smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1cc([N+](=O)[O-])cc2cc(C(=O)NC3CCCCC3)c(=O)oc12 466265 JFFMKJUMDBVOQB-UHFFFAOYSA-N 346.339 2.772 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 2058312 NWMYPGTWVAMIPB-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA COc1cc(NC(=O)c2ccccc2[N+](=O)[O-])c(C(=O)O)cc1OC 502180 SATVOEMKDOHZBB-UHFFFAOYSA-N 346.295 2.563 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 4809227 BTPZMPLZTQJGMY-UHFFFAOYSA-N 349.368 2.527 5 50 EFBA Nc1ccc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] 158527991 BNVCJUDCMGXASV-YOEHRIQHSA-N 341.367 2.827 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@H]3CCC[C@H]32)s1 230103602 APNQSFZRNDMVJV-NXEZZACHSA-N 330.431 2.829 5 50 EFBA CC(=O)N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)NC1CCCCC1 459252 MYQQRGBQUJDYCC-LFIBNONCSA-N 331.372 2.521 5 50 EFBA CC(=O)Nc1ccc(NC(=O)[C@H](C)n2nc(C)c([N+](=O)[O-])c2C)cc1 1068462 HONPLVHPTRXIOF-NSHDSACASA-N 345.359 2.566 5 50 EFBA C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 1180179 XAQFWUKALHQJBC-NSHDSACASA-N 328.324 2.857 5 50 EFBA O=[N+]([O-])c1ccc2oc(CN3CC[C@]4(O)CCCC[C@H]4C3)nc2c1 247115739 AGBPJQPSEHASLP-YVEFUNNKSA-N 331.372 2.863 5 50 EFBA O=[N+]([O-])c1ccc2oc(CN3CC[C@@]4(O)CCCC[C@H]4C3)nc2c1 247115722 AGBPJQPSEHASLP-SJCJKPOMSA-N 331.372 2.863 5 50 EFBA CCC(=O)NC(=S)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 2844104 GVHFNYJZORSYHD-UHFFFAOYSA-N 336.398 2.941 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(C)(C)C(N)=O)cc1 225562062 KANKRKNNFQCISQ-UHFFFAOYSA-N 341.367 2.918 5 50 EFBA COC(=O)c1cc(C)nc(N2CCc3sccc3C2)c1[N+](=O)[O-] 253415407 IGNWNALSGFTNLN-UHFFFAOYSA-N 333.369 2.709 5 50 EFBA C[C@@H]1CCC[C@H](Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])[C@@H]1C 4813536 PPJJRKILMNEUBW-BZPMIXESSA-N 331.376 2.651 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)OC12CCCCC2 4845009 LCZASDAFYIJYLA-LBPRGKRZSA-N 348.355 2.808 5 50 EFBA C[C@]1(C(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc2C(=O)O1 5064928 OKDQBZHWPXBWKH-QGZVFWFLSA-N 326.308 2.705 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccccc1[N+](=O)[O-] 4017924 VKQCDGNQTPNRPW-OAHLLOKOSA-N 330.296 2.893 5 50 EFBA Cc1cc(=O)oc(C)c1C(=O)OC[C@@H]1CCC[N@+]2(C)CCCC[C@H]12 253389853 VJGXIRQJQRPTAG-YRNRMSPPSA-N 334.436 2.823 5 50 EFBA biogenic COc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2)cc1OC 242185 PLRANRIYZRCBNA-UHFFFAOYSA-N 330.340 2.884 5 50 EFBA C[C@@H]1CN(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 4723274 SKVYGLPGRYWITQ-HUUCEWRRSA-N 333.432 2.668 5 50 EFBA Cc1nc([N+](=O)[O-])nn1C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 100437059 GCXVVAXZOUZPFA-WPMGSTCASA-N 341.209 2.938 5 50 EFBA aggregator COC(=O)c1ccc([N+](=O)[O-])c(N2CCc3sccc3[C@H]2C)n1 286159246 OQFGEXKOABPZMX-SECBINFHSA-N 333.369 2.962 5 50 EFBA CCc1ccccc1NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4117080 WGVWPOURALMBEP-UHFFFAOYSA-N 331.353 2.718 5 50 EFBA C[C@@H](Nc1ccc(CNS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 170592786 FBZSDWRWSKEHKT-GFCCVEGCSA-N 349.412 2.817 5 50 EFBA O=C(N[C@@H]1CCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170015385 URLBWOJVKYYXHQ-CJNGLKHVSA-N 328.324 2.560 5 50 EFBA CNC(=O)c1cc2cc(Cc3ccccc3)cc([N+](=O)[O-])c2oc1=O 1064052 RVTAEWMXAPVXCX-UHFFFAOYSA-N 338.319 2.652 5 50 EFBA O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2NCCC1=CCCCC1 4401895 DETQIPDMNCMKGF-UHFFFAOYSA-N 335.385 2.524 5 50 EFBA Cc1cc(C)n(-c2nc(N3CCC(C)CC3)nc(C)c2[N+](=O)[O-])n1 4951680 MWYGWGHYQZGXIA-UHFFFAOYSA-N 330.392 2.732 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(c2ccccc2)C1 115105344 FBQITMLNFZKOKQ-INIZCTEOSA-N 339.395 2.923 5 50 EFBA COc1ccc(C(=O)NC(=S)Nc2cccc([N+](=O)[O-])c2)cc1 5550116 HMIWSTHIVLAJJV-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@@H](CCc1ccccc1)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 4696268 UHQYOFPFBLMFQV-ZDUSSCGKSA-N 334.397 2.894 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](c2cnn(C)c2)C1 162691346 PGBMIPLTOZDFNQ-LBPRGKRZSA-N 329.360 2.658 5 50 EFBA Cc1ccc(Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])c(C)c1 4758822 JMNHNKIYUIGERQ-UHFFFAOYSA-N 325.328 2.774 5 50 EFBA aggregator COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2c1c(C)nn2C 2741103 QUSKCEBZYGKHSN-UHFFFAOYSA-N 326.312 2.639 5 50 EFBA CNc1ccc(CN[C@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] 131554094 XRMWXNPLQKAUEX-INIZCTEOSA-N 346.431 2.660 5 50 EFBA Cc1sc(NC(=O)Cc2ccccc2[N+](=O)[O-])c(C(N)=O)c1C 3613282 FWKKHQITMKAKRC-UHFFFAOYSA-N 333.369 2.553 5 50 EFBA C[N@@+]12CCCC[C@@H]1[C@H](COC(=O)c1ccc3c(c1)OCO3)CCC2 252441073 CZOWFUDDKUCISC-YRNRMSPPSA-N 332.420 2.981 5 50 EFBA biogenic C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1cccs1 305726773 RQFXSVLZPJUYME-CQSZACIVSA-N 340.788 2.947 5 50 EFBA Cc1cc(OCCN2C(=O)CCN2c2ccccc2)ccc1[N+](=O)[O-] 5065686 SKAKIJMORWQYLA-UHFFFAOYSA-N 341.367 2.936 5 50 EFBA Cc1ccc(C(=O)N2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-] 19879101 YHAWVWZXADIPRF-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA COc1ccc(NC(=O)CN[C@@H]2[C@@H](C)CCC[C@H]2C)c([N+](=O)[O-])c1 245899191 RURJHTQSFLLRPA-PBKGOJFUSA-N 335.404 2.956 5 50 EFBA CCNc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cn1 952995587 QMSCRYASYWMGNC-UHFFFAOYSA-N 346.343 2.691 5 50 EFBA O=C(c1cccnc1)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4998720 ICJKQNRHQAWHHW-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA C[N+]1(C)CCC[C@@H](OC(=O)C(O)(c2ccccc2)c2ccccc2)C1 3813083 GKNPSSNBBWDAGH-LJQANCHMSA-N 340.443 2.705 5 50 EFBA fda Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1c2ccccc2C[C@@H]1O 163058559 LBQFSUATHLWQMY-HOTGVXAUSA-N 327.340 2.683 5 50 EFBA O=C(O)C[C@@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 263031139 VADHJLQFQTZAEQ-JTQLQIEISA-N 334.353 2.889 5 50 EFBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 216261176 WIVIBAYEYWRCMI-QQXRRDQMSA-N 336.731 2.710 5 50 EFBA CCO[C@@H]1CCCC[C@H]1Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] 408519617 GWLMUBWZGILOML-MWLCHTKSSA-N 348.446 2.819 5 50 EFBA O=C(/C=C\c1cccs1)NC(=S)Nc1ccc([N+](=O)[O-])cc1O 16133978 GUIMFLJOFXLEBK-XQRVVYSFSA-N 349.393 2.888 5 50 EFBA O=C(NC(=S)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 174138 FYPFRVDUXCOUFS-UHFFFAOYSA-N 325.733 2.968 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])Nc1nnc(C(F)(F)F)s1 460348 WYLLCWDEUOKPHA-UHFFFAOYSA-N 332.263 2.646 5 50 EFBA O=c1[nH]c2ccc(CNc3ccc([N+](=O)[O-])c4cnccc34)cc2[nH]1 239352691 ADAZDJSOCYIVDB-UHFFFAOYSA-N 335.323 2.925 5 50 EFBA CC1(C)CC[C@@H](CO)N(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 952884261 WLWQIJVPCBUJMV-LBPRGKRZSA-N 331.372 2.699 5 50 EFBA Cc1cc(C(=O)NCc2nc(-c3ccccc3)no2)ccc1[N+](=O)[O-] 1056871 PYEIJOLAPRZNLU-UHFFFAOYSA-N 338.323 2.883 5 50 EFBA COC(=O)c1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2779488 IXMQEFQXINZQBS-UHFFFAOYSA-N 346.251 2.509 5 50 EFBA CC(=O)c1ccc(OCC(=O)Nc2cccc(F)c2)c([N+](=O)[O-])c1 119035499 QMOFFVQHIIDHIL-UHFFFAOYSA-N 332.287 2.954 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCO[C@@H](c2cccs2)C1 163244421 KFEHJRSBORRXSK-GFCCVEGCSA-N 334.353 2.576 5 50 EFBA O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccccc1[N+](=O)[O-] 19683094 FBJIQVPIDVBFFK-UHFFFAOYSA-N 341.367 2.679 5 50 EFBA C[C@H](NS(=O)(=O)C[C@@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 2325803811 CLZSGDZBCMASGW-WFASDCNBSA-N 346.408 2.915 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 365671472 DVSJEUCXUKGOTB-AWEZNQCLSA-N 342.399 2.968 5 50 EFBA CC(=O)Nc1cccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 161670884 PXAUSBMKTLFZFY-UHFFFAOYSA-N 341.367 2.721 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2 250576027 OEXHQOGQTVQTAT-HZVKZAKPSA-N 332.464 2.854 5 50 EFBA in-man Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1-n1c(C)nc2ccccc2c1=O 3671581 PUNMEYQLVSHRPN-UHFFFAOYSA-N 340.295 2.819 5 50 EFBA CCC(=O)c1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 1868494 QBMNEQDIGXKFPL-UHFFFAOYSA-N 335.337 2.955 5 50 EFBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2CC(Cl)=CC[C@H]2C1=O 100634205 QMBQBFXCJNMJBG-MNOVXSKESA-N 336.731 2.626 5 50 EFBA O=[N+]([O-])c1cc(OCc2nc(CC(F)(F)F)no2)c(F)cc1F 408524058 XGRYNAGYIKUABC-UHFFFAOYSA-N 339.176 2.940 5 50 EFBA COC(=O)c1cc(NC(=O)c2nc(C)oc2C)c(C)c([N+](=O)[O-])c1 292961950 HRFDAHVXCMLWCG-UHFFFAOYSA-N 333.300 2.547 5 50 EFBA CCN(CC)S(=O)(=O)c1ccc2[nH]c(=O)c3ccccc3c2c1 4632183 OAWPNARGEFTVKV-UHFFFAOYSA-N 330.409 2.712 5 50 EFBA C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)N1CCCCC1=O 170606531 APZIJOAFQKVXQE-GFCCVEGCSA-N 328.372 2.956 5 50 EFBA Cc1ccc(C)c(OC2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)c1 179605867 ARSWDBBCYQGTTR-UHFFFAOYSA-N 344.371 2.618 5 50 EFBA O=C(NCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1Cl 283112 IBPOQUGGUHFTQG-UHFFFAOYSA-N 334.715 2.907 5 50 EFBA CC(C)(C)c1nnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 2991866 WIWRVTXHWSPXQY-UHFFFAOYSA-N 342.402 2.545 5 50 EFBA CCCC1=C(C(=O)OCC)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 178978 GHSUJHCDAYGKDF-AWEZNQCLSA-N 333.344 2.566 5 50 EFBA Cc1cc(C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)ccc1[N+](=O)[O-] 4550363 PHDWSUOHFUVBFY-UHFFFAOYSA-N 344.279 2.552 5 50 EFBA CCOC[C@H]1CCN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C1 408522414 IOXIHQMSAIRLQI-JTQLQIEISA-N 328.315 2.680 5 50 EFBA O=C(O)C[C@H](NC(=O)Nc1ccccc1)c1cccc([N+](=O)[O-])c1 4685904 XWYPPEXCJAXJDZ-AWEZNQCLSA-N 329.312 2.932 5 50 EFBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 4013688 OBZOTQJIUPWICF-UHFFFAOYSA-N 346.324 2.630 5 50 EFBA Cc1noc(C)c1C[C@@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1C 124649196 PJQKVJANKXBMGE-SNVBAGLBSA-N 331.372 2.798 5 50 EFBA Cc1noc(C)c1C[C@H](C)NC(=O)Cc1cccc([N+](=O)[O-])c1C 124649070 PJQKVJANKXBMGE-JTQLQIEISA-N 331.372 2.798 5 50 EFBA O=C(CNCCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1 5799430 PKTNNMBKUHNRHJ-UHFFFAOYSA-N 346.362 2.764 5 50 EFBA COc1ccc(NC(=S)NC(=O)c2ccccc2F)cc1[N+](=O)[O-] 2812942 NIZVLGXDAMIDLI-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccccc1OC 39141 HSMZGNSORMDVQD-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CCCO2)CC1 4838895 QYBKYDXKLHAJNR-OAHLLOKOSA-N 347.415 2.740 5 50 EFBA O=C1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)O1 4845677 VSUVQNJWUMYAEJ-GOEBONIOSA-N 326.308 2.838 5 50 EFBA Cc1ccc2nsnc2c1NC(=O)COc1ccc([N+](=O)[O-])cc1 97717 JPHMCLOEXMXTIC-UHFFFAOYSA-N 344.352 2.925 5 50 EFBA COC(=O)[C@@H](CC(C)C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 318571 JDRJTXRQGTYURW-LLVKDONJSA-N 328.752 2.566 5 50 EFBA Cc1cc(C(=O)N2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-] 858824 IVIICVHUDGJBPP-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(C(C)C)on1 225443841 XFKUDBOKGQRWCO-UHFFFAOYSA-N 325.346 2.815 5 50 EFBA CN(c1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])C1CCCCC1 5050344 JZYGOFZPUNRPHI-UHFFFAOYSA-N 347.415 2.836 5 50 EFBA O=C(CSc1nnnn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 97549 BGPGICJSOJXUJY-UHFFFAOYSA-N 341.352 2.546 5 50 EFBA COc1ccccc1CN1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 3900593 SGILPRMMUWFYID-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA Cn1cc(-c2c3cnn(C)c3nc3c2oc2cc(O)cc(O)c23)cn1 409415369 CVLZDNHLTKQYMP-UHFFFAOYSA-N 335.323 2.679 5 50 EFBA CC(=O)Oc1ccc2c(=O)oc(-c3cccc([N+](=O)[O-])c3)nc2c1 435166 OUMHVKNRXLAQBH-UHFFFAOYSA-N 326.264 2.689 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1 17068219 UBSYTORUDLHNLU-QMTHXVAHSA-N 332.356 2.814 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1 17068225 UBSYTORUDLHNLU-HZMBPMFUSA-N 332.356 2.814 5 50 EFBA CCOC(=O)c1ccnc(NCc2noc3ccccc23)c1[N+](=O)[O-] 241144844 JTOOAUVPYMBNRI-UHFFFAOYSA-N 342.311 2.920 5 50 EFBA CCOc1ccc(N2C(=O)CN(c3ccccc3[N+](=O)[O-])C2=O)cc1 5196969 PYVJJPFRUJRCBB-UHFFFAOYSA-N 341.323 2.967 5 50 EFBA COc1ccc(-n2nc([N+](=O)[O-])c(=O)c3ccc(Cl)cc32)cc1 3192100 CQTWKOHJCCCQNO-UHFFFAOYSA-N 331.715 2.956 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)CC(C)(C)C 4367669 HHLLFMRXGOHNAH-UHFFFAOYSA-N 325.390 2.853 5 50 EFBA O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 19683103 VKOPLAKFLSOUKB-UHFFFAOYSA-N 341.367 2.679 5 50 EFBA CC(C)NC(=O)c1ccccc1NC(=O)c1ccccc1[N+](=O)[O-] 2875503 SCCWFWRARNCYBF-UHFFFAOYSA-N 327.340 2.985 5 50 EFBA CC(=O)c1ccc(N2CC[C@H](Oc3cccnc3)C2)c([N+](=O)[O-])c1 301671255 OIQKPHHYENUVQD-HNNXBMFYSA-N 327.340 2.850 5 50 EFBA CC(=O)c1ccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])cc1 34690 GAQJBULSLBTNGJ-UHFFFAOYSA-N 328.280 2.748 5 50 EFBA CC(=O)Oc1ccc2nc(-c3cccc([N+](=O)[O-])c3C)oc(=O)c2c1 203410 QLFGUZYENLIHIC-UHFFFAOYSA-N 340.291 2.997 5 50 EFBA COc1ccc(Nc2cc(N(C)C)c3nonc3c2[N+](=O)[O-])cc1 3904304 PQNBJDXQHJFYFL-UHFFFAOYSA-N 329.316 2.949 5 50 EFBA NC1=N[C@H](c2cc([N+](=O)[O-])ccc2Cl)n2c(nc3ccccc32)N1 4741644 PKNLRTKXEJBUNZ-ZDUSSCGKSA-N 342.746 2.885 5 50 EFBA C[C@@H]1[C@@H](Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])CCC[C@H]1C 244774189 PPJJRKILMNEUBW-DYEKYZERSA-N 331.376 2.651 5 50 EFBA CCOP(=O)(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)OCC 1776004124 KDMVGTMTMZPUPO-UHFFFAOYSA-N 342.288 2.750 5 50 EFBA O=C(O)C[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4599349 GGLUURJRYCGAJJ-CYBMUJFWSA-N 328.324 2.867 5 50 EFBA COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c(OC)c1 309146 PTHHPLLLKMZERV-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA CCc1ncc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cn1 414395979 LGGRIOZMMOCLCG-UHFFFAOYSA-N 342.399 2.991 5 50 EFBA CC(=O)Oc1ccc2nc(-c3ccc(C)c([N+](=O)[O-])c3)oc(=O)c2c1 79731 FXQUADJXHNAXPH-UHFFFAOYSA-N 340.291 2.997 5 50 EFBA O=c1oc(-c2ccc([N+](=O)[O-])cc2)nc2c1cnn2-c1ccccc1 35922 RELGBSXBJYORPU-UHFFFAOYSA-N 334.291 2.949 5 50 EFBA