXBDU-UHFFFAOYSA-N 353.765 5.360 5 1 FKBF CCCc1c(O)ccc2c1O[C@@H](c1ccc(C(C)C)c([N+](=O)[O-])c1)CC2=O 587468956 FNPSFUAVTISJOI-HXUWFJFHSA-N 369.417 5.083 5 1 FKBF Cc1cccc2c1cc1n2-c2ccccc2N[C@@H]1c1ccc([N+](=O)[O-])cc1 71331608 QHVHCYMPFQMFQG-JOCHJYFZSA-N 355.397 5.362 5 1 FKBF Cc1cccc(-c2ccc(Cl)cc2)c1-c1nc2cncc([N+](=O)[O-])c2[nH]1 587074563 XHNKHTXNNGGSRX-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF CCc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2C(=O)C(F)(F)F)s1 587645396 UDKRXDAOUKNBTJ-UHFFFAOYSA-N 368.336 5.112 5 1 FKBF O=[N+]([O-])c1cccc2c(Sc3cccc(C(F)(F)F)c3)cc(O)nc12 299869229 UHIAFQZYRXDKSD-UHFFFAOYSA-N 366.320 5.019 5 1 FKBF Cc1ccc(/C=C\c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1F 587146460 MSCGHNAVBQEIQZ-HJWRWDBZSA-N 354.388 5.277 5 1 FKBF Cc1oc2c(c1-c1nc3c4ccccc4c4ccccc4c3[nH]1)C(=O)CCC2 586902968 DHTMAULEOFJLFO-UHFFFAOYSA-N 366.420 5.957 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C\c3ccc(SC(F)(F)F)cc3)[nH]c2c1 587126595 ZUJQVZWBZVDVNX-BAQGIRSFSA-N 365.336 5.253 5 1 FKBF COc1cccc2nc3c(OCC=C(C)CCC=C(C)C)cccc3nc12 2356400506 AYBXOQNDOSRELU-UHFFFAOYSA-N 362.473 5.863 5 1 FKBF Fc1ccc2[nH]cc(Cc3nc4c5ccccc5c5ccccc5c4[nH]3)c2c1 587175135 QTJXOKWRTTZOOQ-UHFFFAOYSA-N 365.411 6.081 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C=C\c3ccccc3Oc3ccccc3)[nH]c2c1 587951023 VCLOZFBBACDFCX-RAXLEYEMSA-N 357.369 5.434 5 1 FKBF COc1ccc(-c2cc(-c3cccs3)nc3cnc4ccccc4c23)cc1 1772650388 FNMOEUTUIPQMAA-UHFFFAOYSA-N 368.461 6.187 5 1 FKBF CCc1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1CC 586878358 FSHWWBJTHAVELQ-UHFFFAOYSA-N 350.465 6.661 5 1 FKBF c1ccc2nc3cc4[nH]c(-c5ccc(C6CCC6)cc5)nc4cc3nc2c1 586880081 KUZQTKMVTONCLN-UHFFFAOYSA-N 350.425 5.594 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccccc3)c(-c3ccc(F)c(F)c3)c12 587646143 VDIWPZAHGDFEHE-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF CCCN1[C@H](C)Cc2ccccc2[C@]1(C)C(C)(C)c1ccc([N+](=O)[O-])cc1 963223754 DFPCAGCCCRFXPA-UZUQRXQVSA-N 366.505 5.444 5 1 FKBF CC(=O)S[C@@H]1CCC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)C1 1857540812 ZSWCOOZXTUENRV-HZPDHXFCSA-N 352.455 5.252 5 1 FKBF Cc1ccc2c(c1)c(O)nc1c(C)cc(O)c(-c3ccc([C@@H](C)N)cc3)c12 1857566609 VXHUYSIKIIGPDX-CQSZACIVSA-N 358.441 5.103 5 1 FKBF O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)cc1 299871249 YETVKLLBAIFCKH-UHFFFAOYSA-N 359.341 5.104 5 1 FKBF Cc1cccc(-c2ccccc2)c1-c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 