Cc1ccccc1NC(=O)c1[nH]nc([N+](=O)[O-])c1Br 17066563 NCBNABWROCFMCH-UHFFFAOYSA-N 325.122 2.641 5 50 EFBA Cc1cc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)ccc1[N+](=O)[O-] 121299554 DYTIVTGKXZVGNW-JKSUJKDBSA-N 327.340 2.683 5 50 EFBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](O)(c2ccccc2)C1 436054 HYFAVSSJUUIBLV-KRWDZBQOSA-N 325.324 2.662 5 50 EFBA CC(C)n1nc(O)c2c1NC(=O)CS[C@H]2c1ccc([N+](=O)[O-])cc1 463402 XLQYNWJRBUWNPL-ZDUSSCGKSA-N 348.384 2.853 5 50 EFBA O=C1OC(c2ccc3c(c2)OCO3)=N/C1=C\c1ccc([N+](=O)[O-])cc1 58915 BBCGJUKZDKOSQB-QPEQYQDCSA-N 338.275 2.668 5 50 EFBA COC(=O)c1cc(C(=O)N2CCc3ccccc3C2)cc([N+](=O)[O-])c1 60834 QJGHVXMGXNTTIW-UHFFFAOYSA-N 340.335 2.580 5 50 EFBA C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(C(C)(C)C)cc1 374861 NUUSDAHBZWJPKI-GFCCVEGCSA-N 330.388 2.966 5 50 EFBA O=[N+]([O-])c1ccc(Cl)cc1CN1CCC(Cn2ccnn2)CC1 179029056 IBUXKAKQJHKGLD-UHFFFAOYSA-N 335.795 2.752 5 50 EFBA COC(=O)CCCCC(=O)OC[C@@H]1CCC[N@+]2(C)CCCC[C@H]12 252441076 DQPCKZZXKTTXKQ-FCEWJHQRSA-N 326.457 2.672 5 50 EFBA biogenic O=C(Cc1ccccc1[N+](=O)[O-])N1CCCCC[C@H]1c1ncon1 184177253 VHONVTWWNNNVKC-AWEZNQCLSA-N 330.344 2.664 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1)N1CCN(c2ccc(F)cc2)CC1 116907 LGQWIKKWTDYTET-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA CC(C)NC(=O)c1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 1056728 VDDQQQJQNOXLRO-UHFFFAOYSA-N 341.367 2.914 5 50 EFBA O=C(c1sc2cc([N+](=O)[O-])ccc2c1Cl)N1CCNCC1 2558525 YSSCJSZEFBLRIZ-UHFFFAOYSA-N 325.777 2.508 5 50 EFBA Nc1ccc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] 158528130 BNVCJUDCMGXASV-WMLDXEAASA-N 341.367 2.827 5 50 EFBA COc1cc2c(cc1O)C[C@H]1c3cc(O)c(OC)cc3CC[N@+]1(C)C2 238809382 RBBVPNQTBKHOEQ-HRAATJIYSA-O 342.415 2.915 5 50 EFBA biogenic,in-vitro Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c(Br)c1 371942 CHJBMHZLMOHELY-UHFFFAOYSA-N 339.149 2.501 5 50 EFBA NC(=O)c1cc([N+](=O)[O-])cnc1Sc1nc(-c2ccccc2)co1 302827592 NPGHCKPYXONXSZ-UHFFFAOYSA-N 342.336 2.895 5 50 EFBA COc1ccc(CN(C)[C@H]2Cc3ccccc3[C@H]2O)cc1[N+](=O)[O-] 252512620 TVOMOHXIRDWKOQ-FUHWJXTLSA-N 328.368 2.694 5 50 EFBA O=C1[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 239433626 YEPKVCZGNVXKKG-JSBGKLSNSA-N 344.754 2.806 5 50 EFBA O=C(Nc1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cccs1 5049682 DMYFXHMKYHDADZ-UHFFFAOYSA-N 333.369 2.745 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccc(Cl)cn2)cc([N+](=O)[O-])c1 2930719 LFKZFKBGFSGURD-UHFFFAOYSA-N 335.703 2.682 5 50 EFBA COc1ccc(-n2nc([N+](=O)[O-])c(NC3CCCCCC3)[n+]2[O-])cc1 4813815 OITGOSQUIFZGGB-UHFFFAOYSA-N 347.375 2.557 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](c2cnn(C)c2)C1 162691478 PGBMIPLTOZDFNQ-GFCCVEGCSA-N 329.360 2.658 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@H](CO)c1ccccc1)C2 253476025 OEXHQOGQTVQTAT-CWVBCOCOSA-N 332.464 2.854 5 50 EFBA fda CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1cc(F)ccc1Cl 170619600 CYGDTMXURRLSGV-UHFFFAOYSA-N 345.739 2.607 5 50 EFBA COC(=O)c1ccccc1NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 102201 PIPBCGMRSITHEO-UHFFFAOYSA-N 330.296 2.642 5 50 EFBA Cc1ccc(S(=O)(=O)n2c(C)nc3cc([N+](=O)[O-])ccc32)cc1 3121735 GIUHLEZRPZHWHN-UHFFFAOYSA-N 331.353 2.798 5 50 EFBA CC1(C)[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@@H]2CCO[C@H]21 230191552 KBZULBQZHGSTSD-COLVAYQJSA-N 329.356 2.619 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N1CCOCC1 20310874 LIHICEXSMVDLNI-KRWDZBQOSA-N 341.367 2.607 5 50 EFBA N[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 238023587 NLFATLITAOYPFJ-INIZCTEOSA-N 341.367 2.854 5 50 EFBA CC(=O)N(C)c1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 38523 SOELSHSSYHBMGK-UHFFFAOYSA-N 343.339 2.595 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(CCO)cc1 1752579 YNZLMGRAXLCKAR-UHFFFAOYSA-N 331.328 2.782 5 50 EFBA O=C(NC(c1cccs1)c1cccs1)c1n[nH]cc1[N+](=O)[O-] 162388826 SLCBMNKQQAQYPU-UHFFFAOYSA-N 334.382 2.960 5 50 EFBA Cc1ocnc1C(=O)O[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 170605086 AJSIFUOQQHXUAP-LBPRGKRZSA-N 349.318 2.856 5 50 EFBA C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)no1 864060653 JYGBYAIPUQYWLR-ZCFIWIBFSA-N 345.237 2.879 5 50 EFBA Cc1c(Cl)cccc1NC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1 1066861 WWRHZERUMQLHNY-UHFFFAOYSA-N 347.758 2.925 5 50 EFBA CCc1ccc(C(C)(C)CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1 176891590 XTKKJTGKAYGTFJ-UHFFFAOYSA-N 344.415 2.907 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19773594 JODXGRITUCQNPC-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA O=C(N[C@@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1O 156096863 LTGFZLONZXXJLT-CJNGLKHVSA-N 328.324 2.560 5 50 EFBA CCOC(=O)c1nc(-c2ccccc2)oc1Cn1nccc1[N+](=O)[O-] 174014820 USDBKRDXYDTVSS-UHFFFAOYSA-N 342.311 2.671 5 50 EFBA CS(=O)(=O)C[C@@H]1CCCCN1c1ccc(Cl)cc1[N+](=O)[O-] 408519610 DXPMCFSUIPTLPD-NSHDSACASA-N 332.809 2.652 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)[C@@H](CO)c1ccccc1)C2 250576018 OEXHQOGQTVQTAT-FIRLOTFOSA-N 332.464 2.854 5 50 EFBA in-man COCC[C@](C)(O)CNc1ccc([N+](=O)[O-])cc1Br 230235510 QBLMQWVFTPFEHD-LBPRGKRZSA-N 333.182 2.557 5 50 EFBA C[C@@H]1Oc2ccc([N+](=O)[O-])cc2N(Cc2ccc(C(=O)O)cc2)C1=O 20393137 ICHNTBRDZLOJER-JTQLQIEISA-N 342.307 2.607 5 50 EFBA in-vitro CC(=O)Oc1cc(O)c(C(=O)CCc2ccc([N+](=O)[O-])cc2)c(O)c1 3122416 XIOWYXPUQNHPEP-UHFFFAOYSA-N 345.307 2.747 5 50 EFBA Cc1cc([N+](=O)[O-])nn1Cc1ccccc1C(=O)Nc1nccs1 2795397 KIWWKBVRPSTUEJ-UHFFFAOYSA-N 343.368 2.857 5 50 EFBA CCOC(=O)C(C[C@@H]1CCC[N@+]2(C)CCCC[C@H]12)C(=O)OCC 252441296 NONZADLMFDYBRU-GMBSWORKSA-N 326.457 2.528 5 50 EFBA biogenic COc1cccc(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1 446592 HFQDXJGPOIAGJV-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA O=C(Nc1ccccc1F)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4865817 YUHRIDHEQPARLB-UHFFFAOYSA-N 345.330 2.823 5 50 EFBA O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N1CCCCC1 4917943 FAGRGRSDVNBGIZ-UHFFFAOYSA-N 338.307 2.879 5 50 EFBA O=C(NCCO)c1cc([N+](=O)[O-])cc2c1C=Cc1ccccc1O2 4689819 IASFWYDGHBHTIY-UHFFFAOYSA-N 326.308 2.593 5 50 EFBA CN(CCc1ccccc1[N+](=O)[O-])Cc1nc(O)c2sccc2n1 253630208 QPKAQGDNEXMKNX-UHFFFAOYSA-N 344.396 2.980 5 50 EFBA Cc1cc([N+](=O)[O-])c(Cl)cc1NS(=O)(=O)c1cncc(F)c1 408514052 OUBIJCSUAQYCSL-UHFFFAOYSA-N 345.739 2.892 5 50 EFBA Cc1nc(CN2CCCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cs1 193412489 DRSJICVAALFRHG-UHFFFAOYSA-N 347.444 2.654 5 50 EFBA COc1ccc(NC(=O)c2cc3ccccc3oc2=O)c([N+](=O)[O-])c1 4036838 KPDIEFZUCNBLQI-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 139550405 KBZVQXRRBCJLNT-LLVKDONJSA-N 340.763 2.664 5 50 EFBA O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1CCCN(c2ccncn2)C1 370768181 RLCQNDNQPWFFLE-WUTVXBCWSA-N 339.399 2.657 5 50 EFBA C[C@]1(F)CCN(c2nc(N3CC[C@@](C)(F)C3)ccc2[N+](=O)[O-])C1 408391628 DUYKWJBAKNRBCE-CABCVRRESA-N 326.347 2.866 5 50 EFBA CC(C)(C)[C@@H](CO)NCc1ccc(Br)c([N+](=O)[O-])c1 278493231 LTTYPDDQTQSDPR-GFCCVEGCSA-N 331.210 2.854 5 50 EFBA COc1ccc(CNCCc2ccc([N+](=O)[O-])cc2)c(OC)c1OC 19720444 YXZXUFCLIYMFNI-UHFFFAOYSA-N 346.383 2.953 5 50 EFBA O=C(c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4543935 NZFHTAKURIYZRO-UHFFFAOYSA-N 347.321 2.835 5 50 EFBA Cc1c(Cl)c([N+](=O)[O-])nn1CCCC(=O)NCc1cccs1 215064 DOUGKLDOCONZLY-UHFFFAOYSA-N 342.808 2.911 5 50 EFBA CCCn1cc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)c2ccccc21 16361857 HHPJYWGYMHQALA-BQYQJAHWSA-N 340.339 2.919 5 50 EFBA CC1(C)CC[C@H](CO)N(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 952884258 WLWQIJVPCBUJMV-GFCCVEGCSA-N 331.372 2.699 5 50 EFBA COc1ccc(OC)c(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 316837 XWGUZPJESONXCS-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA O=Cc1cc(Cl)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 2980472 MTYXZZBPNMOPLB-UHFFFAOYSA-N 341.728 2.828 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4912872 SJCURNALOTVZLY-CYBMUJFWSA-N 332.356 2.672 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(C2CCCC2)CC1 13322775 SLKPPZLLFZJNOU-UHFFFAOYSA-N 348.403 2.696 5 50 EFBA Cc1ccc(S(=O)(=O)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 4834863 ZDEXBXDFCUGRTI-UHFFFAOYSA-N 348.380 2.624 5 50 EFBA Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2Cc3ccccc32)cc1C 170651994 ABOOKMYDWSGUJR-AWEZNQCLSA-N 346.408 2.830 5 50 EFBA O=C(Cn1c(=O)sc2ccccc21)Oc1cccc([N+](=O)[O-])c1 5605040 MAHCIIGEJAVQGS-UHFFFAOYSA-N 330.321 2.577 5 50 EFBA O=[N+]([O-])c1cc(S(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)ccc1F 1596706 KHAWDEWNXJIVCJ-UHFFFAOYSA-N 344.251 2.614 5 50 EFBA in-vitro CCCN(CCC)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 5139146 UMKANAFDOQQUKE-UHFFFAOYSA-N 345.377 2.533 5 50 EFBA in-vitro Cc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2N)cc1 601148103 PNUNYJSKCZTOKY-UHFFFAOYSA-N 341.776 2.940 5 50 EFBA Nc1cc(CC(=O)N[C@H]2CCCOc3ccccc32)ccc1[N+](=O)[O-] 408515257 SXSUPRIHYHKAOV-HNNXBMFYSA-N 341.367 2.750 5 50 EFBA CCOC(=O)[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4975495 SLJSZVXIXLCLIH-INIZCTEOSA-N 342.351 2.955 5 50 EFBA CCN1CCC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] 279846611 DBCJYRVAZLECNE-LLVKDONJSA-N 343.786 2.530 5 50 EFBA Cc1c(NC(=O)c2ccc(NS(C)(=O)=O)cc2)cccc1[N+](=O)[O-] 1063501 HJSWRUHMBYYFPA-UHFFFAOYSA-N 349.368 2.527 5 50 EFBA Cc1c([N+](=O)[O-])cnn1CCC(=O)NCC12CC3CC(CC(C3)C1)C2 6921776 KVJHBVAUESNMLZ-UHFFFAOYSA-N 346.431 2.822 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4688252 ZAADZFMMPMYHNI-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA COC(=O)c1ccc(N2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1 4051575 GFBKCJHXEKDMDZ-UHFFFAOYSA-N 341.367 2.708 5 50 EFBA Cc1cc(OCC(=O)N2CCn3cccc3[C@H]2C)ccc1[N+](=O)[O-] 280881360 UKQDVJBIDKIUNZ-CYBMUJFWSA-N 329.356 2.687 5 50 EFBA O=[N+]([O-])c1cccc([C@]2(O)C[n+]3ccccc3N2c2ccccc2)c1 5947902 KXUMHCBLNSSWES-LJQANCHMSA-N 334.355 2.879 5 50 EFBA COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2c2cnn(C)c2)c1 341777175 UJYHHTFOUVVNJH-OAHLLOKOSA-N 344.371 2.704 5 50 EFBA O=C(c1csc([N+](=O)[O-])c1)N1CCN2CCOc3cccc1c32 374496018 KNGNRNLMVFAPJJ-UHFFFAOYSA-N 331.353 2.516 5 50 EFBA COc1cc(C(=O)Nc2ncnc3[nH]c(C)c(C)c23)ccc1[N+](=O)[O-] 183593192 MPGAWRQQQRWIFW-UHFFFAOYSA-N 341.327 2.744 5 50 EFBA COc1ccc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1[N+](=O)[O-] 456343 PRDIZJHMRQPLQD-UHFFFAOYSA-N 343.339 2.838 5 50 EFBA COCc1nc2oc3ccc(Cl)cc3c(=O)c2cc1C(=O)OC 3027701 NUNIVLCQUKIAPE-UHFFFAOYSA-N 333.727 2.928 5 50 EFBA O=C(Nc1cc(Br)c(F)cc1F)c1n[nH]cc1[N+](=O)[O-] 170605276 OHDWJDFELZCYFB-UHFFFAOYSA-N 347.075 2.611 5 50 EFBA Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCNCC2)cc1 4873336 UBXDVYRWGSJGGH-UHFFFAOYSA-N 340.383 2.565 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1cc(F)ccc1F 17071798 PCUHHOJFKZNAAE-UHFFFAOYSA-N 344.295 2.682 5 50 EFBA O=C(C1=COCCO1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 194659841 FYMHHQCOLQHEPA-UHFFFAOYSA-N 338.747 2.879 5 50 EFBA Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1[N+](=O)[O-] 19571555 RKQFXAGVZZOLIJ-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 270905 JIABFMRDXFPWMC-BZNIZROVSA-N 328.324 2.553 5 50 EFBA C[C@H]1C(c2cccs2)=[N+]([O-])[C@](C)(c2cccc([N+](=O)[O-])c2)N1O 2993761 RSYWLMKGYLYSKM-ZUZCIYMTSA-N 333.369 2.922 5 50 EFBA CC(C)OC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1 2819586 MLDIZOBDEKCDAO-UVTDQMKNSA-N 344.323 2.910 5 50 EFBA Cc1nc(N[C@@H]2CCN(C[C@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] 252512292 OWSOHGRCOGBKKM-BPLDGKMQSA-N 334.420 2.600 5 50 EFBA Cc1cc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)no1 175345833 BILGCVGCQMXWSW-UHFFFAOYSA-N 345.355 2.504 5 50 EFBA Nc1nccc2c1CN(c1ccc([N+](=O)[O-])c(OC(F)F)c1)CC2 952993038 VHKCSVRYQRFZOA-UHFFFAOYSA-N 336.298 2.736 5 50 EFBA O=c1[nH]c(O)nc(/C=C/c2cc(Cl)c(O)c(Cl)c2)c1[N+](=O)[O-] 5041550 ZISUEZROSWGJMD-OWOJBTEDSA-N 344.110 2.567 5 50 EFBA COCC[C@@](C)(O)CNc1ccc([N+](=O)[O-])cc1Br 230235505 QBLMQWVFTPFEHD-GFCCVEGCSA-N 333.182 2.557 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)N1CCOCC1 20310876 LIHICEXSMVDLNI-QGZVFWFLSA-N 341.367 2.607 5 50 EFBA O=C1[C@@H]2[C@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1C=C[C@H]2C12CC2 239309363 HKVODJLKOYCOLK-MHWZDGSBSA-N 344.754 2.950 5 50 EFBA Cc1cnccc1OC1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 278435867 VLASCCRERYPIFK-UHFFFAOYSA-N 331.328 2.575 5 50 EFBA Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)C(=O)NC(C)(C)C 170610270 ZMIBPXNLCIDURG-VIFPVBQESA-N 341.795 2.590 5 50 EFBA O=C(OCc1cc(=O)oc2ccc3ccccc3c12)c1cccc(=O)[nH]1 225842189 JKCNEFMHIUVILC-UHFFFAOYSA-N 347.326 2.992 5 50 EFBA CN(c1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12 184763282 MTWKJVSOFPBBMB-UHFFFAOYSA-N 343.364 2.968 5 50 EFBA COC(=O)c1ccc(OCc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 472258 OUPMACRBASSVLT-UHFFFAOYSA-N 347.323 2.978 5 50 EFBA O=[N+]([O-])c1ccc(N2CC(c3n[nH]c4c3COCC4)C2)c(Cl)c1 1472901857 CGVBBVRWQGAACH-UHFFFAOYSA-N 334.763 2.648 5 50 EFBA CCN(CCNc1ncc(Cl)cc1[N+](=O)[O-])CC(F)(F)F 170618753 GEVOHVZOUSXIHW-UHFFFAOYSA-N 326.706 2.939 5 50 EFBA CCc1nccn1[C@@H]1CCCN(c2c([N+](=O)[O-])c(C)nn2CC)C1 192573185 ZMLLZRYSCIOJFZ-CYBMUJFWSA-N 332.408 2.720 5 50 EFBA CCCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 2757541 ORKIWCWMTXRWJH-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H](C)C(=O)NC(C)(C)C 170610271 ZMIBPXNLCIDURG-SECBINFHSA-N 341.795 2.590 5 50 EFBA COC(=O)[C@H](CC(C)C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 303025 GXCIPISFQFCFNB-LBPRGKRZSA-N 328.752 2.566 5 50 EFBA CCOc1ccc(C(=O)NC(=S)Nc2cccnc2)cc1[N+](=O)[O-] 454447 VORNMMKTHHDCES-UHFFFAOYSA-N 346.368 2.515 5 50 EFBA O=C(N[C@@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170015382 URLBWOJVKYYXHQ-CZUORRHYSA-N 328.324 2.560 