586878123 BXEZDXWMVSEPQV-UHFFFAOYSA-N 363.804 5.767 5 1 FKBF Cc1c2ccncc2c(C)c2c1[nH]c1cc(Cc3ccccc3)c(O)cc12 45210193 SPYGFWIDPZNNNG-UHFFFAOYSA-N 352.437 5.783 5 1 FKBF Cc1sc2c(c1C)CCN[C@H]2c1ccccc1-c1cccc([N+](=O)[O-])c1 963014802 VILWAYCTIFKAHH-FQEVSTJZSA-N 364.470 5.175 5 1 FKBF CCO/C(O)=C1\C(C)=Nc2ccccc2S[C@@H]1c1cccc([N+](=O)[O-])c1 100961861 QKOUSCYOFWEEGH-SELCWUDQSA-N 370.430 5.340 5 1 FKBF Cc1cc2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc2cc1F 587272624 WUDDWIUGHSOVJY-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF NC[C@H](O)c1cc2ccc(C(F)(F)F)cc2c2cc(C(F)(F)F)ccc12 169338200 JDUSYZOMGSFOPG-INIZCTEOSA-N 373.296 5.023 5 1 FKBF CCN(CC)CCCCNc1c2nc3ccccc3c-2n(C)c2ccccc12 169729278 AFAZCIMKGSBARF-UHFFFAOYSA-N 374.532 5.365 5 1 FKBF Clc1cccc(C2(c3nc4c5ccccc5c5ccccc5c4[nH]3)CC2)n1 587084509 ODTQSWUSLFBDJS-UHFFFAOYSA-N 369.855 5.998 5 1 FKBF O=[N+]([O-])c1cc2nc([C@@H]3C[C@@H]3c3c(Cl)cccc3Cl)[nH]c2cc1F 587048959 KCSXAAZYVPEQIT-JGVFFNPUSA-N 366.179 5.188 5 1 FKBF CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 587953064 ZAAMADPLWHZJOH-MMPTUQATSA-N 351.834 5.171 5 1 FKBF CC(C)=CCCC(C)=CCC[C@](C)(Cl)[C@@H](O)Cc1c[nH]c([N+](=O)[O-])c1 2356846576 LIQXVRBBAVQORU-HKUYNNGSSA-N 368.905 5.297 5 1 FKBF Fc1ccc(/C=C\c2nc3c4ccccc4c4ccccc4c3[nH]2)c(F)c1 587151253 RGRNABOZUOMDBZ-BENRWUELSA-N 356.375 6.318 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C(=C/c3ccc(F)cc3)c3cccs3)[nH]c2c1 587163877 MMFZEKWUQFDAMV-XNTDXEJSSA-N 365.389 5.261 5 1 FKBF Cc1c(F)cccc1-c1cc(-c2nc3cccc(F)c3[nH]2)cc([N+](=O)[O-])c1 587136407 ZWGNGPUKGAZQPE-UHFFFAOYSA-N 365.339 5.392 5 1 FKBF O=C(c1c2ccccc2cc2ccccc12)c1coc2ccc(Cl)cc12 587279029 ULUBARHBMGMKPN-UHFFFAOYSA-N 356.808 6.624 5 1 FKBF NC[C@@H](O)c1cc2ccc(C(F)(F)F)cc2c2cc(C(F)(F)F)ccc12 169338197 JDUSYZOMGSFOPG-MRXNPFEDSA-N 373.296 5.023 5 1 FKBF O=[N+]([O-])c1cccc2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c12 587127875 CGKKIBNPURPSDU-UHFFFAOYSA-N 372.356 5.199 5 1 FKBF Cc1nc2ccccc2c(Cl)c1Cc1c(C)[nH]c2cccc([N+](=O)[O-])c12 587644970 GMYYLCPLZALJAO-UHFFFAOYSA-N 365.820 5.485 5 1 FKBF C[C@@H]1CCCCN1CCCCn1c2ccccc2c2nc3ccccc3nc21 1772624064 OTZKKTYBTBWVTJ-GOSISDBHSA-N 372.516 5.392 5 1 FKBF CC(C)=CCC[C@H](C)C=CC=C(C)C(=O)NC[C@@H]1CC[N@@+]2(C)CCCC[C@@H]12 2356697750 OIRGOJBSVAJDRX-PETUGJSASA-O 373.605 5.007 5 1 FKBF O=[N+]([O-])c1ccc([C@H]2C[C@@H](c3c4ccccc4cc4ccccc34)N=N2)cc1 169724701 MNHOJKHCVKBGIQ-YADHBBJMSA-N 367.408 6.540 5 1 FKBF O=[N+]([O-])c1ccc2c(C(F)(F)F)c(-c3c[nH]c4ccc(F)cc34)[nH]c2c1 587646662 ZTXVPAZGRJTRAG-UHFFFAOYSA-N 363.270 5.382 5 1 FKBF O=c1cc(-c2cccc(Br)c2)oc2c1ccc1ccccc12 1772647302 WVXXGHGWOGRKTE-UHFFFAOYSA-N 351.199 5.376 5 1 FKBF Cc1c2ccncc2c(C)c2c1[nH]c1ccc(O)c(OCC(F)(F)F)c12 13221002 FKSSRGLBYHPRMR-UHFFFAOYSA-N 360.335 5.133 5 1 FKBF COc1cc(Cl)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1 587066525 LTTGTXJNOMPMGG-UHFFFAOYSA-N 358.828 6.198 5 1 FKBF O=C(c1coc2cc([N+](=O)[O-])ccc12)C(c1ccccc1)c1ccccc1 587279971 XFAFVTOQCXRSFK-UHFFFAOYSA-N 357.365 5.356 5 1 FKBF CC(=O)S[C@@H]1CCC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)C1 1857540813 ZSWCOOZXTUENRV-JKSUJKDBSA-N 352.455 5.252 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccccc3)c(Cc3ccccc3Cl)c12 587644408 BHWSMTBRXOHHFF-UHFFFAOYSA-N 362.816 5.987 5 1 FKBF CCc1c(-c2cc(Br)ccc2F)[nH]c2cc([N+](=O)[O-])ccc12 587646001 IBAAAESFGYAYFI-UHFFFAOYSA-N 363.186 5.207 5 1 FKBF Cc1c(-c2nc3ccc(SC(F)(F)F)cc3[nH]2)cccc1[N+](=O)[O-] 587260748 CDFLPRNTRCSQSO-UHFFFAOYSA-N 353.325 5.058 5 1 FKBF O=C1c2ccccc2-c2nc(-c3ccncc3)cc3c2c1nc1ccccc13 13222903 LZKCPNRQYLJNBC-UHFFFAOYSA-N 359.388 5.056 5 1 FKBF O[C@@H](CNCc1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 26474217 SWVXNBFGMAKKRS-QHCPKHFHSA-N 351.449 5.407 5 1 FKBF C[C@]1(c2ccc(Cl)cc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587499382 IQGQPXRMKGOVLZ-HXUWFJFHSA-N 371.820 5.008 5 1 FKBF CC(C)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1[N+](=O)[O-] 587507916 DEOOQTLNUNMFFJ-OAQYLSRUSA-N 365.429 5.304 5 1 FKBF CCN(CC)C[C@H](O)c1cc2cc(Cl)ccc2c2cc(Cl)ccc12 169337828 DVYYPAPDKVOUAV-FQEVSTJZSA-N 362.300 5.675 5 1 FKBF Cc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)oc2c1[C@@H](O)CCC2 586904380 UFLGYMAKADMGKY-SFHVURJKSA-N 368.436 5.807 5 1 FKBF CCC[C@@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587514570 ZTLZQBDUIQXJAI-QFIPXVFZSA-N 365.429 5.134 5 1 FKBF Cc1ccc2ccccc2c1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 586884674 WXVMLHDVHBPFPG-UHFFFAOYSA-N 360.420 5.788 5 1 FKBF COc1c(F)ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c1N 587133273 NPDQWNMJSRTRFM-UHFFFAOYSA-N 357.388 5.266 5 1 FKBF Cc1c(F)ccc2[nH]c(-c3ccc(Oc4ccc([N+](=O)[O-])cc4)cc3)nc12 587271577 GUPVBEKPIMWSNA-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF O=C(c1c(Cl)cc(Cl)cc1Cl)c1coc2cc([N+](=O)[O-])ccc12 587280402 WEKXBMROFNIGKU-UHFFFAOYSA-N 370.575 5.532 5 1 