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccc(Cl)cc1 168565 FPCYRNMRPWBQHW-UHFFFAOYSA-N 326.761 2.727 5 50 EFBA O=C(NCc1ccc2c(c1)OCO2)c1ccc(Cl)cc1[N+](=O)[O-] 442551 XUDBJJYHCPRGBJ-UHFFFAOYSA-N 334.715 2.907 5 50 EFBA CCc1nnc(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])s1 279545144 MDAYPJJQVPARMQ-UHFFFAOYSA-N 344.755 2.982 5 50 EFBA Cc1ccc2[nH]/c(=N\S(=O)(=O)c3ccccc3[N+](=O)[O-])sc2c1 456728 AOYZFOFCQKQPNW-UHFFFAOYSA-N 349.393 2.736 5 50 EFBA Cc1ccc(CN2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 20367219 WBVMVHNFXMZTQH-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA CCCc1[nH]nc(C(=O)N2CC3(CC3)c3ccccc32)c1[N+](=O)[O-] 169992015 AAGQAYVPGMTETI-UHFFFAOYSA-N 326.356 2.962 5 50 EFBA C[C@H]1C(c2ccc(F)cc2)=[N+]([O-])[C@](C)(c2ccc([N+](=O)[O-])cc2)N1O 4819946 JSTIHOYGIPKDHH-APPDUMDISA-N 345.330 3.000 5 50 EFBA CCOc1nc2cc(C(=O)NCc3ccccc3[N+](=O)[O-])ccc2[nH]1 225704545 SVXZZJONGZORFD-UHFFFAOYSA-N 340.339 2.800 5 50 EFBA COC(=O)c1ccc(O)c(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 253424598 IJQRHXXCFAKQCI-UHFFFAOYSA-N 330.296 2.648 5 50 EFBA O=[N+]([O-])c1cc2c(c(CN3CCO[C@H]4CCCC[C@H]43)c1)OCOC2 230251158 KPGNJRASZDWHGY-CVEARBPZSA-N 334.372 2.605 5 50 EFBA O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CCOC2(CCCC2)C1 178430681 UFIIEWNDGQJVKY-AWEZNQCLSA-N 333.388 2.886 5 50 EFBA Cc1nc(C[C@H]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])C2)no1 194588169 VGCRNQRMOFZWGF-CYBMUJFWSA-N 344.371 2.690 5 50 EFBA Cc1cc(NC(=O)COc2ccc(C(F)(F)F)cc2[N+](=O)[O-])on1 194613851 CNHQQELFELZSNE-UHFFFAOYSA-N 345.233 2.928 5 50 EFBA C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 176730970 AQRTXXBZISOOED-APPDUMDISA-N 346.362 2.760 5 50 EFBA CN(C)c1ccnc(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1 170603297 FBDDZUXALYLNIZ-UHFFFAOYSA-N 326.356 2.649 5 50 EFBA C[C@H]1CO[C@@H](c2ccccc2)CN1c1ccc2ncc([N+](=O)[O-])n2n1 192655517 OBESSNOQVWVFME-GXTWGEPZSA-N 339.355 2.604 5 50 EFBA O=C(NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1)c1cccc(F)c1 452085 HAUHBMYDXSYBCO-UHFFFAOYSA-N 337.307 3.000 5 50 EFBA O=C1[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CCCN1c1cccnc1 253427188 XAMNOAJQHAWZFK-LBPRGKRZSA-N 347.762 2.646 5 50 EFBA CCOc1ccc2c(c1)CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)CC2 164419911 AKTMLINIPYRWDF-UHFFFAOYSA-N 342.351 2.898 5 50 EFBA CCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1C(F)(F)F 82524 QNUASRIZVSLLGS-UHFFFAOYSA-N 329.234 2.976 5 50 EFBA in-vitro COc1ccc([N+](=O)[O-])cc1NCc1cc(OC)c2c(c1)OCO2 437284 OFZHOSTZBKRYPZ-UHFFFAOYSA-N 332.312 2.953 5 50 EFBA C[C@H]1CN(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 4723273 SKVYGLPGRYWITQ-GJZGRUSLSA-N 333.432 2.668 5 50 EFBA O=C(Nc1ccc(F)cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4841936 WNXPMTJWLYVTDN-UHFFFAOYSA-N 345.330 2.823 5 50 EFBA O=C1C[C@@H](c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3[nH]c2=O)O1 4625849 REDMUAHFTKWVHR-ZDUSSCGKSA-N 336.303 2.877 5 50 EFBA N=c1c2c(=O)oc3ccccc3c2ccn1C[C@@H](O)c1cccc(O)c1 1848443032 SJDNQPAWIDBRDU-MRXNPFEDSA-N 348.358 2.666 5 50 EFBA O=[N+]([O-])c1ccc(N2CCC(Cn3ccnc3)CC2)c([N+](=O)[O-])c1 1775990893 GGBMNOJFSWDJMG-UHFFFAOYSA-N 331.332 2.616 5 50 EFBA COc1cc(C(=O)Nc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC 1121770 NTTKBUVWDKSTAL-UHFFFAOYSA-N 346.295 2.593 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCOC[C@@H]1C[C@@H](O)c1ccccc1 253421700 FFLQSCBOGPXHRI-PKOBYXMFSA-N 342.395 2.919 5 50 EFBA CO[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1O)c1ccc(F)cc1 155675749 MUJFHBUINMOFFJ-CQSZACIVSA-N 334.303 2.557 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 195324622 CJPZEPJBDPIJPU-LLVKDONJSA-N 339.351 2.889 5 50 EFBA O=[N+]([O-])c1ccc(N2CCNCC2)cc1N1CCc2ccccc2C1 4143372 BBMODURIERVVDV-UHFFFAOYSA-N 338.411 2.567 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NC23CC4CC(CC(C4)C2)C3)c1 4676369 LQQOKYOYAQULMS-UHFFFAOYSA-N 336.413 2.842 5 50 EFBA CCCc1cc(C(N)=O)c(NC(=O)c2ccc([N+](=O)[O-])cc2)s1 2789204 YSBPGQJZIYJBSP-UHFFFAOYSA-N 333.369 2.960 5 50 EFBA O=C(O)c1cc([N+](=O)[O-])ccc1-c1ccc([N+](=O)[O-])cc1C(=O)O 1717037 CDYUHLLQUAYYHD-UHFFFAOYSA-N 332.224 2.566 5 50 EFBA in-vitro O=[N+]([O-])c1ccccc1NCc1nnc2n1CC[C@@H](C(F)(F)F)C2 952992970 DQBBMYDYZJZETF-SECBINFHSA-N 341.293 2.923 5 50 EFBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H]1/C=C/c1cccs1 253418834 AMHZREZBENZSKN-FYJFLYSWSA-N 332.385 2.557 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@@H](O)Cc1ccccc1 194938007 QUMRECXUJSQNFH-CJNGLKHVSA-N 328.368 2.625 5 50 EFBA O=[N+]([O-])c1cnc2ccc(NC[C@H]3COC4(CCCCCC4)O3)nn12 302065873 UJYQLDZYLMLYQO-LBPRGKRZSA-N 347.375 2.515 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 178850 FLIUPXFFDCLVLD-LKFCYVNXSA-N 333.344 2.564 5 50 EFBA O=C(c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4614757 HLSMXSYHNYFDGR-UHFFFAOYSA-N 347.321 2.835 5 50 EFBA CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)c1cccc(F)c1 252484575 FZOICVLGYQDWTI-CQSZACIVSA-N 348.330 2.596 5 50 EFBA O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H](c2nc[nH]n2)C1 425065917 MKXNYRVHXCYPHS-VIFPVBQESA-N 343.368 2.557 5 50 EFBA CNC(=O)Cn1cc(Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)cn1 170598669 REYMCVNSPGMMMU-UHFFFAOYSA-N 344.158 2.588 5 50 EFBA CNc1nc(Nc2ccc([N+](=O)[O-])cc2)nc(OCC(F)(F)F)n1 3877360 UEXZTHUKFXWLPD-UHFFFAOYSA-N 344.253 2.506 5 50 EFBA biogenic COc1ccccc1C(=O)NC(=S)Nc1ccccc1[N+](=O)[O-] 4562292 IBEKQYHBIWDWNB-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@@]1(c2ccsc2)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O 328594273 NURUKMILUOGQSD-INIZCTEOSA-N 330.365 2.873 5 50 EFBA O=C(CSc1nncs1)Nc1ccc([N+](=O)[O-])c2ncccc12 185460086 WSYGQFGQUJBPQX-UHFFFAOYSA-N 347.381 2.725 5 50 EFBA O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccccc2[N+](=O)[O-])N1 33179 ZKQJJSPFSANANO-GDBMZVCRSA-N 337.335 2.764 5 50 EFBA biogenic CC(C)N(c1ccccc1)c1ncnc(NCCC(=O)O)c1[N+](=O)[O-] 4054708 HLLIRWAECHHIGH-UHFFFAOYSA-N 345.359 2.818 5 50 EFBA CC(C)Oc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)ccn1 157234026 ZZOZOFOAWLVQSF-UHFFFAOYSA-N 333.319 2.846 5 50 EFBA O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2 95682051 BFIMWJCWLWGDOF-UHFFFAOYSA-N 346.211 2.891 5 50 EFBA COC(=O)c1cc(F)cc(-c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1 97757117 DTCUTBAMLSGQSR-UHFFFAOYSA-N 333.271 2.974 5 50 EFBA O=C(NCCCNc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 5093817 OSFGCFKQJAJCOI-UHFFFAOYSA-N 334.763 2.875 5 50 EFBA O=C(Nc1cc([N+](=O)[O-])ccc1O)Nc1cc([N+](=O)[O-])ccc1F 25691140 XPEVLVMYRUJBJC-UHFFFAOYSA-N 336.235 2.992 5 50 EFBA Nc1ccc([N+](=O)[O-])c(NCC2CCN(CC(F)(F)F)CC2)c1 193521674 XNAKJODWBJAFNL-UHFFFAOYSA-N 332.326 2.863 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 225536380 JVDIDQUKWIFDCW-XOKHGSTOSA-N 344.392 2.749 5 50 EFBA CCc1nsc(N2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)n1 174521867 BLNWFQZPTCSFIO-UHFFFAOYSA-N 347.444 2.721 5 50 EFBA O=C1OC(c2ccc([N+](=O)[O-])cc2)=N/C1=C/c1cccc([N+](=O)[O-])c1 1735846 NUNZUZWZVYNTGT-NTEUORMPSA-N 339.263 2.848 5 50 EFBA Cn1cccc1CNC(=O)c1cccc([N+](=O)[O-])c1Br 236087653 NKOJSKQEWPIQAF-UHFFFAOYSA-N 338.161 2.626 5 50 EFBA O=[N+]([O-])c1c(N2CCN(c3ccccc3)CC2)nc2sccn12 4024473 JEOPJKIOUIMHIG-UHFFFAOYSA-N 329.385 2.631 5 50 EFBA CC(C)CCO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 170618725 CMZJANBSGSNFJD-NSHDSACASA-N 339.367 2.593 5 50 EFBA O=C(N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O)OCc1ccccc1 5059662 UORCURAKJUSAHL-HNNXBMFYSA-N 344.323 2.517 5 50 EFBA O=C1c2ccccc2C(=O)N1CCCOc1ccccc1[N+](=O)[O-] 2496361 UALDHAVULPTRMI-UHFFFAOYSA-N 326.308 2.660 5 50 EFBA CN1C(=O)CCc2cc(C(=O)COc3ccccc3[N+](=O)[O-])ccc21 155290369 BYONMTYYYDGKFZ-UHFFFAOYSA-N 340.335 2.766 5 50 EFBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ncoc1C1CCC1 1776005506 CTZQSRFNADNKTM-UHFFFAOYSA-N 327.296 2.647 5 50 EFBA CCc1ccc(Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])cc1 4759071 TVDWLDDNBLQLFK-UHFFFAOYSA-N 325.328 2.720 5 50 EFBA aggregator O=C(Nc1cc(F)c([N+](=O)[O-])cc1Br)C(F)(F)F 616568280 OYCIYCREBYIZAD-UHFFFAOYSA-N 331.019 2.997 5 50 EFBA CCc1[nH]nc(C(=O)N2CCCCc3cc(OC)ccc32)c1[N+](=O)[O-] 278301611 BXXUAHXDLQLAEV-UHFFFAOYSA-N 344.371 2.872 5 50 EFBA O=C(NCc1nnc(C2CC2)o1)c1cc2cc([N+](=O)[O-])ccc2s1 193997791 HMJIWSUQRNRAFB-UHFFFAOYSA-N 344.352 3.000 5 50 EFBA CCCCN(CCCC)S(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 5309090 CDCNQFUEFQMIBQ-UHFFFAOYSA-N 330.406 2.891 5 50 EFBA CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(O)c2)C12CCC2 160540027 BCBBIPLQKAEXOY-LSDHHAIUSA-N 334.372 2.720 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)Nc1ccccc1C(N)=O 4999182 BMQYOLDKLPNVPU-UHFFFAOYSA-N 346.368 2.511 5 50 EFBA CCOC(=O)c1c(N)sc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1C 2920944 SIVTXLSKYVOFHS-UHFFFAOYSA-N 349.368 2.976 5 50 EFBA CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 3106612 GJARFAFMBBYFFD-CQSZACIVSA-N 333.344 2.518 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C2CCCCC2)C1 206328 FISAEQLGNNVXOB-GFCCVEGCSA-N 331.372 2.715 5 50 EFBA CCOc1ccc([C@@H]2C([N+](=O)[O-])=C(C)N(C)C(=O)N2C)cc1OC 334924 APQSBIWSPAOSRK-OAHLLOKOSA-N 335.360 2.640 5 50 EFBA C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 1053567 XBRRZVRGIGMIBT-NSHDSACASA-N 328.324 2.743 5 50 EFBA C[C@H](NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1cccc([N+](=O)[O-])c1 252667911 DOATUHAKYHPWHE-QOWREQOWSA-N 333.388 2.769 5 50 EFBA N=c1c(C(N)=O)cc2[nH]c3ccccc3c2n1-c1ccc([N+](=O)[O-])cc1 334156973 IQDNTCTXWWDFDG-UHFFFAOYSA-N 347.334 2.598 5 50 EFBA C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 185453419 WPWFAQRLSSKAQX-RYUDHWBXSA-N 345.355 2.666 5 50 EFBA COc1cc(C=O)ccc1OCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 5063450 YSGATGJCRHXQLA-UHFFFAOYSA-N 344.323 2.742 5 50 EFBA N[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 195116839 FFJRCNVQFJXMOV-ZDUSSCGKSA-N 341.367 2.950 5 50 EFBA COc1ccc(NC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] 296904455 SCXUJMZHMPNDOJ-RDJZCZTQSA-N 347.371 2.779 5 50 EFBA CC(C)n1nc(O)c2c1NC(=O)CS[C@H]2c1cccc([N+](=O)[O-])c1 5686033 ARYVKDDMYXSLLM-ZDUSSCGKSA-N 348.384 2.853 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1Nc2ccccc2NC1=O 91356 GEMWUBKVDFUHNE-HNNXBMFYSA-N 340.339 2.665 5 50 EFBA Cc1cc(C(=O)N2CCN(c3cccs3)CC2)c(N)c([N+](=O)[O-])c1 137258304 ZWJWYEIGLIPQKQ-UHFFFAOYSA-N 346.412 2.509 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(n2ccnc2)CC1 122790816 CEBNQHZZVUQJBS-UHFFFAOYSA-N 345.359 2.669 5 50 EFBA CN(C)c1nc2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc2[nH]1 170617862 IWEXMUBCBHAZTL-UHFFFAOYSA-N 339.355 2.718 5 50 EFBA CN(c1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])[C@H]1CC1(C)C 225605838 HITWHFAGJRCQDC-AWEZNQCLSA-N 328.372 2.794 5 50 EFBA COC(=O)c1ccccc1Nc1ccn2c(=O)c3ccccc3nc2n1 445059 AXNBAGVOKKQQEZ-UHFFFAOYSA-N 346.346 2.773 5 50 EFBA biogenic COc1ccc(OCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 3958666 ZCOWFHUUPUAAMX-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA Cc1c(C)c(C)c(CNC(=O)Cn2ccc([N+](=O)[O-])n2)c(C)c1C 154329786 ZCGSJSOIANSVRG-UHFFFAOYSA-N 330.388 2.650 5 50 EFBA CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cc2c(cn1)OCCC2 242183952 XDDWGKMTUZETJP-UHFFFAOYSA-N 341.367 2.630 5 50 EFBA CCc1ccc(NC(=O)c2n[nH]c([N+](=O)[O-])c2Br)cc1 5615700 GJRACBRUBRWALT-UHFFFAOYSA-N 339.149 2.895 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2cccc(OCc3ccccc3)c2)N1 122560 OZIYDKVKDFPAQG-WMZOPIPTSA-N 326.352 2.862 5 50 EFBA CCOC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])s2)nc1C 4069873 NHTZLWQNDHFHHL-UHFFFAOYSA-N 341.370 2.850 5 50 EFBA N[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 261941942 NLFATLITAOYPFJ-MRXNPFEDSA-N 341.367 2.854 5 50 EFBA CCOC(=O)C1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 471586 ZIXKAXSFKIRYJL-GFCCVEGCSA-N 334.372 2.500 5 50 EFBA O=[N+]([O-])c1cc(Cl)ccc1Sc1nnc(CO)n1C1CC1 225560697 SZBQKRJILNOSBR-UHFFFAOYSA-N 326.765 2.818 5 50 EFBA Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)c([N+](=O)[O-])cc1C 239339049 LQCHEPDDRNPJCI-CVPVQDPWSA-N 338.363 2.769 5 50 EFBA COc1cc2nc(-c3ccccc3[N+](=O)[O-])oc(=O)c2cc1OC 75656 GWMVOZPZCDEBNK-UHFFFAOYSA-N 328.280 2.780 5 50 EFBA CCOC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 271762 FZWNWHIHBRASAH-UHFFFAOYSA-N 340.763 2.664 5 50 EFBA CCN1C(=O)/C(=C2\SC(=S)N=C2O)c2cc([N+](=O)[O-])ccc21 4845346 CQPCLQXICCBRRC-KTKRTIGZSA-N 335.366 2.661 5 50 EFBA C[C@H](NC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1cccc([N+](=O)[O-])c1 252667909 DOATUHAKYHPWHE-CJYSPXJISA-N 333.388 2.769 5 50 EFBA C[C@H]1CSc2ccccc2N(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 253425739 LYEFDNHWECQHOA-SNVBAGLBSA-N 332.385 2.717 5 50 EFBA O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170004976 LCPCIFRFVQYIQT-RHSMWYFYSA-N 342.351 2.808 5 50 EFBA Cc1nc(N2CC(C)(C)[C@H]2c2nccn2C2CC2)ncc1[N+](=O)[O-] 952893608 JLGNCSCHWNNDGH-CYBMUJFWSA-N 328.376 2.812 5 50 EFBA COc1ccc(-n2cnc(N)c2C(=O)c2cccc([N+](=O)[O-])c2)cc1 448113 CMNCXFJVZMACFP-UHFFFAOYSA-N 338.323 2.602 5 50 EFBA CCCC12CN3CC(CCC)(CN(C1)C3c1ccc([N+](=O)[O-])o1)C2=O 19323193 NASKTTUPRXSSRC-UHFFFAOYSA-N 347.415 2.973 5 50 EFBA biogenic O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2cccc([N+](=O)[O-])c2)N1 188513 CYXGKHWORVZUGJ-JKSUJKDBSA-N 337.335 2.764 5 50 EFBA biogenic CCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 2852358 VQGSEIRGTOLTFW-UHFFFAOYSA-N 327.340 2.987 5 50 EFBA O=C(c1ccco1)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4187747 RSVOVILEWJDBSN-UHFFFAOYSA-N 335.747 2.804 5 50 EFBA CN1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 172602826 ATSVOQPAHFMQAN-UHFFFAOYSA-N 347.396 2.630 5 50 EFBA C[C@H]1[C@H](C)CCC[C@H]1Nc1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-] 244774190 PPJJRKILMNEUBW-MBNYWOFBSA-N 331.376 2.651 5 50 EFBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](Nc2ccccc2)C1 180872399 ZBGZQXXVBKSPFV-AWEZNQCLSA-N 340.383 2.894 5 50 EFBA CCOc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)c1cccs1 252494036 NJDDTZIEPLUVDB-UHFFFAOYSA-N 334.353 2.668 5 50 EFBA Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]2c2ccc(Cl)cc2)n1 253418196 HGEMOPZVJCHNGK-LBPRGKRZSA-N 334.763 2.959 5 50 EFBA O=[N+]([O-])c1cc(I)ccc1Br 40571390 JKIQXEOUGXCWLB-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA CCCC1=C(C(=O)OCC)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 122581 ASBMZOOAHJSDTH-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA CCOc1ccccc1N1CCN(Cc2ccc([N+](=O)[O-])o2)CC1 3109320 PPCFLSGEYBBXEX-UHFFFAOYSA-N 331.372 2.909 5 50 EFBA CC(C)Cc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1C 6701154 BOGFYFVFVSKBIH-UHFFFAOYSA-N 334.401 2.897 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccnc1N(C)C 156033967 JREAYZVHWLZZNG-UHFFFAOYSA-N 329.360 2.686 5 50 EFBA O=C(Nc1ccccc1[N+](=O)[O-])c1ccc(N2C(=O)CCC2=O)cc1 4417021 FWBXFZWVJYKRDB-UHFFFAOYSA-N 339.307 2.501 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 92575 ZIBIRUTZKIEBIT-SECBINFHSA-N 338.307 2.558 5 50 EFBA COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1OC 450700 XNFKHLBUYNCGAY-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA Cc1ccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 4706809 DSGVHHRYEKIMGV-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA COc1cc(N2CCN(Cc3c(C)noc3C)CC2)ccc1[N+](=O)[O-] 266351446 JLOJZVYIPFNOHJ-UHFFFAOYSA-N 346.387 2.530 5 50 EFBA O=[N+]([O-])c1ccc(C2OCCO2)cc1CS(=O)(=O)c1ccccc1 1388713 DMJUHYKQMRYMBP-UHFFFAOYSA-N 349.364 2.614 5 50 EFBA O=C(Cc1ccncc1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 182061725 GWLIWDKYUDYRNC-UHFFFAOYSA-N 341.367 2.602 5 50 EFBA O=C(c1ccccc1-n1ccnn1)N1CCCc2c1cccc2[N+](=O)[O-] 183200844 VHLNARAVYLLNJB-UHFFFAOYSA-N 349.350 2.769 5 50 EFBA CCCn1cc(CNc2c(Br)cccc2[N+](=O)[O-])nn1 1187496646 IPNDQBUVVOWWRA-UHFFFAOYSA-N 340.181 2.971 5 50 EFBA CCOC(=O)c1ccc(Nc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 3879137 FQSBELGQFVOVMI-UHFFFAOYSA-N 332.272 2.818 5 50 EFBA COc1cccc2cc(C(=O)Nc3ccccc3[N+](=O)[O-])c(=O)oc12 4749623 NGSBQFUNJKHKJX-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA O=[N+]([O-])c1ccc(Cl)c(CN2CCCN(c3cccnn3)CC2)c1 172179005 FCSXFIVAVVGVAQ-UHFFFAOYSA-N 347.806 2.751 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC(=S)Nc1ccccn1 457303 IPWRKORVCAROEN-BQYQJAHWSA-N 328.353 2.516 5 50 EFBA O=C(Nc1nc2c(s1)CSCC2)c1cccc(O)c1[N+](=O)[O-] 376107924 YOYFLILFKRDYEP-UHFFFAOYSA-N 337.382 2.799 5 50 EFBA O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(c2ccccn2)CC1 18220278 OOCLOIGNZXGHAA-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 43067 XQQRRONJFBQGJS-LLVKDONJSA-N 343.314 2.726 5 50 EFBA O=C1C[C@@H](c2ccccc2[N+](=O)[O-])c2cc3c(cc2N1)OCCO3 427587 NOYDAFUULYHBIU-NSHDSACASA-N 326.308 2.840 5 50 EFBA COC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccc(C)cc1 4917020 SQIQLQPFCOXOHQ-WJDWOHSUSA-N 340.335 2.847 5 50 EFBA O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2cccc([N+](=O)[O-])c2)N1 188510 CYXGKHWORVZUGJ-HZPDHXFCSA-N 337.335 2.764 5 50 EFBA biogenic Cc1nc(NC(=O)c2cc(Cl)nc(N(C)C)c2)ccc1[N+](=O)[O-] 134032772 YVWCGXFXLBDNGA-UHFFFAOYSA-N 335.751 2.665 5 50 EFBA Cc1nn(C[C@H](C)C(=O)Nc2ccc(F)cc2F)c(C)c1[N+](=O)[O-] 2794561 FJDCCRPLXKXVRL-QMMMGPOBSA-N 338.314 2.961 5 50 EFBA O=C(c1cc(Cl)ccn1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188491414 VLGPAICCVBIHNE-UHFFFAOYSA-N 333.731 2.547 5 50 EFBA CCCCOc1ccc(CSc2nnc(C)n2N)cc1[N+](=O)[O-] 2064324 SUIDJXGGPPEQMO-UHFFFAOYSA-N 337.405 2.680 5 50 EFBA CC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2N)cc1 3878387 AKMJSSQJSLYZRL-UHFFFAOYSA-N 344.283 2.540 5 50 EFBA CC(C)c1nccnc1N1CCN(c2ccccc2[N+](=O)[O-])CC1 170606566 LIGGPGSDEAAMPQ-UHFFFAOYSA-N 327.388 2.835 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@](O)(c2ccc(F)cc2)C1 376474230 WEJIWGOIXGRAHF-SFHVURJKSA-N 344.342 2.776 5 50 EFBA Cc1cc(C(=O)N[C@H](C)Cc2c(C)nn(C)c2C)cc([N+](=O)[O-])c1 173436296 NJJXZHGEIWGQIY-LLVKDONJSA-N 330.388 2.615 5 50 EFBA O=C(Cc1ccc2c(c1)NC(=O)C2)Nc1cc([N+](=O)[O-])c(F)cc1F 181764247 WCPCHFKXUQQBHW-UHFFFAOYSA-N 347.277 2.549 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32 189790647 FEGPYJWMMQVZME-JTQLQIEISA-N 337.335 2.898 5 50 EFBA O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c([N+](=O)[O-])c1)C2=O 5010130 KKDCJFNOYDJTDU-UHFFFAOYSA-N 346.682 2.747 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccc(OCc3ccccc3)cc2)N1 89586 FVICUYAPMJJFFN-AEFFLSMTSA-N 326.352 2.862 5 50 EFBA C[C@@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCN(CC(F)(F)F)C1=O 241465970 NTOQFQOHKYASIZ-GWCFXTLKSA-N 345.321 2.751 5 50 EFBA O=[N+]([O-])c1cc(CN2CCN(Cc3ccccc3)CC2)ccc1O 19608607 YIVHMOLYVFAUGQ-UHFFFAOYSA-N 327.384 2.618 5 50 EFBA O=[N+]([O-])c1ccccc1N1CCC(n2c(O)nc3cccnc32)CC1 952993459 HHZCOCGNYJSKIE-UHFFFAOYSA-N 339.355 2.887 5 50 EFBA Cc1ccccc1NC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 60143 DPVQKIKQURLBTJ-ZDUSSCGKSA-N 339.351 2.895 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ccccc2F)CC1 860033 PDGUMBZXXFOAOI-UHFFFAOYSA-N 343.358 2.625 5 50 EFBA O=C(Nc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879692 WAVIJVJGPBPSPG-UHFFFAOYSA-N 326.356 2.949 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19773418 AETKLSJCHVSZJZ-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA CCN1CCC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] 279846615 DBCJYRVAZLECNE-NSHDSACASA-N 343.786 2.530 5 50 EFBA CCCCn1ccc2nc3ccn(-c4ccccn4)c(=O)c3cc2c1=O 38829419 BZDRPGZEOVXLBO-UHFFFAOYSA-N 346.390 2.896 5 50 EFBA O=C(NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1)c1cccs1 451068 JVOGIBPAHCFPFT-UHFFFAOYSA-N 325.346 2.922 5 50 EFBA CN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc(F)c1F 170659942 LBUTXFSLLKGMQF-UHFFFAOYSA-N 342.323 2.694 5 50 EFBA COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(C(=O)O)cc1OC 62951 OHWMQOYCSYCMFU-UHFFFAOYSA-N 346.295 2.563 5 50 EFBA biogenic NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ccc([N+](=O)[O-])c2cnccc12 247750697 SHTYGDASTBIUTP-KHIZAZIESA-N 340.383 2.766 5 50 EFBA Cn1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc(F)cc2)C(C)(C)C)n1 274952931 IRYPJSMEUBYAHN-UHFFFAOYSA-N 334.351 2.908 5 50 EFBA Cc1cc(OCC(=O)Nc2nnc(C3CC3)s2)ccc1[N+](=O)[O-] 1055194 RGJBFLJENHKRHN-UHFFFAOYSA-N 334.357 2.650 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](c1ccco1)N(C)C 156080933 SFHVBZKMQATBNE-AWEZNQCLSA-N 332.360 2.921 5 50 EFBA COc1ccccc1N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C1 156805088 UWTOUTDSVZDQIA-AWEZNQCLSA-N 341.367 2.612 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N(C)C2CCN(CCn3cccn3)CC2)c1 241515580 OGIJGACZOIWFLB-UHFFFAOYSA-N 343.431 2.701 5 50 EFBA O=C(c1ccccc1F)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4703760 PRHLOQUZLLYZCV-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1cnn(-c2cccnc2)c1 759346564 LVEHYEZAVDXHPE-UHFFFAOYSA-N 342.286 2.672 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ccccn2)CC1 18179248 MTPWGSFRTDJEFJ-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA C[C@H]1Oc2ccc([N+](=O)[O-])cc2N(Cc2ccc(C(=O)O)cc2)C1=O 20393140 ICHNTBRDZLOJER-SNVBAGLBSA-N 342.307 2.607 5 50 EFBA in-vitro C[C@@H]1CN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)N1 4663381 QQXPEFSDYYTWGB-HTQZYQBOSA-N 348.281 2.708 5 50 EFBA CN(C)Cc1ccccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 177274306 GYSTVZMJYSNYAN-UHFFFAOYSA-N 331.347 2.726 5 50 EFBA Cn1cnc2cc(C(=O)OCc3ccc([N+](=O)[O-])cc3Cl)cnc21 132912650 LCSYVAXHNXKRTE-UHFFFAOYSA-N 346.730 2.887 5 50 EFBA Cc1nn(C[C@H](O)COc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] 179858899 YQFTZXUIRNTXTH-VIFPVBQESA-N 346.170 2.846 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 43066 XQQRRONJFBQGJS-NSHDSACASA-N 343.314 2.726 5 50 EFBA CSc1nc(-c2ccco2)nn1C(=O)c1cccc([N+](=O)[O-])c1 618722 PTDIKULINOUNQU-UHFFFAOYSA-N 330.325 2.857 5 50 EFBA CCOC(=O)C(=CNc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC 100285163 HLSFTHUHGYPULT-UHFFFAOYSA-N 342.735 2.670 5 50 EFBA CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCCN2CC)c1 253392774 GHAOYIKVSHIVMY-CYBMUJFWSA-N 335.404 2.598 5 50 EFBA Cc1ccc([C@@H]2CCCN2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 241326151 LZPUMKDMFJOXRU-AWEZNQCLSA-N 329.356 2.932 5 50 EFBA COc1cc(C(=O)N2CCCC[C@H]2c2ncon2)cc([N+](=O)[O-])c1C 187859204 MNGSHJXIDUMNND-LBPRGKRZSA-N 346.343 2.662 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC(=S)Nc1cccnc1 456723 HFAFKGWCHYNRGW-VOTSOKGWSA-N 328.353 2.516 5 50 EFBA O=[N+]([O-])C1=C(Nc2ccc(-c3ccccc3)cc2)CS(=O)(=O)C1 297716 LNNGHBQXOPMEMS-UHFFFAOYSA-N 330.365 2.682 5 50 EFBA O=[N+]([O-])c1cc(Cl)cnc1N1CCSC2(CCOCC2)C1 241634603 PNSPBZRWKYOAIK-UHFFFAOYSA-N 329.809 2.746 5 50 EFBA O=C(OCc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(c2ccccc2)C1 282668 LXBRAFWTZVOUAU-AWEZNQCLSA-N 340.335 2.691 5 50 EFBA O=C1N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)N1Cc1ccccc1F 4698897 YDAYOEPYONIMDX-OQLLNIDSSA-N 341.298 2.827 5 50 EFBA CCn1c(SCc2cnn(C)c2)nnc1-c1ccc([N+](=O)[O-])cc1 177754858 ZNWTWGYBZHDOSV-UHFFFAOYSA-N 344.400 2.899 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCSc2ccccc2)cc1 2864299 WYMULMZNCWTNFV-UHFFFAOYSA-N 338.410 2.665 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4543863 YNSWXCVQALQQFN-UHFFFAOYSA-N 347.321 2.835 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(c2c[nH]cn2)CC1 253427406 MHIPDDPLPSVVLR-UHFFFAOYSA-N 345.359 2.738 5 50 EFBA O=C(NO[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 128220878 YUYNPIBWBMXOPB-MRXNPFEDSA-N 349.387 2.773 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1NC1CCN(Cc2ccccn2)CC1 192506540 WGGNWKKWMLEIAG-UHFFFAOYSA-N 344.419 2.591 5 50 EFBA CC(C)(C)C(=O)N1CCC(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 16649636 FVJIXDIUNJRZJI-UHFFFAOYSA-N 333.388 2.818 5 50 EFBA O=[N+]([O-])c1ccc(CN2CCN(C[C@H]3C[C@H]4C=C[C@H]3C4)CC2)cc1 100709519 XGWPXXNQWMMZDI-OKZBNKHCSA-N 327.428 2.925 5 50 EFBA O=C(NC[C@@H]1CSCCS1)c1ccc([N+](=O)[O-])c(Cl)c1 139474170 LANZFWBCNBSHKN-SECBINFHSA-N 332.834 2.827 5 50 EFBA C[C@@H](c1cccnc1)N(C(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1 225539561 AHGBDMYXCLOBPA-NSHDSACASA-N 326.356 2.938 5 50 EFBA O=[N+]([O-])c1cc(I)cc(Br)c1O 169800546 GWLUBOLLAVRTNJ-UHFFFAOYSA-N 343.902 2.668 5 50 EFBA CCOP(=O)(OCC)[C@H](OC(N)=O)c1ccc([N+](=O)[O-])cc1 3185548 AZUCIFQBAURMGE-NSHDSACASA-N 332.249 2.955 5 50 EFBA Cn1ccnc1C[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 151506939 YBZSVIKCYFZSDZ-CYBMUJFWSA-N 343.387 2.815 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCCc1cccc(Cl)c1 461456 VJYYDQDTYILRFJ-UHFFFAOYSA-N 340.788 2.769 5 50 EFBA C[C@H]1CCC[C@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 4700886 QGQQGJRYAOYXPD-YOEHRIQHSA-N 331.416 2.931 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Oc2ccccc2)CC1 4845993 YGWONPFQIKYRLQ-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA O=C(/C=C/c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 5336134 DRWMKKHVOTZMKW-IZZDOVSWSA-N 337.379 2.957 5 50 EFBA O=C(O)CNc1ccc(NC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 1741717 VTWWMRPKCQYRCS-UHFFFAOYSA-N 348.290 2.874 5 50 EFBA O=C(Nc1cccc(F)c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4841222 AWLBNKRYUYHMEB-UHFFFAOYSA-N 345.330 2.823 5 50 EFBA O=Cc1ccccc1OS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 1882872 MGHHCOKYWOBEPK-UHFFFAOYSA-N 341.728 2.828 5 50 EFBA O=C(N[C@H]1CCO[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1O 156096976 LTGFZLONZXXJLT-XJKSGUPXSA-N 328.324 2.560 5 50 EFBA C[C@H]1C[C@H]1c1ccc(CN(c2ncc([N+](=O)[O-])c(N)n2)C2CC2)o1 170620865 VROHXSZELNXUCX-JOYOIKCWSA-N 329.360 2.852 5 50 EFBA CN1C(=O)/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)N=C1S 456787 AINFHAMJUDPIHG-FLIBITNWSA-N 329.337 2.954 5 50 EFBA CCOC(=O)c1cccc(NC(=O)COc2ccccc2[N+](=O)[O-])c1 115683 CCXPWWBYWQRCGR-UHFFFAOYSA-N 344.323 2.789 5 50 EFBA CCn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(OC(F)(F)F)cc1 1001959 CMWPQHHQCWWKKV-UHFFFAOYSA-N 344.249 2.962 5 50 EFBA CC(C)c1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)n[nH]1 143602586 RCEVLPUOFBABGW-UHFFFAOYSA-N 340.343 2.879 5 50 EFBA CC(C)(NCc1ccc([N+](=O)[O-])c(F)c1)C(=O)NCC1CCCC1 253392398 SDXUJSVTIPXZEA-UHFFFAOYSA-N 337.395 2.909 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 178845 FLIUPXFFDCLVLD-XPTSAGLGSA-N 333.344 2.564 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(Br)CC1 952994846 VMHRNOCLXNVRMA-UHFFFAOYSA-N 328.166 2.952 5 50 EFBA COc1ccc(C(=O)Nc2nnc(C(F)(F)F)s2)cc1[N+](=O)[O-] 1142647 JKCDGDLTCBHBDD-UHFFFAOYSA-N 348.262 2.726 5 50 EFBA CCN(CC)CCCNc1c([N+](=O)[O-])c(=O)n(C)c2ccccc12 4833828 OFGKREGQTPSLAT-UHFFFAOYSA-N 332.404 2.591 5 50 EFBA CN(c1ncccc1[N+](=O)[O-])C1CCN(CCc2ccccn2)CC1 301133388 VJNZFYDPCAMRKS-UHFFFAOYSA-N 341.415 2.528 5 50 EFBA C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1cccs1 305726771 RQFXSVLZPJUYME-AWEZNQCLSA-N 340.788 2.947 5 50 EFBA CCN(c1cccnc1)S(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] 170611285 ZTQNMZZJERWIOF-UHFFFAOYSA-N 335.385 2.822 5 50 EFBA COC(=O)COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 5059777 DKTATQFMQKZNNJ-UHFFFAOYSA-N 344.323 2.707 5 50 EFBA CC(=O)Oc1ccc2c(=O)oc(-c3ccc([N+](=O)[O-])cc3)nc2c1 64398 LYONAYXAKCVJPW-UHFFFAOYSA-N 326.264 2.689 5 50 EFBA O=C(c1cc(C(=O)N2CCCCC2)cc([N+](=O)[O-])c1)N1CCCCC1 106666 CGEBAZQANLNPGX-UHFFFAOYSA-N 345.399 2.847 5 50 EFBA Nc1c(I)cc(Br)cc1[N+](=O)[O-] 38540927 CUVSESOKQSEEHQ-UHFFFAOYSA-N 342.918 2.544 5 50 EFBA O=C(NCCc1ccccc1)c1ccc2nc3ccccc3c(=O)n2c1 422914 MCCMUFSXCPQWFZ-UHFFFAOYSA-N 343.386 2.820 5 50 EFBA C[C@H](Nc1ccc(CNS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 