FKBF CC(C)Cc1[nH]c2cc([N+](=O)[O-])ccc2c1-c1ccc(Cl)cc1Cl 587644572 FOEVGMIQLPQMMN-UHFFFAOYSA-N 363.244 6.248 5 1 FKBF C[C@@]1(c2ccc3cc4ccccc4cc3c2)NCCc2nc3ccccn3c21 962992683 YRVBVYYUEMCDIS-VWLOTQADSA-N 363.464 5.050 5 1 FKBF CC/C(=C\c1nc2cc3nc4ccccc4nc3cc2[nH]1)c1ccc(C)cc1 587968559 USLIVDLPJBDVKX-FOWTUZBSSA-N 364.452 5.918 5 1 FKBF O=C(O)c1cnc2cc(-c3ccc4ccccc4c3O)c3ccccc3c2n1 72110934 BXZMQMVGXMQVAM-UHFFFAOYSA-N 366.376 5.007 5 1 FKBF N[C@]1(c2nc3c4ccccc4c4ccccc4c3[nH]2)C[C@H]1c1ccccc1F 587154368 DRZRKISNQXAFSH-YADARESESA-N 367.427 5.350 5 1 FKBF Cc1[nH]c2cc(Cl)c(F)cc2c1-c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 587630184 UZOSETRMJGFTBK-UHFFFAOYSA-N 372.705 5.863 5 1 FKBF COc1ccc([C@H]2CC(c3c4ccccc4cc4ccccc34)=NN2)cc1 71317000 JMDNXKAWMPEATG-JOCHJYFZSA-N 352.437 5.440 5 1 FKBF Cc1cc2nc(-c3ccc(-c4ccccc4)c(Cl)n3)[nH]c2cc1[N+](=O)[O-] 587083699 GUVOMZHLWAUZEP-UHFFFAOYSA-N 364.792 5.162 5 1 FKBF O=[N+]([O-])c1cc(F)cc(-c2nc3ccc(Sc4ccccc4)cc3[nH]2)c1 587161193 LISBZDAHTKPVQA-UHFFFAOYSA-N 365.389 5.428 5 1 FKBF O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4cc(F)c(F)cc4[nH]3)c2)cc1 587273939 WUDZNNIHZNOZFR-UHFFFAOYSA-N 367.311 5.209 5 1 FKBF CCOc1cc(Cn2c3ccccc3c(=O)c3ccccc32)cc(OCC)c1 40943431 LVEWRZLGGTXJBD-UHFFFAOYSA-N 373.452 5.000 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3cc4c5c(cccc5n3)CC4)cc2)cc1 587211817 XEIIUUZASNKXKD-UHFFFAOYSA-N 368.392 5.701 5 1 FKBF Clc1[nH]c2ccccc2c1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 587087698 NTWZMBBQBZVDKI-UHFFFAOYSA-N 369.815 5.461 5 1 FKBF c1cc2cc(c1)Oc1cccc(c1)Oc1cccc(c1)Oc1cccc(c1)O2 64624928 QHOWMEYTMINRGN-UHFFFAOYSA-N 368.388 7.169 5 1 FKBF in-vitro CC[C@@H](C)c1ccc2[nH]c(-c3cccc([N+](=O)[O-])c3)c(-c3ccccc3)c2c1 587642856 PGFBJKZXYFWWMK-MRXNPFEDSA-N 370.452 6.924 5 1 FKBF CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2cccc(Cl)c2[nH]1 586968279 BKCRJCDVSZIQCO-UHFFFAOYSA-N 361.854 5.540 5 1 FKBF O=C1c2ccccc2-c2cc(-c3ccc(F)c([N+](=O)[O-])c3)nc3cccc1c23 587103580 KPIIBPVJQCCRFS-UHFFFAOYSA-N 370.339 5.161 5 1 FKBF COc1ccc(/C=C/c2cc(=O)oc3c2ccc2ccccc23)c(OC)c1 1857603404 DHBUEHYGNDITJW-BQYQJAHWSA-N 358.393 5.134 5 1 FKBF CCCCN(CCCC)C[C@@H](O)c1cc2ccccc2c2cc(F)ccc12 169339633 QVQZRVQEYOVBDW-XMMPIXPASA-N 367.508 6.068 5 1 FKBF Cc1ccc(/C=C/c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1F 587146459 MSCGHNAVBQEIQZ-CMDGGOBGSA-N 354.388 5.277 5 1 FKBF COc1ccc(Nc2c3ccccc3[n+](C)c3c2[nH]c2ccccc23)cc1 