170592785 FBZSDWRWSKEHKT-LBPRGKRZSA-N 349.412 2.817 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)OC12CCCCC2 93324 NYDAEDZQKQFADH-GFCCVEGCSA-N 348.355 2.808 5 50 EFBA CC(C)(C)OC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 67800464 VQQDLDPXBVJQDP-UHFFFAOYSA-N 325.340 2.791 5 50 EFBA CCOc1cc2c(cc1Cn1ccc(=O)c([N+](=O)[O-])c1)O[C@H](C)C2 131191163 WHJXKBQCUQZADO-LLVKDONJSA-N 330.340 2.527 5 50 EFBA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 245225983 COOCAAQRPUONQQ-TYNCELHUSA-N 346.387 2.987 5 50 EFBA Cc1nc(N2CC(C)(C)[C@@H]2c2nccn2C2CC2)ncc1[N+](=O)[O-] 952893611 JLGNCSCHWNNDGH-ZDUSSCGKSA-N 328.376 2.812 5 50 EFBA Cn1nc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(F)(F)Cl)cc1 4785041 MMLHOMLXHAHPFA-UHFFFAOYSA-N 346.677 2.749 5 50 EFBA COc1ccccc1C(=O)NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1 309490 ZCIBCORVWCSPHZ-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA COC(=O)[C@@H](CC(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 318307 QXISUMISAREUBS-GFCCVEGCSA-N 328.752 2.566 5 50 EFBA COc1ccccc1[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1 153021304 OENDIXWQYHVFJW-LBPRGKRZSA-N 342.351 2.939 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 195324613 CJPZEPJBDPIJPU-NSHDSACASA-N 339.351 2.889 5 50 EFBA O=[N+]([O-])c1cnc(NC[C@H]2CCC=CO2)nc1NC[C@@H]1CCC=CO1 849478417 SSGOXUVYDUJQSR-QWHCGFSZSA-N 347.375 2.594 5 50 EFBA O=[N+]([O-])c1c(N2CCC[C@@H](n3ccnn3)CC2)ccc2ncccc12 874434872 GQDIZSUSEZNCBC-CYBMUJFWSA-N 338.371 2.966 5 50 EFBA O=C(O)c1cc(Oc2ncc(Br)cn2)ccc1[N+](=O)[O-] 217319878 DUACTDGREICMAH-UHFFFAOYSA-N 340.089 2.638 5 50 EFBA COc1ccc(CCNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC 447625 NHQSYTKZMGPLTH-UHFFFAOYSA-N 344.367 2.893 5 50 EFBA Cc1ncc([N+](=O)[O-])n1Cc1cccc(I)c1 459717 BSTVQHGGYRGINA-UHFFFAOYSA-N 343.124 2.753 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 156075743 BIMUSOHLCZDSNF-CFVMTHIKSA-N 331.372 2.982 5 50 EFBA CCOC(=O)c1cc(Nc2nc3ccccn3c2[N+](=O)[O-])cn1C 760471454 HCBNWHZLFSPSHP-UHFFFAOYSA-N 329.316 2.501 5 50 EFBA COc1ccc2ccccc2c1/C=C/c1nc(O)[nH]c(=O)c1[N+](=O)[O-] 4180418 MZNLIOYOGDKVAO-BQYQJAHWSA-N 339.307 2.716 5 50 EFBA O=C(CCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)N1CCOCC1 4542660 SEDULAINAFHBSG-UHFFFAOYSA-N 330.340 2.646 5 50 EFBA Cc1sc2ncn3nc([C@@H](C)n4cc([N+](=O)[O-])cn4)nc3c2c1C 2808527 BCELRVOYYYVYLL-MRVPVSSYSA-N 343.372 2.670 5 50 EFBA O=[N+]([O-])c1ccc2nc(NCCCNc3ccccn3)nc(O)c2c1 239367345 AIJODGIODNXSPZ-UHFFFAOYSA-N 340.343 2.553 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCC[C@H](c2nccs2)C1 132160031 ZKUSZORPVKSBIH-JTQLQIEISA-N 333.369 2.777 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(F)cc2)CC1 19782455 MXARPWQKOZXTFJ-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA O=C1c2cccc3c([N+](=O)[O-])ccc(c23)C(=O)N1C[C@@H]1CCCO1 4165963 NGYYHWDFIZTGMZ-JTQLQIEISA-N 326.308 2.523 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](c1ccco1)N(C)C 156081064 SFHVBZKMQATBNE-CQSZACIVSA-N 332.360 2.921 5 50 EFBA CN1CCN(c2cc(N3CCCCCC3)c(F)cc2[N+](=O)[O-])CC1 4137911 OXHLKKWMHZCRJW-UHFFFAOYSA-N 336.411 2.866 5 50 EFBA Cc1c(NC(=O)[C@H](C)N(C)CC2CCOCC2)cccc1[N+](=O)[O-] 155910446 QKMZZWNPZWSTKI-ZDUSSCGKSA-N 335.404 2.589 5 50 EFBA COC(=O)c1sccc1NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 1055409 JNXJCNKEVORZTL-UHFFFAOYSA-N 336.325 2.704 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2)CC1 4983448 AFSFGWPLSYGHCA-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA CCO[C@@H]1C[C@@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])[C@@]12CCCO2 273521210 SAHYZSKYYWUHMV-ZACQAIPSSA-N 334.372 2.936 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@H]2c1cc([N+](=O)[O-])ccc1O 19702975 LXVNSQCSYPYNDF-CQSZACIVSA-N 331.280 2.577 5 50 EFBA biogenic Cn1c(CCNC(=O)c2cccs2)nc2cc([N+](=O)[O-])ccc21 2334417 UWFNGGZHXYWQSX-UHFFFAOYSA-N 330.369 2.516 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCOC[C@@H]1C[C@H](O)c1ccccc1 253421693 FFLQSCBOGPXHRI-HKUYNNGSSA-N 342.395 2.919 5 50 EFBA CN(c1ccc(F)cc1[N+](=O)[O-])C1CCN(c2cccnn2)CC1 253430873 MGKCQSQJEKVAEI-UHFFFAOYSA-N 331.351 2.629 5 50 EFBA Cc1nn([C@H](C)c2nc3c4ccccc4ncn3n2)c(C)c1[N+](=O)[O-] 2806312 VKGGIIDFIQGXLD-LLVKDONJSA-N 337.343 2.608 5 50 EFBA C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H](C)S1=O 357750789 URHBFOJKOMJZIL-RKDXNWHRSA-N 336.335 2.959 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 2754830 JFVCJBJLUHCTAN-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA CN1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 371528343 LCHOWKGOEIPVOA-HOTGVXAUSA-N 343.358 2.562 5 50 EFBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 181023145 YCSSSULVQXEELH-OAHLLOKOSA-N 345.330 2.530 5 50 EFBA C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nncn1C 170606513 CNKJIYBLMKNIFH-MRVPVSSYSA-N 327.291 2.540 5 50 EFBA CC(=O)Nc1ccc(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1 4371975 JXZXJHWSQKISBZ-UHFFFAOYSA-N 349.368 2.700 5 50 EFBA in-vitro O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CC(Oc2ccccc2Cl)C1 119346072 FGPLTISJEWFKHE-UHFFFAOYSA-N 348.742 2.857 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCCN2C2CC2)C1 192706342 HCGQVYVRPQXARF-HIFRSBDPSA-N 333.436 2.573 5 50 EFBA O=C(Nc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4895925 LTIFWHZSFDVJPQ-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA COc1ccc([C@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)cc1 299607501 ONEDZFFPWLRHMO-AWEZNQCLSA-N 341.367 2.815 5 50 EFBA NC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])o2)sc2c1CCCCC2 2845541 LLYIRMNTQDZPKG-UHFFFAOYSA-N 349.368 2.869 5 50 EFBA O=C1[C@@H]2[C@H](C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=C[C@H]2C12CC2 101357947 KQVNUOKAKUTQMC-MHWZDGSBSA-N 344.754 2.950 5 50 EFBA CN1CCc2c(Nc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])cccc21 170660365 WXGNIWOANLXRTD-UHFFFAOYSA-N 347.396 2.734 5 50 EFBA C[C@@H]1CCC[C@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 4700885 QGQQGJRYAOYXPD-PBHICJAKSA-N 331.416 2.931 5 50 EFBA O=C(O)C[C@@H](c1cccc([N+](=O)[O-])c1)N1Cc2ccccc2C1=O 8873502 HTIMNPHZLWCSOW-HNNXBMFYSA-N 326.308 2.767 5 50 EFBA O=C(O)CCCC(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2741923 ZOYYSHCYXQGNSB-UHFFFAOYSA-N 335.341 2.912 5 50 EFBA Cc1cc(S(=O)(=O)N2CCC(=O)c3ccccc32)ccc1[N+](=O)[O-] 178886361 KXPNYYTUIINNDJ-UHFFFAOYSA-N 346.364 2.685 5 50 EFBA COc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 194717 AUAFLPLDIXTQII-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA Cc1ccc(S(=O)(=O)Nc2ccc3c(ncn3C)c2[N+](=O)[O-])cc1 3876446 GCNOLVABVFBRPH-UHFFFAOYSA-N 346.368 2.591 5 50 EFBA Cc1ccc(C(=O)c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)cc1 4618739 MJYRMLLWMCTTIQ-UHFFFAOYSA-N 339.395 2.886 5 50 EFBA Cc1ccc([N+](=O)[O-])c(OCCn2cnc3ccccc3c2=O)c1 4869153 ODVBDDCTGKELQZ-UHFFFAOYSA-N 325.324 2.692 5 50 EFBA NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ccc([N+](=O)[O-])c2cnccc12 247750699 SHTYGDASTBIUTP-ZLENFMNRSA-N 340.383 2.766 5 50 EFBA C[C@@H]1c2ccccc2CN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 361085734 GLRQYNHPPKOBAA-CJNGLKHVSA-N 328.368 2.911 5 50 EFBA C[C@H](NS(=O)(=O)C[C@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 2325803810 CLZSGDZBCMASGW-SWLSCSKDSA-N 346.408 2.915 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4460017 HRIOMQZKVWZXFZ-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA Cc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)o2)no1 2778221 YZSKVRKJYZLRQS-UHFFFAOYSA-N 345.315 2.598 5 50 EFBA Cc1cc(C)n(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)o2)n1 2777805 TWFGDWJQQJQMSW-UHFFFAOYSA-N 343.343 2.551 5 50 EFBA Cn1c(Sc2ncc(Cl)cc2[N+](=O)[O-])nnc1-c1ccccn1 154094608 PMFKYQKCSHCWIU-UHFFFAOYSA-N 348.775 2.985 5 50 EFBA CC[C@H]1C[C@H](Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCO1 252551718 UFUAPUSRYYJGQU-PWSUYJOCSA-N 332.360 2.975 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCC[C@@H](c2nccs2)C1 132160212 ZKUSZORPVKSBIH-SNVBAGLBSA-N 333.369 2.777 5 50 EFBA COc1ccc(NC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] 296904457 SCXUJMZHMPNDOJ-WBVHZDCISA-N 347.371 2.779 5 50 EFBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H](C)S1=O 357750786 URHBFOJKOMJZIL-IUCAKERBSA-N 336.335 2.959 5 50 EFBA CC(C)OC(=O)c1ccn(Cc2cc([N+](=O)[O-])ccc2F)c(=O)c1 1875275627 IMMCLCAYAIDZBI-UHFFFAOYSA-N 334.303 2.509 5 50 EFBA C[N+]1(C)C[C@H]2CCN(c3nc(C(F)(F)F)nc4ccccc34)[C@H]2C1 1775988560 WKJGFMGXDYLVET-RISCZKNCSA-N 337.369 2.934 5 50 EFBA COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2c(Cl)cnn12 20605615 JWZCOPICDYGKLQ-UHFFFAOYSA-N 332.703 2.745 5 50 EFBA CCOC(=O)CSc1cc(F)c(C(=O)OCC)cc1[N+](=O)[O-] 149373814 VONLTXKMYDGKKG-UHFFFAOYSA-N 331.321 2.566 5 50 EFBA O=C(c1ccco1)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 5119894 HZSHWSVMPSQXHS-UHFFFAOYSA-N 335.747 2.804 5 50 EFBA Cn1ccc(NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)n1 120222196 XSVQPHXXIDJEMK-UHFFFAOYSA-N 340.137 2.735 5 50 EFBA CC(=O)N1CCN(c2nccc(C)c2[N+](=O)[O-])CC12CCCCC2 328586867 QZLBBXUVIBBMOZ-UHFFFAOYSA-N 332.404 2.670 5 50 EFBA Cc1cccc(C(=O)N2CCCN(CC3CCC3)CC2)c1[N+](=O)[O-] 328590034 XIIQMPBRBTVZQH-UHFFFAOYSA-N 331.416 2.851 5 50 EFBA Cc1cc(O)nc(N2CCC[C@H](Nc3ccc(F)cc3[N+](=O)[O-])C2)n1 1332028243 CWMCNORKBIYUPV-LBPRGKRZSA-N 347.350 2.619 5 50 EFBA O=[N+]([O-])c1c(N2CCC[C@H](n3ccnn3)CC2)ccc2ncccc12 874434874 GQDIZSUSEZNCBC-ZDUSSCGKSA-N 338.371 2.966 5 50 EFBA C[C@H](CNC(=O)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 1121171 JCHHLBASVILAJH-LLVKDONJSA-N 328.324 2.857 5 50 EFBA Cc1cccc(O)c1NS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-] 182469582 CFJFKPXEKXWBTJ-UHFFFAOYSA-N 326.305 2.549 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCc2ccccc21 4821147 CVDGJZDRWMNOAG-UHFFFAOYSA-N 341.367 2.995 5 50 EFBA O=C(Nc1ccccc1F)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4841286 GVVBUHNEONCLFA-UHFFFAOYSA-N 345.330 2.823 5 50 EFBA COC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1 5049550 ATELJVKHFJKBML-RVDMUPIBSA-N 326.308 2.539 5 50 EFBA COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 315340 KNDDEYSGQBLTQI-UHFFFAOYSA-N 346.339 2.802 5 50 EFBA O=C(Cn1c2ccccc2c2nc3ccccc3nc21)N1CCOCC1 1906917 BLULIJOGRPHHFD-UHFFFAOYSA-N 346.390 2.597 5 50 EFBA COc1ccc(NC(=S)NC(=O)c2ccccc2)c([N+](=O)[O-])c1 4299719 XCMQURIPKVDKQR-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 158429425 KNXGGYVVZCRNEQ-ZUZCIYMTSA-N 348.330 2.682 5 50 EFBA O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170004981 LCPCIFRFVQYIQT-PBHICJAKSA-N 342.351 2.808 5 50 EFBA COc1cc2c(cc1O)C[C@@H]1c3cc(O)c(OC)cc3CC[N@@+]1(C)C2 247962292 RBBVPNQTBKHOEQ-IERDGZPVSA-O 342.415 2.915 5 50 EFBA biogenic NCCNc1ccc([N+](=O)[O-])c(Sc2nc3ccccc3[nH]2)c1 4675914 DTTKLEJBWVJOTA-UHFFFAOYSA-N 329.385 2.993 5 50 EFBA aggregator C[C@@]1(F)CCN(c2ccc([N+](=O)[O-])c(N3CC[C@@](C)(F)C3)n2)C1 408391630 DUYKWJBAKNRBCE-HUUCEWRRSA-N 326.347 2.866 5 50 EFBA Cc1nc(N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)ccc1[N+](=O)[O-] 408521238 MXJANXFRARLOKG-DYVFJYSZSA-N 326.356 2.730 5 50 EFBA O=C1C[C@H](c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3[nH]c2=O)O1 4625850 REDMUAHFTKWVHR-CYBMUJFWSA-N 336.303 2.877 5 50 EFBA CC(C)[N+]1(C)[C@H]2CC[C@H]1CC(OC(=O)[C@H](CO)c1ccccc1)C2 100301743 OEXHQOGQTVQTAT-JZEGDQDVSA-N 332.464 2.854 5 50 EFBA investigational C[C@H](NC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1cccc([N+](=O)[O-])c1 252667907 DOATUHAKYHPWHE-BSLXNSKLSA-N 333.388 2.769 5 50 EFBA O=C(Nc1nnc(-c2ccccn2)s1)c1ccc(F)cc1[N+](=O)[O-] 122302216 ALURGCOAHXQKMP-UHFFFAOYSA-N 345.315 2.900 5 50 EFBA O=C(NCc1ccccc1)c1ccc2nc3ccccc3c(=O)n2c1 422913 LLYIDARIVOIETE-UHFFFAOYSA-N 329.359 2.778 5 50 EFBA O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1[C@H]2CC[C@H]1c1cncnc1C2 1119305379 LGNHHFLBDSKYBB-HZMBPMFUSA-N 344.758 2.940 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccccc2OC)cc([N+](=O)[O-])c1 60843 NSYYUZAXZYDERJ-UHFFFAOYSA-N 330.296 2.642 5 50 EFBA Cc1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)cc1[N+](=O)[O-] 63412 WGUNYQZWEYGYBM-CQSZACIVSA-N 340.339 2.665 5 50 EFBA Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2CCOC(C)(C)C2)c1F 324506684 HLWWJCATFGARLR-SECBINFHSA-N 328.315 2.869 5 50 EFBA O=C([C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 101634081 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RVSBOBULCNIGPK-UHFFFAOYSA-N 339.311 2.821 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 101237964 FAPKDRKTVSYZEC-JLJPHGGASA-N 329.400 2.541 5 50 EFBA O=[N+]([O-])c1ncn(CNc2cc(Br)cc3cccnc23)n1 32833 QXKMHLNOIVGDEA-UHFFFAOYSA-N 349.148 2.567 5 50 EFBA Cc1cc(C)c(S(=O)(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] 4263278 BSMMZTPJZDFLOQ-UHFFFAOYSA-N 332.381 2.963 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 4589353 LDPJRTBIDDJKGT-LLVKDONJSA-N 343.314 2.726 5 50 EFBA O=[N+]([O-])c1ccc(N[C@@H](CO)CN2CCCCC2)cc1C(F)(F)F 253431873 YASIPMVOASGDCI-GFCCVEGCSA-N 347.337 2.872 5 50 EFBA O=[N+]([O-])c1ccc(-n2ncc3ccc([N+](=O)[O-])cc32)c([N+](=O)[O-])c1 29749212 SQYRZYMKPQFDRB-UHFFFAOYSA-N 329.228 2.750 5 50 EFBA C[C@@H](NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1)c1ccccc1 371601 VFIALPUYBASCKA-GFCCVEGCSA-N 340.339 2.924 5 50 EFBA CCCSCc1nnc2sc(-c3ccc([N+](=O)[O-])o3)nn12 1776110980 DUUFNIJEEFFWSU-UHFFFAOYSA-N 325.375 2.997 5 50 EFBA COc1ccc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 2734033 SLHOMGHARGUKCH-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA CC(C)OC(=O)C[S@@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4819551 INWSNHNSNKURDR-QFIPXVFZSA-N 339.291 2.673 5 50 EFBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CCSC1 282034772 UBQQJEWTYSQPKN-NSHDSACASA-N 325.390 2.963 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@@H]2c1cc([N+](=O)[O-])ccc1O 