1772586464 ZQOWXKQGLLLGAX-UHFFFAOYSA-O 354.433 5.051 5 1 FKBF O=[N+]([O-])c1cccc(-c2ccc(/C=C/c3ccc4cccc(O)c4n3)o2)c1 1857547405 LTVRISWDHXIMQS-MDZDMXLPSA-N 358.353 5.279 5 1 FKBF COc1cc(F)c2c(=O)c3ccc(-c4ccc(Cl)cc4)cc3[nH]c2c1 1911586657 FPHRAALQEBWSOP-UHFFFAOYSA-N 353.780 5.149 5 1 FKBF CCC(=O)c1c(-c2ccc(C(F)(F)F)cc2)[nH]c2cc([N+](=O)[O-])ccc12 587645962 HANVAYKZOMPCIF-UHFFFAOYSA-N 362.307 5.355 5 1 FKBF O=[N+]([O-])c1cccc(Nc2ccnc3cc(OCc4ccccc4)ccc23)c1 1857556102 APGZBHKPZLKCEF-UHFFFAOYSA-N 371.396 5.466 5 1 FKBF O=C(c1ccc(Oc2ccccc2)cc1)c1coc2cc([N+](=O)[O-])ccc12 587279075 FHOSKURFRNDKGG-UHFFFAOYSA-N 359.337 5.364 5 1 FKBF CCC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1 586882085 SXFPWUYMQMSLOA-UHFFFAOYSA-N 364.492 7.224 5 1 FKBF CC(C)(Oc1ccc(Cl)cc1)C(=O)c1coc2cc([N+](=O)[O-])ccc12 587279789 ATYQROMFNHHLNQ-UHFFFAOYSA-N 359.765 5.035 5 1 FKBF O=[N+]([O-])c1cccc([C@@H]2Nc3ccccc3-c3cc(-c4ccccc4)nn32)c1 169702031 IBSLRCXTUSXLEK-JOCHJYFZSA-N 368.396 5.098 5 1 FKBF CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 587951284 GRUXYORBFKLKHO-KIMHZCHSSA-N 374.488 5.706 5 1 FKBF CCN(CC)CCCCCn1c2ccccc2c2nc3ccccc3nc21 1772584649 ZPEOQAPWFKNOIS-UHFFFAOYSA-N 360.505 5.250 5 1 FKBF O=[N+]([O-])c1cccc(-c2cncc(-c3nc4ccc5c(c4[nH]3)CCCC5)c2)c1 587269995 KNGIVHXLJKSHCP-UHFFFAOYSA-N 370.412 5.079 5 1 FKBF O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4cc(Cl)ccc4[nH]3)cc2)cc1 587272231 QFSSGHYFUZWDEO-UHFFFAOYSA-N 365.776 5.584 5 1 FKBF CCCCCCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 45348207 HMHPSLQNTLXLJD-UHFFFAOYSA-N 360.841 5.623 5 1 FKBF Cn1cc(-c2nc3c4ccccc4c4ccccc4c3[nH]2)c(C(F)(F)F)c1 587115573 QEFPBJDAAPWMAS-UHFFFAOYSA-N 365.358 5.894 5 1 FKBF C[C@H](c1ccc(N(C)C)cc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 587195134 GGGFSXSMLVXBPO-MRXNPFEDSA-N 365.480 6.087 5 1 FKBF COc1cccc(-c2c3c(nc4c2oc2ccccc24)[C@H]([N+](=O)[O-])CCC3)c1 587362673 JBEDFBFWAWSUCV-QGZVFWFLSA-N 374.396 5.311 5 1 FKBF Cc1ccccc1-c1ccc(Cc2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)cc1 587960103 VUQYVOIIJQHPJY-UHFFFAOYSA-N 357.413 5.346 5 1 FKBF O=C1c2ccccc2-c2cc(-c3ccccc3[N+](=O)[O-])nc3cccc1c23 587104812 JUNORPKNNWMVOO-UHFFFAOYSA-N 352.349 5.021 5 1 FKBF O=C1C[C@H](c2ccc3ccccc3c2[N+](=O)[O-])Oc2c1ccc1c2CCCC1 587512303 MVLJHMHNLRRQGH-OAQYLSRUSA-N 373.408 5.333 5 1 FKBF O=[N+]([O-])C[C@H](Cc1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 2382222507 GKQGDPUISOETSU-IBGZPJMESA-N 