19702973 LXVNSQCSYPYNDF-AWEZNQCLSA-N 331.280 2.577 5 50 EFBA biogenic CCOC(=O)c1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 183908 TYULCXNRECJWGR-UHFFFAOYSA-N 328.324 2.953 5 50 EFBA Cc1ccc(O)c(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)c1 456929 DWSJRMNQWJXSQM-UHFFFAOYSA-N 331.353 2.736 5 50 EFBA O=C(NCCc1nc2ccccc2[nH]1)c1c[nH]c2cccc([N+](=O)[O-])c12 342918214 YGRXCCCPOJQRNL-UHFFFAOYSA-N 349.350 2.925 5 50 EFBA Cc1cc(C)n2nc(Sc3ncc(Cl)cc3[N+](=O)[O-])nc2n1 153559605 PAOSWCKOTHSQFE-UHFFFAOYSA-N 336.764 2.849 5 50 EFBA O=C(Cc1c(F)cccc1Cl)N1CCc2ncc([N+](=O)[O-])cc2C1 408513825 AWLZPGBFDWKIPJ-UHFFFAOYSA-N 349.749 2.910 5 50 EFBA CCN(c1ccc(O)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 193106959 FWZNQBVPCXVSDA-UHFFFAOYSA-N 336.369 2.824 5 50 EFBA CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]nnc3c2)c1 176720630 IJBBORWAFKZZKU-UHFFFAOYSA-N 329.341 2.840 5 50 EFBA O=C(NCCN1CCc2ccccc2C1)c1ccc(F)cc1[N+](=O)[O-] 161001639 FYMDCUSLBZNQHR-UHFFFAOYSA-N 343.358 2.522 5 50 EFBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2CC=C(Cl)C[C@H]2C1=O 82564 QMBQBFXCJNMJBG-GHMZBOCLSA-N 336.731 2.626 5 50 EFBA CNc1ccc(C(=O)O[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)cc1[N+](=O)[O-] 225396959 AOBCVWJPONCFBR-TUKIKUTGSA-N 334.372 2.997 5 50 EFBA Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCN(c2cnccn2)CC1 170606578 LEFLAJKWFIBHRW-UHFFFAOYSA-N 333.779 2.673 5 50 EFBA O=C1[C@H]2[C@H](C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=C[C@H]2C12CC2 101357950 KQVNUOKAKUTQMC-DMTCVQMQSA-N 344.754 2.950 5 50 EFBA O=C(NC[C@H](O)c1cccc(F)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 762393559 RBTKLCSSGKCBHX-INIZCTEOSA-N 343.314 2.679 5 50 EFBA COc1cccc(CCNCc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 19642941 UTJFMFWYTLMBJS-UHFFFAOYSA-N 346.383 2.953 5 50 EFBA COc1cc(C(=O)NCCc2ccccc2)c([N+](=O)[O-])cc1OC 445426 ISRXJBXBOROEAT-UHFFFAOYSA-N 330.340 2.585 5 50 EFBA Cn1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C(F)(F)F)c1 170088105 NZFVGFRBVFQSNR-GFCCVEGCSA-N 342.277 2.549 5 50 EFBA O=C(c1cccs1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19790263 SCSVRNHOICUGEX-UHFFFAOYSA-N 331.397 2.614 5 50 EFBA CC[C@@]1(O)CCCN(C(=O)c2cc(C)c(Cl)c([N+](=O)[O-])c2)C1 1875279034 VCQCBOSMFUYIDA-OAHLLOKOSA-N 326.780 2.934 5 50 EFBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)c1ccncc1Br 166160928 JRZABBUCUKLQFQ-UHFFFAOYSA-N 338.117 2.710 5 50 EFBA CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccccc1[N+](=O)[O-] 67424 XSQNHMFJCYAFHC-AWEZNQCLSA-N 333.344 2.518 5 50 EFBA CCCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 2757540 ORKIWCWMTXRWJH-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA O=C(O)c1cccc([N+](=O)[O-])c1C(=O)Nc1nc2c(s1)CCCC2 2820092 ZZIXXUGCGLCHSZ-UHFFFAOYSA-N 347.352 2.881 5 50 EFBA CN(C)[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1cccs1 131652194 SFRCBKGRRLECIS-CYBMUJFWSA-N 337.376 2.828 5 50 EFBA O=[N+]([O-])c1ccc(Br)c(I)c1 1675942 AWBNZHRQRUEANT-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA Cc1ccc(S(=O)(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1 2522111 RXEOOKWGGUSHKP-UHFFFAOYSA-N 333.365 2.950 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC(Cc2cccnc2)CC1 253430636 XGCHQQBUTOETTO-UHFFFAOYSA-N 341.367 2.790 5 50 EFBA CCN(CC)CCCN1C(=O)CS[C@@H]1c1ccc([N+](=O)[O-])cc1 4905978 GPZPZGUHULWJHF-MRXNPFEDSA-N 337.445 2.901 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 156075970 BIMUSOHLCZDSNF-YUELXQCFSA-N 331.372 2.982 5 50 EFBA CCO[C@@H]1C[C@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])[C@]12CCCO2 273521206 SAHYZSKYYWUHMV-GVDBMIGSSA-N 334.372 2.936 5 50 EFBA C[C@H](NC(=O)Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1)c1cccs1 170596263 UWTMDNYZEXIMJN-ZETCQYMHSA-N 348.306 2.749 5 50 EFBA O=C(O)c1ccc(Nc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 104233813 IFFWELKVXWIAJA-UHFFFAOYSA-N 348.227 2.853 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 195680 LTFWCPVQIQEGIE-HNNXBMFYSA-N 347.371 2.764 5 50 EFBA C[C@H](CO)N(C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 305272383 UGMKCIDNGAXHCL-GFCCVEGCSA-N 329.356 2.791 5 50 EFBA O=C(Nc1nc2ccccc2c(=O)s1)c1ccc([N+](=O)[O-])cc1 119520 SIVDDGRUZWVGDO-UHFFFAOYSA-N 327.321 2.817 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCCSc1ccccc1 2979133 FCUMALQWXSSQMS-UHFFFAOYSA-N 338.410 2.665 5 50 EFBA CCN(CC)CC(=O)Nc1ccc(Br)cc1[N+](=O)[O-] 4986514 IREDVDPOTNGHLJ-UHFFFAOYSA-N 330.182 2.638 5 50 EFBA CCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)c2ccccc21 170605052 RULCZPMRMNGUNI-UHFFFAOYSA-N 326.356 2.664 5 50 EFBA CCCC1=C(C(=O)OCC)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 178974 GHSUJHCDAYGKDF-CQSZACIVSA-N 333.344 2.566 5 50 EFBA O=C1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)O1 4845675 VSUVQNJWUMYAEJ-GDBMZVCRSA-N 326.308 2.838 5 50 EFBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H]1c1nc(-c2ccccc2F)c[nH]1 247406244 OOXVDISTURBKJW-BYCMXARLSA-N 344.346 2.545 5 50 EFBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cccc(C(F)(F)F)c1 1428937 HCZCGJCMBCSFDO-UHFFFAOYSA-N 328.250 2.757 5 50 EFBA O=[N+]([O-])c1ccsc1N1CCn2c(nnc2-c2ccccc2)C1 170591810 RMXIPBUHBFGYIA-UHFFFAOYSA-N 327.369 2.935 5 50 EFBA O=C(c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4117311 XIWWFTZTOJYMOE-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA COc1ccc2[nH]/c(=N\C(=O)c3ccccc3[N+](=O)[O-])sc2c1 1828465 VAUWYBKCJGMCHA-UHFFFAOYSA-N 329.337 2.887 5 50 EFBA COc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 454511 UKKOCWWIDBNGHY-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA O=C(Cc1ccccc1)NC(=S)Nc1cc([N+](=O)[O-])ccc1F 456216 SYIYKBXUUWWMLG-UHFFFAOYSA-N 333.344 2.790 5 50 EFBA Cc1ccc(CN2CC[C@H](NCc3ccc([N+](=O)[O-])cc3)C2=O)cc1 191800065 KEEXORRYOXDWNV-SFHVURJKSA-N 339.395 2.794 5 50 EFBA C[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 472072 SVKLHSXCUXYCSI-NSHDSACASA-N 328.324 2.743 5 50 EFBA COc1ccccc1CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 55543570 BZSACAOQQXTFDY-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA Cc1cc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2)n[nH]1 426910423 YLVMVHUMDVWPMM-UHFFFAOYSA-N 327.300 2.999 5 50 EFBA CSCc1cccc(-c2noc(-c3nn(C)cc3[N+](=O)[O-])n2)c1 328593895 XBXNMXCPPLXOGO-UHFFFAOYSA-N 331.357 2.908 5 50 EFBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](Nc2ccccc2)C1 180872385 ZBGZQXXVBKSPFV-CQSZACIVSA-N 340.383 2.894 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4913541 JOCJVSAELAYKKM-AWEZNQCLSA-N 344.367 2.958 5 50 EFBA Cc1cnc(N[C@H](CC(N)=O)c2cccc(Cl)c2)c([N+](=O)[O-])c1 175780957 LBBNPSRLSYBHAQ-GFCCVEGCSA-N 334.763 2.980 5 50 EFBA O=[N+]([O-])c1ccc([C@@]2(O)C[n+]3ccccc3N2c2ccccc2)cc1 5738299 DJWJJKIPJFKNNF-IBGZPJMESA-N 334.355 2.879 5 50 EFBA O=C1CCCC[C@H]1[C@@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] 170657204 IMHIMCXVBUVGCO-ZFWWWQNUSA-N 345.399 2.757 5 50 EFBA O=[N+]([O-])c1ccc(NC2CC(Cn3ccnn3)C2)cc1OC(F)F 1875289387 NXWRUBOWQWQDTA-UHFFFAOYSA-N 339.302 2.678 5 50 EFBA COC(=O)c1cc(C(=O)Nc2cc(F)cc(F)c2)cc([N+](=O)[O-])c1 4814507 JXCZXCIEBDXHSR-UHFFFAOYSA-N 336.250 2.912 5 50 EFBA O=C(O)C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 4049754 ZFLLNZBCNFTDJA-UHFFFAOYSA-N 329.150 2.658 5 50 EFBA O=C(c1cc([N+](=O)[O-])cnc1O)N1CC[C@@H](Cc2ccc(F)cc2)C1 129304473 HYGISDWJMJKYGU-LBPRGKRZSA-N 345.330 2.539 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(CN(C)C)c1 194384990 KGFSWPSYPIBXEI-UHFFFAOYSA-N 327.384 2.895 5 50 EFBA Cc1cccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 4895951 OCXZPKWOFNBXNF-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC2(CC1)OCCO2 15443353 HRGPJHCEEHVJCM-UHFFFAOYSA-N 332.278 2.957 5 50 EFBA Cc1cc(N[C@H](CC(N)=O)c2cccc(Cl)c2)ncc1[N+](=O)[O-] 175780878 OFJZQEKMAFNNAW-GFCCVEGCSA-N 334.763 2.980 5 50 EFBA C[C@@H]1C[C@H]1c1ccc(CN(c2ncc([N+](=O)[O-])c(N)n2)C2CC2)o1 170620864 VROHXSZELNXUCX-BXKDBHETSA-N 329.360 2.852 5 50 EFBA COc1ccccc1N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 283431 FTTSWYYELKOFGI-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA Cn1c(COc2ccccc2)nnc1Sc1ncccc1[N+](=O)[O-] 152341899 SPCACEONCOVTPX-UHFFFAOYSA-N 343.368 2.849 5 50 EFBA Cn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1 615102 SECFUPLDDVQPIH-UHFFFAOYSA-N 344.352 2.958 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1-c1ccc([C@H]2N[C@@H](C(=O)O)CS2)o1 4974172 FWYBBEHLFYFMNJ-RISCZKNCSA-N 334.353 2.951 5 50 EFBA CN(CCOc1cccc(Cl)c1)c1cccc(C(N)=O)c1[N+](=O)[O-] 225537297 AGGDAYOSZZRWDQ-UHFFFAOYSA-N 349.774 2.862 5 50 EFBA COc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])c(OC)c1 115666 OMIQXZKVTTXXDI-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA CN(C)[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 160101359 FTMNMCXTQRNXOF-SNVBAGLBSA-N 346.309 2.781 5 50 EFBA NCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] 5102326 OLIXKYRWXVVHFS-UHFFFAOYSA-N 334.763 2.871 5 50 EFBA O=C(C[C@]1(O)C(=O)Nc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 312425 HHFRTRAUPLVFSG-MRXNPFEDSA-N 346.726 2.661 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N2CC[C@H](OCc3c(C)noc3C)C2)n1 368769277 GGMMJVNEXTYDLS-ZDUSSCGKSA-N 332.360 2.699 5 50 EFBA O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(Br)ccn1 123790761 AHBZMVYEULMDSI-UHFFFAOYSA-N 336.145 2.934 5 50 EFBA O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC(c2nccs2)CC1 328586501 OMEXDQPDIXKWOO-UHFFFAOYSA-N 347.396 2.836 5 50 EFBA CC(=O)Nc1cc2c(cc1[N+](=O)[O-])-c1ccc([N+](=O)[O-])cc1C2=O 4578045 AAGDPOKIFBYAMI-UHFFFAOYSA-N 327.252 2.673 5 50 EFBA in-vitro COc1ccccc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 263447 BJBHMYPRZCQSMI-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=[N+]([O-])[C@@H]1CS(=O)(=O)C=C1N(Cc1ccccc1)c1ccccc1 1229185 UBKKTSOMBTWEMY-QGZVFWFLSA-N 344.392 2.608 5 50 EFBA O=C1CCCC[C@@H]1[C@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] 170657206 IMHIMCXVBUVGCO-UKRRQHHQSA-N 345.399 2.757 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1ccccc1F 4089213 QGPHWTZYVHURGY-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)[C@H]1CCN(CC(F)(F)F)C1=O 248028088 HDCXRACGNUECSA-GWCFXTLKSA-N 345.321 2.751 5 50 EFBA Cc1nc(NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)sc1C 2763858 ILIBGORPQPXWRH-UHFFFAOYSA-N 347.356 2.758 5 50 EFBA CC1(C)[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@H]2CCO[C@H]21 230191561 KBZULBQZHGSTSD-VCTAVGKDSA-N 329.356 2.619 5 50 EFBA CCOC(=O)N(CC(C)(C)CN(C)C)c1ncc([N+](=O)[O-])s1 96027564 XCFDNIAWAALXOW-UHFFFAOYSA-N 330.410 2.602 5 50 EFBA NC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(-c2ccccc2)on1 170604184 TWAJLMBPSNJGDY-UHFFFAOYSA-N 338.323 2.961 5 50 EFBA C[S@](=O)(=NC(=O)c1ccc(N)cc1[N+](=O)[O-])c1ccc(F)cc1 2325874571 RXEZVMWVUKTKHM-HSZRJFAPSA-N 337.332 2.613 5 50 EFBA CC[C@@H](Sc1nnc(N)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 2846976 YUFCRDNYHIUNRO-SECBINFHSA-N 339.402 2.538 5 50 EFBA CC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 3131891 REHINTBMIJRTTH-UHFFFAOYSA-N 329.268 2.958 5 50 EFBA O=C(Nc1cc(Br)cc([N+](=O)[O-])c1F)C(F)(F)F 261493642 GLHPHSPUDVRJHW-UHFFFAOYSA-N 331.019 2.997 5 50 EFBA O=C1[C@@H]2[C@@H](C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=C[C@H]2CC1 100063704 FCYQQISDGGSKJH-WBRVRECLSA-N 332.743 2.950 5 50 EFBA O=c1c2ccccc2ncn1CCCOc1ccccc1[N+](=O)[O-] 2863007 JMWNHLYIMOPCLV-UHFFFAOYSA-N 325.324 2.774 5 50 EFBA Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 4873321 SRBKUSPEHKAVCJ-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA O=C(Nc1nnc(C(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1F 124961931 PITARQVVIBCTEE-UHFFFAOYSA-N 336.226 2.857 5 50 EFBA O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 291679 HJCXAUYALIHUDI-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA COc1cc(C(=O)Nc2ccccc2[N+](=O)[O-])cc(OC)c1OC 4542907 IOCPUJWWSZIRFU-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@@H]4CCCC[C@H]43)n2)cc1 230127013 PIFZXIRJQRRKHS-HUUCEWRRSA-N 344.371 2.788 5 50 EFBA COc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4359316 XMFFZHHWNRXFDP-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA CN1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 371528345 LCHOWKGOEIPVOA-JKSUJKDBSA-N 343.358 2.562 5 50 EFBA CCC12CN3CC(CC)(CN(C1)C3c1ccccc1[N+](=O)[O-])C2=O 19319809 OMAOQWWJLFXQEG-UHFFFAOYSA-N 329.400 2.600 5 50 EFBA biogenic COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1NC(C)=O 616249 SSDPYCCYMZASGA-UHFFFAOYSA-N 329.312 2.814 5 50 EFBA CC1CCN(c2ccc(C(=O)NC[C@@H]3CCCO3)cc2[N+](=O)[O-])CC1 4865811 WSNLFQMWPPFLTE-HNNXBMFYSA-N 347.415 2.740 5 50 EFBA O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCO[C@H](Cc2ccccc2)C1 182155421 GUAGRGKBPAYZEB-OAHLLOKOSA-N 344.342 2.818 5 50 EFBA COc1ccc(NC(=O)CSc2nc(C)cc(C)n2)c([N+](=O)[O-])c1 4976357 AHGYZQNMLUGDMU-UHFFFAOYSA-N 348.384 2.741 5 50 EFBA COc1cccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 54992641 WCUGAMVZHSLFPF-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 248382575 XKTWUTBUVVGIFI-IKOXMDCHSA-N 333.388 2.698 5 50 EFBA COc1cc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1O 19536095 NGAHQDWSKCZGCB-UHFFFAOYSA-N 343.383 2.631 5 50 EFBA O=C(Nc1cc(-c2cccnc2)on1)c1ccc([N+](=O)[O-])cc1O 225467773 IUXQHLVTYXCLHD-UHFFFAOYSA-N 326.268 2.603 5 50 EFBA Cc1cccc(C(=O)N2CCC(c3ccnn3C)CC2)c1[N+](=O)[O-] 124342892 ISVPKOPEYGQAOJ-UHFFFAOYSA-N 328.372 2.657 5 50 EFBA C[C@@H]1COCCN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 160279512 YHBRXNHVCGRHSX-MRVPVSSYSA-N 333.266 2.866 5 50 EFBA COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cn(C)nc1C(C)(C)C 179462871 QHWVXCWANOAVMI-UHFFFAOYSA-N 346.387 2.564 5 50 EFBA C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)no1 864060652 JYGBYAIPUQYWLR-LURJTMIESA-N 345.237 2.879 5 50 EFBA Cc1ccc(S(=O)(=O)c2ccc3nsnc3c2[N+](=O)[O-])cc1 