356.425 5.438 5 1 FKBF CC1(C)[C@H]2CC=C(C[N+](C)(C)Cc3ccc(-c4ccsc4)cc3)[C@@H]1C2 95561296 HWFPIUQIMQHDNJ-VXKWHMMOSA-N 352.567 5.984 5 1 FKBF c1ccc2c(c1)N[C@@H](c1cc3ccccc3c3ccccc13)[C@H]1CCCO[C@@H]21 95571892 UOVBAOZXTRRJFJ-RCXJIHSJSA-N 365.476 6.628 5 1 FKBF Cc1c(Cl)ccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 587110291 YOLDZUGVMQYBJN-UHFFFAOYSA-N 369.730 5.043 5 1 FKBF Cc1ccc(/C=C/c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1F 587146171 CBLUMPFTBZEBBR-CMDGGOBGSA-N 354.388 5.277 5 1 FKBF O=[N+]([O-])C[C@@H](c1ccccc1)c1c(-c2ccccc2F)[nH]c2ccccc12 1857549233 UXEWHTIMUWUEGJ-SFHVURJKSA-N 360.388 5.383 5 1 FKBF COC(=O)c1[nH]c2ccc3c4ccccc4sc3c2c1-c1ccccc1 40953207 VADNDPHLWBDBSB-UHFFFAOYSA-N 357.434 5.989 5 1 FKBF COc1ccc(OC)c(/C=C/c2cc(=O)oc3c2ccc2ccccc23)c1 1857553806 SEGVYLMPLUEUTL-BQYQJAHWSA-N 358.393 5.134 5 1 FKBF O=[N+]([O-])c1ccc2nc(-c3ccccc3-c3ccc(F)c(F)c3)[nH]c2c1 587144756 DKKJTEKGTSZZLQ-UHFFFAOYSA-N 351.312 5.083 5 1 FKBF O=C(c1c2ccccc2cc2ccccc12)c1coc2cc([N+](=O)[O-])ccc12 587278948 BVEKNNNWSCKVQZ-UHFFFAOYSA-N 367.360 5.878 5 1 FKBF CC1(C)CC(=O)[C@H]2C(=NC(c3ccccc3)=C[C@@H]2c2ccc([N+](=O)[O-])cc2)C1 169723755 KWXLHRWYRPHVGL-XMSQKQJNSA-N 374.440 5.179 5 1 FKBF C[C@H](SCc1ccccc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 586963161 XVANMQGIUPFGMH-INIZCTEOSA-N 368.505 6.864 5 1 FKBF O=C(C[C@@H](Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1)c1ccc(F)cc1 49853575 FFBFTWHDFGXBAD-HXUWFJFHSA-N 370.424 5.368 5 1 FKBF CC(=O)S[C@H]1CCC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)C1 1857540810 ZSWCOOZXTUENRV-CVEARBPZSA-N 352.455 5.252 5 1 FKBF CC(C)(C)OC(=O)Nc1c(-c2ccccc2)[nH]c2cc([N+](=O)[O-])ccc12 587647121 QQKDVERJEWJAKA-UHFFFAOYSA-N 353.378 5.090 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 587161243 LQBLWURUWRLKMM-HUUCEWRRSA-N 354.388 5.070 5 1 FKBF O=[N+]([O-])c1ccc2nc(/C(=C\c3ccc(F)cc3)c3cccs3)[nH]c2c1 587163876 MMFZEKWUQFDAMV-GDNBJRDFSA-N 365.389 5.261 5 1 FKBF CC(=O)Oc1ccc2c(ccc3c(C)c4cc(OC(C)=O)ccc4c(C)c32)c1 5765043 CABXEAJDBBIAPB-UHFFFAOYSA-N 372.420 5.614 5 1 FKBF c1ccc(C[N+]23C(CC[C@H]2c2ccccc2)CC[C@H]3c2ccccc2)cc1 73295554 NEICPURMHDVUJP-XMHBYIEMSA-N 354.517 6.442 5 1 FKBF Cc1cc(C)c2c(c1)c(=O)c1ccccc1n2CCCCN1CCCCC1 1772656240 LWZGTJKFXCZQDM-UHFFFAOYSA-N 362.517 5.038 5 1 FKBF O[C@@H](C[C@@H]1CCCCN1)c1cc2cccc(C(F)(F)F)c2c2ccccc12 169339009 CVESWPZWGKZHKO-YWZLYKJASA-N 373.418 5.577 5 1 FKBF CCCCC1CCC(c2nc3cc4nc5ccccc5nc4cc3[nH]2)CC1 586883755 GHALPSFQJYDERO-UHFFFAOYSA-N 358.489 6.123 5 1 FKBF O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)o1 587265084 MCHOWQWOOIDOQN-UHFFFAOYSA-N 374.183 5.705 5 1 FKBF COc1ccc2c(ccc3c(Cc4ccc(O)cc4)c(O)cc(OC)c32)c1 1857550451 DEEOMPQAWRRBPA-UHFFFAOYSA-N 360.409 5.012 5 1 FKBF CNc1cc(Cl)ccc1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 587066627 OWMLFHQKTGFJQT-UHFFFAOYSA-N 359.820 5.021 5 1 FKBF Fc1cccc([C@H]2C[C@H]2c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 587160525 CXMQVYVNXRKJHF-IAGOWNOFSA-N 354.388 5.070 5 1 FKBF O=[N+]([O-])c1cccc(-c2[nH]c3ccc(F)c(Cl)c3c2-c2ccccc2)c1 587631453 MRPOTSMAKRIMML-UHFFFAOYSA-N 366.779 6.203 5 1 FKBF C(=C\c1cccc2ccccc12)\c1nc2cc3nc4ccccc4nc3cc2[nH]1 587966198 ALZJVLXNJXSWCC-SEYXRHQNSA-N 372.431 5.983 5 1 FKBF CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)CCCCC2 653826093 OOHKGIOTAVORHQ-YRNVUSSQSA-N 350.462 5.009 5 1 FKBF O=[N+]([O-])c1cc(Cl)ccc1SCc1ccccc1Br 299821932 CNNYBMRWFFKARC-UHFFFAOYSA-N 358.644 5.303 5 1 FKBF O=[N+]([O-])c1cccc2[nH]c(-c3ccc(Cl)cc3F)c(-c3ccccn3)c12 587645497 BRMSWYHRCTZUMT-UHFFFAOYSA-N 367.767 5.598 5 1 FKBF CO[C@@H]1[N+]([O-])=C(/C=C/c2ccc3ccc4cccc5ccc2c3c45)CC1(C)C 95580793 ROLKAAIQJNJPSN-CWSBKQHBSA-N 369.464 5.951 5 1 FKBF C[C@@H](SCc1ccccc1)c1nc2c3ccccc3c3ccccc3c2[nH]1 586963163 XVANMQGIUPFGMH-MRXNPFEDSA-N 368.505 6.864 5 1 FKBF Cc1ccc(C)c2[nH]c(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)nc12 587272471 UGZAUTAEQKMVQM-UHFFFAOYSA-N 359.385 5.547 5 1 FKBF Cc1ccc(-c2c(-c3ccc(Cl)cc3)[nH]c3cccc([N+](=O)[O-])c23)cc1 587644639 JJOQZNZJLXPBLZ-UHFFFAOYSA-N 362.816 6.372 5 1 FKBF COC(=O)[C@@H](c1ccc(Cl)cc1)c1c2ccccc2nc2ccccc12 26816009 DRTRYUZPVGYJKT-FQEVSTJZSA-N 361.828 5.346 5 1 FKBF CCCN1[C@H](C)Cc2ccccc2[C@@]1(C)c1cc([N+](=O)[O-])c(Cl)s1 963230490 PSCNILFUFPOVRS-XIKOKIGWSA-N 364.898 5.230 5 1 FKBF Oc1nc2ccccc2c2cc(-c3ccccc3)cc(Nc3ccccc3)c12 2382221007 LHUKYVNIYFDOOU-UHFFFAOYSA-N 362.432 6.504 5 1 FKBF C[C@@H](c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)c1ccccc1C(F)(F)F 587097588 LNYOIPPPEWCEIP-MRVPVSSYSA-N 369.730 5.295 5 1 FKBF Cc1c2cccc-2c2cc(O)c3ccccc3c2n1-c1ccc(N(C)C)cc1 1660882 QRKFFGVOXUVELV-UHFFFAOYSA-N 366.464 5.969 5 1 FKBF Cc1[nH]c2cc([N+](=O)[O-])ccc2c1-c1ccc(Cl)cc1Br 587644333 VHVPKGUPAAIAGO-UHFFFAOYSA-N 365.614 5.467 5 1 FKBF O=C1c2ccccc2[C@@]2(c3c4ccccc4cc4ccccc34)SCCN12 6584048 SLZIXYGPYFYCPU-DEOSSOPVSA-N 367.473 5.397 5 1 FKBF CCCCCC[N+](C)(C)Cc1ccc(C[N+](C)(C)CCCCCC)cc1 