1431914 OXRDDZNUTMKRKU-UHFFFAOYSA-N 335.366 2.741 5 50 EFBA CC[S@](=O)[C@@H]1CCC[C@@H](NCc2ccc([N+](=O)[O-])c(OC)c2)C1 222140502 HMZRGKHIUYOPBT-CSTKLKAISA-N 340.445 2.773 5 50 EFBA CC(C)=C[C@@H]1[C@H](C(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C 229723498 WSRPVXWYCYEVRX-BZUAXINKSA-N 332.400 2.983 5 50 EFBA c1ccc2c(c1)c1ccccc1n2C[C@@H]1C[N+]23CCO[B-]2(OCC3)O1 195796548 DXMWLFUTGSBSNH-ZFAMOUDISA-N 336.200 2.506 5 50 EFBA COc1cccc(NC2CCN(C(=O)c3ccco3)CC2)c1[N+](=O)[O-] 185147557 RNTASANWANXDCQ-UHFFFAOYSA-N 345.355 2.913 5 50 EFBA CC[C@@H](C)n1ncc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1C 408515779 HZODIRVXRBGIFR-SNVBAGLBSA-N 338.389 2.872 5 50 EFBA COc1cccc(N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1 55142275 FSMUEZBBKSWSFQ-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]2C[C@H]1[C@@H]1CCC[C@H]21 247362512 ZZUHCLYKPZDJLG-ARILJUKYSA-N 330.384 2.915 5 50 EFBA O=C(N[C@@H]1CCCOc2c1ccc1ccccc21)[C@H]1C[C@H]1[N+](=O)[O-] 225412359 PMSAOCVUKADPJK-ARFHVFGLSA-N 326.352 2.835 5 50 EFBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc2nsnc12 104112 FXLOVZZYRYOXGZ-UHFFFAOYSA-N 330.325 2.617 5 50 EFBA CC(C)n1nnnc1-c1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1 184557735 ALNYRQPPKOZHFG-UHFFFAOYSA-N 342.315 2.675 5 50 EFBA O=C(Cc1nc2ccc([N+](=O)[O-])cc2nc1O)c1ccc(F)cc1 13212122 XLLDQCRLRDOSRL-UHFFFAOYSA-N 327.271 2.808 5 50 EFBA CN1CC[C@@H]2CN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@@H]2C1 864090827 ANQPOCTWGBIJAX-CABCVRRESA-N 342.399 2.633 5 50 EFBA Cc1nn(C[C@@H](O)c2ccc(F)c(Br)c2)cc1[N+](=O)[O-] 185069205 LYNZSYUJEIJPIT-GFCCVEGCSA-N 344.140 2.735 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cnc3ccccc3c2)cc1 371769 LKRHMKMFRULZMI-UHFFFAOYSA-N 329.337 2.944 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 100037358 ZXCNQOYCWGNIOG-UHFFFAOYSA-N 346.255 2.972 5 50 EFBA COc1cc(C(=O)Nc2nc3ccc(Cl)cn3n2)ccc1[N+](=O)[O-] 157105440 DMLLSSFIPBUCQR-UHFFFAOYSA-N 347.718 2.552 5 50 EFBA CCC(=O)c1cccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 135394667 RUFWBJOKAJLFND-UHFFFAOYSA-N 334.353 2.988 5 50 EFBA CNc1nc(Nc2cccc([N+](=O)[O-])c2)nc(OCC(F)(F)F)n1 448972 GRCMGAZXDNUMRB-UHFFFAOYSA-N 344.253 2.506 5 50 EFBA biogenic COC[C@@H](Cn1nccc1[N+](=O)[O-])c1ccc(Br)cc1 450813684 SRGLJGNWSRBUTD-LLVKDONJSA-N 340.177 2.984 5 50 EFBA NC(=S)Nc1nc(-c2cccc([N+](=O)[O-])c2)cc(C(F)(F)F)n1 390824158 JMXVAAQTUJHLGB-UHFFFAOYSA-N 343.290 2.726 5 50 EFBA CCc1nc2ccccc2n1C[C@@H](O)COc1ccc([N+](=O)[O-])cc1 4043157 BSKGLBYLEXISQI-CQSZACIVSA-N 341.367 2.947 5 50 EFBA Cc1cnc2c(c1)N(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)CCO2 253417157 GERIOSKDRWYBEC-UHFFFAOYSA-N 333.731 2.991 5 50 EFBA CC1(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])Cc2ccccc2C1 170078824 AFSAHJIRFFJSMY-UHFFFAOYSA-N 346.408 2.572 5 50 EFBA Cc1n[nH]c2cc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc12 194656233 IJKKOJJBAQVPAE-UHFFFAOYSA-N 332.341 2.580 5 50 EFBA COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1OC 68236 BADQIKJTTFPFML-UHFFFAOYSA-N 344.367 2.893 5 50 EFBA CCOC(=O)c1ccccc1NC(=O)Cc1ccccc1[N+](=O)[O-] 183919 GPDMNXMEUJFZDE-UHFFFAOYSA-N 328.324 2.953 5 50 EFBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](O)(c2ccccc2)C1 436056 HYFAVSSJUUIBLV-QGZVFWFLSA-N 325.324 2.662 5 50 EFBA CCc1n[nH]c([C@H]2CN(c3ccc(Cl)cc3[N+](=O)[O-])CCO2)n1 276260935 SKIDIMSETPQPOC-GFCCVEGCSA-N 337.767 2.507 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccc(F)c(F)c2)cc([N+](=O)[O-])c1 5023667 LUVUQJRBZYBKSD-UHFFFAOYSA-N 336.250 2.912 5 50 EFBA Cc1nn(C(F)F)c(C)c1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2325699947 SLEFROCUSJXKHB-UHFFFAOYSA-N 346.315 2.604 5 50 EFBA O=C(Cc1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4599853 NNOOCVHLWVYJFW-UHFFFAOYSA-N 331.397 2.548 5 50 EFBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(Br)c2)n1 2763877 YSPYXXCGUQAIHF-UHFFFAOYSA-N 339.149 2.826 5 50 EFBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2F)C1 164497444 YRRLBEPZYWCOKJ-INIZCTEOSA-N 346.314 2.653 5 50 EFBA O=[N+]([O-])c1ccc2nnn(OCc3ccc(Br)cc3)c2c1 78556 YANWGUZFTSETGK-UHFFFAOYSA-N 349.144 2.731 5 50 EFBA Cc1cc(OCCn2cnc3ccccc3c2=O)ccc1[N+](=O)[O-] 311488 VGGHTKCNCQMTAB-UHFFFAOYSA-N 325.324 2.692 5 50 EFBA CCc1nc(C)cn1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 367799 GJTJFBHITMENPA-UHFFFAOYSA-N 329.765 2.553 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4187689 OYCPRFOOECQZKC-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCS[C@@H]2CCCC[C@H]21 176235556 QNBIZEJMWPGFRW-ZIAGYGMSSA-N 346.412 2.971 5 50 EFBA CO[C@H](C)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Br 188372032 QFIJHOSFRBCXEO-JGVFFNPUSA-N 331.166 2.511 5 50 EFBA Cc1ccc(C(=O)COC(=O)c2c(C)cc(=O)oc2C)cc1[N+](=O)[O-] 83615 UBADWQUUVXVQHN-UHFFFAOYSA-N 345.307 2.513 5 50 EFBA Cc1ncc([N+](=O)[O-])n1Cc1ccc(I)cc1 465161 VQJBKTXOSNWGLM-UHFFFAOYSA-N 343.124 2.753 5 50 EFBA O=C(Nc1cccc(F)c1)OC1CN(c2ncccc2[N+](=O)[O-])C1 225814980 TVGUWGZJNUVXRW-UHFFFAOYSA-N 332.291 2.566 5 50 EFBA Cn1c(-c2cccc([N+](=O)[O-])c2)cn(CC(=O)c2ccccc2)c1=N 334157512 DXGCGWSYXAETCM-UHFFFAOYSA-N 336.351 2.764 5 50 EFBA Nc1c(I)cc(C(F)(F)F)cc1[N+](=O)[O-] 43828065 XVVSZOLVVQYKIK-UHFFFAOYSA-N 332.019 2.800 5 50 EFBA in-vitro O=C(N[C@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170015389 URLBWOJVKYYXHQ-XJKSGUPXSA-N 328.324 2.560 5 50 EFBA COc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1[N+](=O)[O-] 3893536 DZMAYBRPHAAHBD-UHFFFAOYSA-N 348.380 2.745 5 50 EFBA Cc1ccc(NC(=O)c2ccc(N3CCNCC3)c([N+](=O)[O-])c2)cc1 4706736 NLASTHSSZNQDCU-UHFFFAOYSA-N 340.383 2.565 5 50 EFBA Cc1cc(C)cc(C(=O)N2CCN(c3ncc([N+](=O)[O-])s3)CC2)c1 252495382 OPIQYNOXXVXHRM-UHFFFAOYSA-N 346.412 2.631 5 50 EFBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(=Cc2ccc(F)c(F)c2)CC1 328587841 AKDVFXLRJKVNMB-UHFFFAOYSA-N 348.309 2.916 5 50 EFBA Cc1nn([C@@H](C)C(=O)N2CCCc3ccccc32)c(C)c1[N+](=O)[O-] 1068511 KUAFTSNQOQQASR-ZDUSSCGKSA-N 328.372 2.949 5 50 EFBA Cc1ccc(CN(C)C)cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 154036189 NSVNFGMXKBRQHF-UHFFFAOYSA-N 349.412 2.766 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1nc(C(C)C)co1 1875279126 NOYKATOCRDBODZ-UHFFFAOYSA-N 325.346 2.815 5 50 EFBA COCCn1cc(OC(C)=O)c2c1nc(C)n1c3ccccc3nc21 8617887 XBIZTQOSVURFEZ-UHFFFAOYSA-N 338.367 2.717 5 50 EFBA O=C(O)c1ccccc1Nc1ccn2c(=O)c3ccccc3nc2n1 338332 HOSTXHKWYSIHAN-UHFFFAOYSA-N 332.319 2.685 5 50 EFBA in-vitro C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCOC1 247147665 UCNIGMZVYJKQCS-VXGBXAGGSA-N 332.360 2.674 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCCC(F)(F)F 266466001 ROWMIHHGMIBTFH-UHFFFAOYSA-N 326.296 2.524 5 50 EFBA Nc1c(I)cc([N+](=O)[O-])cc1C(F)(F)F 43828159 BIBLFYZKPGWXNN-UHFFFAOYSA-N 332.019 2.800 5 50 EFBA O=[N+]([O-])c1ccc2c(c1N1CCC(OC[C@H]3CCCO3)CC1)CCN2 225513098 DBWSICBIIGMAGG-CQSZACIVSA-N 347.415 2.727 5 50 EFBA CC(=O)c1ccc(N2CCCN(c3ccccn3)CC2)c([N+](=O)[O-])c1 302125532 AHUMEOBCIGRDRK-UHFFFAOYSA-N 340.383 2.909 5 50 EFBA O=[N+]([O-])c1cc(S(=O)(=O)N2CC3(CC3)c3ccccc32)ccc1O 170635327 FTGQXIXOASSAJH-UHFFFAOYSA-N 346.364 2.541 5 50 EFBA CC(=O)Oc1ccc2nc(-c3ccc([N+](=O)[O-])c(C)c3)oc(=O)c2c1 79469 QFRGPFBWNWFFMP-UHFFFAOYSA-N 340.291 2.997 5 50 EFBA COc1cc(C(=O)N2CCc3ccccc32)c([N+](=O)[O-])cc1OC 4121081 PEZCNBSJEGWHNE-UHFFFAOYSA-N 328.324 2.815 5 50 EFBA CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 456473 RZWRPUYOFHNSMR-SNVBAGLBSA-N 340.763 2.664 5 50 EFBA O=C(O)CCCNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 3878915 ZBQGZSQEIRVUIW-UHFFFAOYSA-N 337.210 2.799 5 50 EFBA Cc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 19210258 AJYXPXBNHHDDHV-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA CC(=O)c1ccc(N2CCN(Cc3ccc([N+](=O)[O-])o3)CC2)cc1 3880543 FZSRMKHMRAJRJO-UHFFFAOYSA-N 329.356 2.713 5 50 EFBA CCc1n[nH]c([C@@H]2CN(c3ccc(Cl)cc3[N+](=O)[O-])CCO2)n1 276260941 SKIDIMSETPQPOC-LBPRGKRZSA-N 337.767 2.507 5 50 EFBA Cn1cccc1[C@H]1COCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 170613492 MUWHJRPLAPZZCT-OAHLLOKOSA-N 330.344 2.539 5 50 EFBA Cc1oc(-c2ccccc2)nc1CCNc1c([N+](=O)[O-])ncn1C 1775986200 KXRJRJQKGDTNBO-UHFFFAOYSA-N 327.344 2.946 5 50 EFBA O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CCOC2(CCCC2)C1 178430667 UFIIEWNDGQJVKY-CQSZACIVSA-N 333.388 2.886 5 50 EFBA O=C(CSc1nc2n(n1)CCCCC2)c1ccc([N+](=O)[O-])cc1 5894146 MEHMWHMYPCRPQN-UHFFFAOYSA-N 332.385 2.888 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cccc(Cl)c2)cc1 474173 XPGXQHGCSABWPY-UHFFFAOYSA-N 340.788 2.769 5 50 EFBA O=C(COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 2810077 GNRJHGRESCWDFA-UHFFFAOYSA-N 330.252 2.543 5 50 EFBA O=C1CCC(=O)N1CCn1c2ccccc2c2nc3ccccc3nc21 4744633 ODKHPUSMVZAREY-UHFFFAOYSA-N 344.374 2.887 5 50 EFBA Nc1ccc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] 158527841 BNVCJUDCMGXASV-RHSMWYFYSA-N 341.367 2.827 5 50 EFBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(OC(F)(F)Cl)cc1 4753773 SODXMBZIJOERIS-UHFFFAOYSA-N 346.677 2.598 5 50 EFBA Cc1ccc(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4674104 FAEUCHLEAYHNHN-UHFFFAOYSA-N 339.395 2.795 5 50 EFBA CCOc1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1C(=O)O 4844888 HKVSTSXBFCLMLH-UHFFFAOYSA-N 330.296 2.944 5 50 EFBA COc1ccc(C(=O)Nc2ccc(NC(C)=O)cc2)cc1[N+](=O)[O-] 291660 MDNJPDFLIUYIKG-UHFFFAOYSA-N 329.312 2.814 5 50 EFBA CCN(CC)c1ccc2c(C)c(C[N+]3(C)CCOCC3)c(=O)oc2c1 4421890 QBXSFBPPAXGLDN-UHFFFAOYSA-N 345.463 2.924 5 50 EFBA O=[N+]([O-])c1ccc(-c2nc(Cc3nnc4n3CCCCC4)no2)cc1 225588430 GRHZBVPXTLIGRI-UHFFFAOYSA-N 340.343 2.554 5 50 EFBA COCCOc1ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc1F 294377103 CMOGMETVJHAQIP-UHFFFAOYSA-N 328.340 2.625 5 50 EFBA NC(=O)c1cccc(CCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 192981230 DJNLHMSZFXHTPF-GOSISDBHSA-N 339.395 2.903 5 50 EFBA O=C(c1ccccc1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19773722 ZAMXHFFCXNWACY-UHFFFAOYSA-N 325.368 2.553 5 50 EFBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CCOc1ccc(Cl)cc1 1163469 CMMVGGYNBIQLPI-UHFFFAOYSA-N 346.726 2.923 5 50 EFBA Cc1cccc([C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2O)n1 119313905 ISKOHOSMFBHSBC-AWEZNQCLSA-N 327.340 2.981 5 50 EFBA O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCO2)CC1 170603456 LUDNXBICKHAVMS-QGZVFWFLSA-N 332.400 2.945 5 50 EFBA COC(=O)c1cccc([N+](=O)[O-])c1CS(=O)(=O)c1ccc(C)cc1 1385127 FOSOLKNODPTFTE-UHFFFAOYSA-N 349.364 2.664 5 50 EFBA CS(=O)(=O)Cc1ccccc1NCCc1ccc([N+](=O)[O-])cc1 184431399 QQMJAYVLGMVSLJ-UHFFFAOYSA-N 334.397 2.794 5 50 EFBA C[C@@H]1C[C@@H]1c1ccc(CN(c2ncc([N+](=O)[O-])c(N)n2)C2CC2)o1 170620862 VROHXSZELNXUCX-SKDRFNHKSA-N 329.360 2.852 5 50 EFBA O=C(Nc1nnc(-c2cccnc2)s1)c1ccc([N+](=O)[O-])cc1 9349920 KBLXMCJSGCTWJN-UHFFFAOYSA-N 327.325 2.761 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(Cl)ccc2O)cc1 313082 MNLPPKCNYSFLRZ-UHFFFAOYSA-N 328.733 2.755 5 50 EFBA CC(C)[N@@+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)[C@@H](CO)c1ccccc1)C2 250576037 OEXHQOGQTVQTAT-RVDAZCDBSA-N 332.464 2.854 5 50 EFBA in-vitro O=[N+]([O-])c1cc2sc(=NCc3cnns3)[nH]c2cc1Cl 1875341771 HELHSDFDKHTNEN-UHFFFAOYSA-N 327.778 2.743 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 178848 FLIUPXFFDCLVLD-YMTOWFKASA-N 333.344 2.564 5 50 EFBA CN(C)[S@@](=O)(=NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 4530225 ZYLDZVLMCQUFDB-QHCPKHFHSA-N 333.369 2.739 5 50 EFBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1O)c1ccc(F)cc1 4935992 USPLMMSVYKCRII-UHFFFAOYSA-N 335.316 2.566 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]3CCCC[C@H]32)s1 159464364 UVKJACMRZXODCC-GHMZBOCLSA-N 330.431 3.000 5 50 EFBA C[C@H]1C[C@@H](C)CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)C1 16425415 DMHYHMHYHDBQLI-PHIMTYICSA-N 330.340 2.819 5 50 EFBA CN(C)c1ccc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 454152 YBZQZOHLTOGABI-UHFFFAOYSA-N 328.324 2.701 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1ccccc1 4608303 GNPCXTZMHINXLI-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA O=C1N[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N2CCCC[C@@H]12 124845262 ZPTQRAKNKSXTSO-BBRMVZONSA-N 327.340 2.838 5 50 EFBA C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 162746509 YHTDEVPYVZYELN-ZANVPECISA-N 336.369 2.604 5 50 EFBA Cc1nc(N2[C@H]3CC[C@H]2[C@H](C(=O)OC(C)(C)C)C3)ccc1[N+](=O)[O-] 408523970 WPFGNSZOVMDWMQ-SCRDCRAPSA-N 333.388 2.997 5 50 EFBA COc1cc([N+](=O)[O-])cc2cc(C(=O)N3CCCC[C@H]3C)c(=O)oc12 612178 JTPDYSDIOMZWNE-SNVBAGLBSA-N 346.339 2.724 5 50 EFBA O=C(COC(=O)c1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 2923951 VBPRAFKJIWDKEP-UHFFFAOYSA-N 330.252 2.543 5 50 EFBA O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@@H]4CCCC[C@H]43)n2)c1 230198293 BJLCAZZXSGCWOB-HUUCEWRRSA-N 344.371 2.788 5 50 EFBA CN(C)C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 169725391 KKUUSNYNZVZTHA-UHFFFAOYSA-N 328.210 2.888 5 50 EFBA COc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 445071 VPQHSULAOZVTIE-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA CCNC(=O)/N=c1\sc([N+](=O)[O-])cn1Cc1ccc(Cl)cc1 71767347 DLQXYDILEGSJHQ-SSZFMOIBSA-N 340.792 2.790 5 50 EFBA COc1ccc(CCN2Cc3c(cccc3[N+](=O)[O-])C2=O)cc1OC 12952631 WLQIBFFYLDMVHP-UHFFFAOYSA-N 342.351 2.811 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 239637049 BIMUSOHLCZDSNF-BPLDGKMQSA-N 331.372 2.982 5 50 EFBA O=C(NCc1ccccc1)c1cc([N+](=O)[O-])nn1Cc1ccccc1 2788655 UGEGVYVSCHGSLA-UHFFFAOYSA-N 336.351 2.770 5 50 EFBA C[C@@H]1C(c2cccs2)=[N+]([O-])[C@@](C)(c2cccc([N+](=O)[O-])c2)N1O 4315137 RSYWLMKGYLYSKM-BMIGLBTASA-N 333.369 2.922 5 50 EFBA C[C@H]1COCCN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 160279664 YHBRXNHVCGRHSX-QMMMGPOBSA-N 333.266 2.866 5 50 EFBA O=[N+]([O-])c1ccc(C2=Nn3c(nnc3C(F)(F)F)SC2)cc1 48481 JWCHJLTVOTWOTQ-UHFFFAOYSA-N 329.263 2.563 5 50 EFBA