5782981 NOQYBHUQBVSDRC-UHFFFAOYSA-N 362.646 6.000 5 1 FKBF O=[N+]([O-])c1cccc(-c2c3c(nn2-c2ccccc2)-c2ccccc2C3)c1 1857609651 DONIDAWWNRZBJD-UHFFFAOYSA-N 353.381 5.019 5 1 FKBF O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(/C=C/c2nc3ccccc3[nH]2)o1 28861749 MVOIOAJOEBTHOC-JXMROGBWSA-N 365.776 5.555 5 1 FKBF Cc1c(F)ccc2nc(-c3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)[nH]c12 587273299 RHLPTWXNSGEZJE-UHFFFAOYSA-N 363.348 5.378 5 1 FKBF CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CO)C(C)(C)C[C@@H](O)C1 238771537 XVQDCCGQSOTQBN-GBVPFENGSA-N 368.561 5.984 5 1 FKBF O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4ccc(Cl)cc4[nH]3)c2)cc1 587272167 LEIQYBQZVGRAOD-UHFFFAOYSA-N 365.776 5.584 5 1 FKBF O=[N+]([O-])c1ccc2c(-c3cccc(F)c3)c(-c3cccc(F)c3)[nH]c2c1 587645408 AQLSZXLUWKPUTO-UHFFFAOYSA-N 350.324 5.688 5 1 FKBF O=c1cc(-c2ccc(C(F)(F)F)cc2F)oc2ccc3ccccc3c12 1857649440 WLDKZNLBQCPCBC-UHFFFAOYSA-N 358.290 5.771 5 1 FKBF CCCCC(=O)OC[n+]1ccc2c(C)c3[nH]c4ccccc4c3c(C)c2c1 1625032 NPZRSNNJSGJLOW-UHFFFAOYSA-O 361.465 5.070 5 1 FKBF O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)cc(Cl)c3[nH]2)ccc1Cl 587047546 KOZJVTGOMVLJBW-DUXPYHPUSA-N 368.607 5.602 5 1 FKBF O=C(c1cc2ccccc2o1)c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 587645593 ZALZQTJNGOAREO-UHFFFAOYSA-N 374.274 5.072 5 1 FKBF CCC1(CC)OC(=O)N(C)c2ccc(Nc3cc(F)cc([N+](=O)[O-])c3)cc21 28878789 UZXKDVGZVWWMGK-UHFFFAOYSA-N 373.384 5.079 5 1 FKBF COc1ccc(-c2cccc(-c3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)c2)cc1 587936247 VDORWDZZRKMTBG-UHFFFAOYSA-N 359.385 5.122 5 1 FKBF O=c1c2ccc(Cl)cc2sc2c(N3CCCC3)nc3ccccc3c12 473169814 OEECAUWFXVEAEP-UHFFFAOYSA-N 366.873 5.217 5 1 FKBF CC(=O)c1ccc2[nH]c(-c3ccc(-c4ccc([N+](=O)[O-])cc4)cc3)nc2c1 84711163 ZTBHGCYEVHKCHT-UHFFFAOYSA-N 357.369 5.008 5 1 FKBF Cc1[nH]c2cc([N+](=O)[O-])ccc2c1[C@H]1CCCCCN1C(=O)OC(C)(C)C 587648348 DMJCKAFURBYNLF-QGZVFWFLSA-N 373.453 5.237 5 1 FKBF O=[N+]([O-])C[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2cccc(F)c12 1857552101 DHBLMEZBOILHCY-QGZVFWFLSA-N 360.388 5.383 5 1 FKBF O=[N+]([O-])c1cc([N+](=O)[O-])c(C=Cc2ccccc2)cc1C=Cc1ccccc1 2356856397 XRQIISCOFYUANL-UHFFFAOYSA-N 372.380 5.844 5 1 FKBF O=[N+]([O-])c1cc2nc(-c3cccc(-c4ccccc4F)c3)[nH]c2cc1Cl 587152647 BXLIBPMAPGXWHV-UHFFFAOYSA-N 367.767 5.598 5 1 FKBF Cc1cc(F)ccc1N=c1c2ccccc2n(C)c2c1oc1ccccc12 1772582257 YLPVIOHDOPVJIG-UHFFFAOYSA-N 356.400 5.758 5 1 FKBF