CCOc1cc2c(cc1Cn1ccc(=O)c([N+](=O)[O-])c1)O[C@@H](C)C2 131191344 WHJXKBQCUQZADO-NSHDSACASA-N 330.340 2.527 5 50 EFBA CN(c1ccc([N+](=O)[O-])nc1)S(=O)(=O)c1ccc(Cl)s1 408515588 ZEUKEAFEJDUIBY-UHFFFAOYSA-N 333.778 2.530 5 50 EFBA O=[N+]([O-])c1cccc([C@@]2(O)C[n+]3ccccc3N2c2ccccc2)c1 5947901 KXUMHCBLNSSWES-IBGZPJMESA-N 334.355 2.879 5 50 EFBA COc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2O)cc1F 130327972 RCNAZQFCJPEDNA-UHFFFAOYSA-N 334.303 2.720 5 50 EFBA COC(=O)c1ccc([N+](=O)[O-])c(NCC2(c3ccccn3)CC2)c1 170603321 CFBTXXJLKKCRMV-UHFFFAOYSA-N 327.340 2.920 5 50 EFBA CCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 2070855 HUSRMKWJGJPJPK-AWEZNQCLSA-N 333.344 2.518 5 50 EFBA Cn1nccc1C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 195504459 HFEZCFUZMJFPIC-UHFFFAOYSA-N 330.388 2.587 5 50 EFBA O=C(c1ccccc1F)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19773533 GOBMUSUTNILQCE-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA CN1CCN(c2cc(N3CCCCCC3)c([N+](=O)[O-])cc2F)CC1 4819053 KUVLZXMKQZHYMP-UHFFFAOYSA-N 336.411 2.866 5 50 EFBA Cc1noc(C)c1CN(C(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1 170088108 CETRAZVGMTYAOA-UHFFFAOYSA-N 330.344 2.587 5 50 EFBA O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170004965 LCPCIFRFVQYIQT-WMLDXEAASA-N 342.351 2.808 5 50 EFBA CCc1ncc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c(N)n1 1776005457 JCEHDJFLBLEJRR-UHFFFAOYSA-N 339.302 2.743 5 50 EFBA C[C@@H]1[C@H](C(=O)N(C=O)c2cccc([N+](=O)[O-])c2)[C@H]2C=C[C@H]1C21CC1 101857264 IABITEUDZCOMLK-SRMUXQRQSA-N 326.352 2.933 5 50 EFBA CCNC(=O)/N=c1\sc([N+](=O)[O-])cn1Cc1ccccc1Cl 71767349 FPXPBEULMNKNRQ-SSZFMOIBSA-N 340.792 2.790 5 50 EFBA CC[C@H]1CC[C@@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)O1 863947898 NOKJHXKVKBTRMB-CABZTGNLSA-N 330.743 2.961 5 50 EFBA O=[N+]([O-])c1cc2c(cc1CN1CCN(c3ccccc3)CC1)OCO2 55542982 IBQQPXWQLSZVTE-UHFFFAOYSA-N 341.367 2.646 5 50 EFBA COc1ccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2F)cc1 452392 XVRDBUIOACKMHF-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 248382574 XKTWUTBUVVGIFI-HTVCTNPSSA-N 333.388 2.698 5 50 EFBA CC(C)=C[C@@H]1[C@@H](C(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C 229723485 WSRPVXWYCYEVRX-OAGGEKHMSA-N 332.400 2.983 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCc1c(C)nn(C)c1C 162459840 IJJKVJBQFOAMRQ-UHFFFAOYSA-N 331.376 2.618 5 50 EFBA Cc1nc2c(s1)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)CCC2 170605205 SADKMBSTHCLMBN-CYBMUJFWSA-N 332.385 2.749 5 50 EFBA O=C(O)C[C@@H](NC(=O)Nc1ccccc1)c1cccc([N+](=O)[O-])c1 4685905 XWYPPEXCJAXJDZ-CQSZACIVSA-N 329.312 2.932 5 50 EFBA COC(=O)c1ccc(Br)c([N+](=O)[O-])c1Br 585672368 FCFFBEKTCRBOFJ-UHFFFAOYSA-N 338.939 2.906 5 50 EFBA O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 102315394 WIVIBAYEYWRCMI-VLIVSTDHSA-N 336.731 2.710 5 50 EFBA CCO[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(O)c2)C12CCC2 160540149 BCBBIPLQKAEXOY-GJZGRUSLSA-N 334.372 2.720 5 50 EFBA O=[N+]([O-])c1ccc(O)cc1CN1CCN(Cc2ccccc2)CC1 19609083 MNFAGPWYBNXTMM-UHFFFAOYSA-N 327.384 2.618 5 50 EFBA O=C(/C=C\c1ccccc1)NC(=S)Nc1ccc([N+](=O)[O-])cc1O 16133977 VPQFHIOTRDEXDO-TWGQIWQCSA-N 343.364 2.827 5 50 EFBA CCCc1cc(=O)nc(SCc2nc3ccc([N+](=O)[O-])cc3[nH]2)[nH]1 9635686 UCUSKZJEPGFMAZ-UHFFFAOYSA-N 345.384 2.799 5 50 EFBA O=[N+]([O-])c1ccc(OC2CCN(Cc3ccc(CO)o3)CC2)cc1 130734478 KXOKLLQENQJCOB-UHFFFAOYSA-N 332.356 2.724 5 50 EFBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2)C1 164972486 LYGNTURYCAAAID-INIZCTEOSA-N 328.324 2.514 5 50 EFBA COc1ccc(OC)c(CNc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])c1 19537579 GPZOJVMXNYUXLX-UHFFFAOYSA-N 334.288 2.527 5 50 EFBA Cc1ccc(C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 4575475 WXTQEVVFJWKQQN-UHFFFAOYSA-N 326.352 2.971 5 50 EFBA COc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC 75329 QGYYUOYOWZSANS-UHFFFAOYSA-N 344.367 2.513 5 50 EFBA COc1cccc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 1052379 WFGKJHUVCNJIAL-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1 5064999 OTKFFZUFZXBNHF-UHFFFAOYSA-N 341.367 2.708 5 50 EFBA O=C(c1ccccc1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19368872 JDZXEXUXRVRGCF-UHFFFAOYSA-N 325.368 2.553 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@@H]2CC=CCC2)CC1 285086 SMAFGORBZUCLDY-OAHLLOKOSA-N 329.400 2.709 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([N+](=O)[O-])cc1C(=O)O 2923747 HAENBECNMUYTKI-UHFFFAOYSA-N 345.267 2.762 5 50 EFBA COc1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1O 55543458 XGCLKKXNMAPOLX-UHFFFAOYSA-N 343.383 2.631 5 50 EFBA COC(=O)c1ccc(COc2ccc(/C=C/[N+](=O)[O-])cc2OC)o1 582228 JPPAPOROLFSFDL-BQYQJAHWSA-N 333.296 2.901 5 50 EFBA O=C(Cc1cccs1)Nc1cc(SCCO)cc([N+](=O)[O-])c1 2760676 ROKCRDVZWXDTAT-UHFFFAOYSA-N 338.410 2.922 5 50 EFBA O=C(O)[C@H](Cc1ccc(O)cc1)NSc1ccccc1[N+](=O)[O-] 19797961 VICFQGTUBSTZHS-LBPRGKRZSA-N 334.353 2.593 5 50 EFBA COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)c(C(=O)O)cc1OC 1065996 SKZRCBVNPOXWQH-UHFFFAOYSA-N 346.295 2.563 5 50 EFBA COc1cccc(/C=C/c2onc(C)c2[N+](=O)[O-])c1OCC(=O)O 4776062 NBBNPXWZSTZATL-VOTSOKGWSA-N 334.284 2.534 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1ccc(F)cc1 4310086 LJSOXIPXWXDSAD-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA O=C(Nc1ncc([N+](=O)[O-])s1)c1cccn1Cc1ccncc1 1775994932 UEEMDZNMJPOEPA-UHFFFAOYSA-N 329.341 2.548 5 50 EFBA Cc1nn(CC(=O)Nc2nc3ccccc3s2)c(C)c1[N+](=O)[O-] 1067743 DPWGRICXIABTCU-UHFFFAOYSA-N 331.357 2.657 5 50 EFBA Cc1cc2ncn(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2cc1C 117363 KHWDMGWQKWODBN-UHFFFAOYSA-N 331.353 2.798 5 50 EFBA COC(=O)c1ccc(-c2nc(N)c3c(=O)oc4ccccc4c3n2)cc1 286135 REPAXWWGYXTMTO-UHFFFAOYSA-N 347.330 2.772 5 50 EFBA biogenic CCS(=O)(=O)c1cccc(CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 157366527 DBOKZJRPSBTOMM-UHFFFAOYSA-N 348.380 2.570 5 50 EFBA N[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 237878998 GKILFNBQTOLTCM-KRWDZBQOSA-N 325.368 2.570 5 50 EFBA CC(=O)c1ccccc1NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 195050921 UOIBCSLDFFCUTD-UHFFFAOYSA-N 328.328 2.510 5 50 EFBA CC(C)(C)N(Cc1ccc(F)cc1)C(=O)Cn1ccc([N+](=O)[O-])n1 123746669 DISMJCFDMOAEQL-UHFFFAOYSA-N 334.351 2.758 5 50 EFBA Cc1cc(C(=O)NCCc2nc3cc(F)ccc3[nH]2)ccc1[N+](=O)[O-] 170011409 VFDJQLSKPPBUPD-UHFFFAOYSA-N 342.330 2.891 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(c2ccccc2)CC1 4821348 UUKQMYQAHYFDEM-UHFFFAOYSA-N 326.356 2.949 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N2CCC(NC(=O)c3ccsc3)CC2)n1 122125285 CHTGOIRNJGZRQW-UHFFFAOYSA-N 346.412 2.759 5 50 EFBA O=C(NC[C@@H]1CCCC[C@@H]1O)Nc1cc([N+](=O)[O-])ccc1Cl 170594003 BRWNKCZHIBBQOR-ZANVPECISA-N 327.768 2.921 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccc(OCc3ccccc3)cc2)N1 89579 FVICUYAPMJJFFN-WMZOPIPTSA-N 326.352 2.862 5 50 EFBA COc1cc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc(OC)c1 469618 LZWACLHXGGJBCF-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@@H](c2nc[nH]n2)C1 425065916 MKXNYRVHXCYPHS-SECBINFHSA-N 343.368 2.557 5 50 EFBA Cc1c(N2C(=O)c3ccccc3C2=O)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3664353 LHQRYICEGNTDSH-UHFFFAOYSA-N 327.252 2.612 5 50 EFBA COc1ccc(CCNC(=O)c2ccccc2[N+](=O)[O-])cc1OC 68233 YWFDPMZSVPNYHJ-UHFFFAOYSA-N 330.340 2.585 5 50 EFBA CCOC(=O)[C@@H](c1nc2ccccc2o1)c1ncccc1[N+](=O)[O-] 5326279 QZUDAUWSNMZZHB-CYBMUJFWSA-N 327.296 2.826 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2 253387919 OEXHQOGQTVQTAT-VDRZXAFZSA-N 332.464 2.854 5 50 EFBA Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)o1 4819091 DLYJZVVTOXRCGX-UHFFFAOYSA-N 329.356 2.767 5 50 EFBA O=[N+]([O-])c1ccc(Cl)cc1CN1CCN(c2ccccn2)CC1 22591298 RDKDHEBPDQHKPM-UHFFFAOYSA-N 332.791 2.965 5 50 EFBA CNc1ccc(C(=O)O[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)cc1[N+](=O)[O-] 239475407 AOBCVWJPONCFBR-NILFDRSVSA-N 334.372 2.997 5 50 EFBA CCc1nccn1[C@H]1CCCN(c2c([N+](=O)[O-])c(C)nn2CC)C1 192573197 ZMLLZRYSCIOJFZ-ZDUSSCGKSA-N 332.408 2.720 5 50 EFBA O=C1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)O1 4845676 VSUVQNJWUMYAEJ-ZBFHGGJFSA-N 326.308 2.838 5 50 EFBA C[C@@H](CCc1ccccc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2754462 HSPPUSZOYWFMNN-ZDUSSCGKSA-N 334.397 2.894 5 50 EFBA COc1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 2969276 VGSJJNAYIVQTCI-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4629911 DADWTLLGYOSYQU-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H](c2ccsc2)O1 150868452 WIHOTYRXFLBTMZ-MEBBXXQBSA-N 348.380 2.964 5 50 EFBA CC[C@H]1CC[C@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)O1 863947899 NOKJHXKVKBTRMB-JOYOIKCWSA-N 330.743 2.961 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 124186 PAMHMEJHODULOD-OAHLLOKOSA-N 347.371 2.764 5 50 EFBA O=C(NC(=S)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 513276 OHJSWYXGZHREKK-UHFFFAOYSA-N 327.365 2.672 5 50 EFBA COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc([N+](=O)[O-])c1 2102484 GGYGRQYICITPSK-UHFFFAOYSA-N 331.284 2.693 5 50 EFBA O=C(O)CCCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 2102509 XIDKJXMAZDFIMG-UHFFFAOYSA-N 335.341 2.912 5 50 EFBA Cc1nc(N[C@H](COC(=N)O)Cc2ccccc2)ccc1[N+](=O)[O-] 496523217 HWWWYCXRZQBUAL-ZDUSSCGKSA-N 330.344 2.831 5 50 EFBA COc1cc(Cn2nnc(-c3ccsc3)n2)c([N+](=O)[O-])cc1F 183842321 PYXYXLLWTSQRGM-UHFFFAOYSA-N 335.320 2.506 5 50 EFBA Cc1ccc(CN2CC[C@@H](NCc3ccc([N+](=O)[O-])cc3)C2=O)cc1 191800079 KEEXORRYOXDWNV-GOSISDBHSA-N 339.395 2.794 5 50 EFBA Cc1nc(C[C@@H]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])C2)no1 194588188 VGCRNQRMOFZWGF-ZDUSSCGKSA-N 344.371 2.690 5 50 EFBA CC(=O)[C@H](Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 146393 HUKMPYQTVOVJAI-INIZCTEOSA-N 333.365 2.569 5 50 EFBA Cc1nc([N+](=O)[O-])c(C(=O)OCc2c(F)cccc2Cl)n1C 1422089 NIQWESPFUMPNQO-UHFFFAOYSA-N 327.699 2.786 5 50 EFBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(OC)cc3s2)n1 2764025 VVXAYIAFAHVFIT-UHFFFAOYSA-N 347.356 2.682 5 50 EFBA Nc1ccc([N+](=O)[O-])c(N2CCC(Oc3ncccc3F)CC2)c1 375708950 ZNKKHMTWHKSHFN-UHFFFAOYSA-N 332.335 2.759 5 50 EFBA CCOc1ccc(-c2nc(Cn3ccc(=O)c([N+](=O)[O-])c3)co2)cc1 159839744 FTCWRXQCENIGQL-UHFFFAOYSA-N 341.323 2.859 5 50 EFBA O=C(NC1(CO)CCCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 182698814 QZUWUZCYLAMSLP-UHFFFAOYSA-N 332.278 2.649 5 50 EFBA Cc1nc(C(=O)Nc2ccc(F)cc2)nn1-c1ccc([N+](=O)[O-])cc1 1397418 ABBRVBYBGWAVHX-UHFFFAOYSA-N 341.302 2.875 5 50 EFBA COCCCNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C)n1 5050361 DBSIXBYBGAUTMU-UHFFFAOYSA-N 344.371 2.999 5 50 EFBA O=C(Nc1nnc(-c2cccnc2)s1)c1cccc([N+](=O)[O-])c1 17251417 BXVCFQVHMUTKRE-UHFFFAOYSA-N 327.325 2.761 5 50 EFBA O=[N+]([O-])c1cc(Cl)cnc1NCc1cccc(-n2cncn2)c1 178837714 DSBHBIJAUZDVRR-UHFFFAOYSA-N 330.735 2.836 5 50 EFBA CC(=O)NCc1ccc([C@H]2CCCN2c2ccc([N+](=O)[O-])c(C)n2)o1 253429456 SGYUTRNIJZRBNL-OAHLLOKOSA-N 344.371 2.869 5 50 EFBA Cc1cc(NC[C@@H]2CCCC[C@@H]2N2CCOCC2)ncc1[N+](=O)[O-] 952993177 FAXYYRMTLUBZKL-GJZGRUSLSA-N 334.420 2.601 5 50 EFBA Cc1nn(CC(=O)OCc2c(C)oc3ccccc23)cc1[N+](=O)[O-] 2332237507 DTDOVIKROYGOHI-UHFFFAOYSA-N 329.312 2.898 5 50 EFBA O=C1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)O1 4845678 VSUVQNJWUMYAEJ-HOCLYGCPSA-N 326.308 2.838 5 50 EFBA COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2cnn(C)c2)c1 341777174 UJYHHTFOUVVNJH-HNNXBMFYSA-N 344.371 2.704 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])cc1C 229898800 XMDJOOASZSWWQK-YXAMBPQSSA-N 326.352 2.913 5 50 EFBA C[C@@H]1C[C@@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3CCC[C@@H](C)C3)n2)C1 238923912 QGYVHIFPKBVXAE-JHJVBQTASA-N 348.451 2.686 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/c1ccc2c(c1)OCO2 441698 RWOIUBSKQUQKIU-XVNBXDOJSA-N 342.307 2.984 5 50 EFBA COc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 4842246 YFGQYAGVKLHWNZ-UHFFFAOYSA-N 346.339 2.551 5 50 EFBA biogenic,in-vitro Nc1ccc([N+](=O)[O-])c(N[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)c1 253396775 NAQXAVRNDOSELC-OCCSQVGLSA-N 332.404 2.770 5 50 EFBA Cc1ccc([C@H]2CCCCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 229349871 BFHCEGFFCRHDEJ-HZPDHXFCSA-N 348.403 2.671 5 50 EFBA O=C(Nc1ncn(Cc2ccccc2F)n1)c1ccc([N+](=O)[O-])cc1 2794648 NJGLTYFKGIOSFK-UHFFFAOYSA-N 341.302 2.626 5 50 EFBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H](c2ccsc2)O1 150868525 WIHOTYRXFLBTMZ-BONVTDFDSA-N 348.380 2.964 5 50 EFBA C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 158429567 KNXGGYVVZCRNEQ-MEBBXXQBSA-N 348.330 2.682 5 50 EFBA O=C(/C=C/c1ccco1)NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1 457182 PDXGASRYNXYKEF-GQCTYLIASA-N 335.316 2.853 5 50 EFBA O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)NCc1ccccc1 519877 ZDKBXPDXPQMXPL-UHFFFAOYSA-N 342.380 2.880 5 50 EFBA CCN(CCNc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 4619227 NABRQLKAICMGAC-UHFFFAOYSA-N 349.412 2.718 5 50 EFBA O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2ccc(F)cc2)CC1 176208 XWVKUETZILGMIQ-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2F)CC1 318350 IBSQZCVDLYAWHQ-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA O=C(c1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 3904569 QHOJZFXYSSOYSC-UHFFFAOYSA-N 335.360 2.758 5 50 EFBA O=C(Nc1ccc2c[nH]nc2c1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 193592593 MICPZVUZRVIBQY-UHFFFAOYSA-N 348.322 2.909 5 50 EFBA COC(=O)CN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cccc(F)c1 176963535 TYNBRJYOERVSGV-UHFFFAOYSA-N 346.314 2.862 5 50 EFBA C[C@H]1CN(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 13748605 SKVYGLPGRYWITQ-GASCZTMLSA-N 333.432 2.668 5 50 EFBA C[C@@H]1CO[C@@H](c2ccccc2)CN1c1ccc2ncc([N+](=O)[O-])n2n1 192655498 OBESSNOQVWVFME-TZMCWYRMSA-N 339.355 2.604 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(C(=O)O)cc1 5042028 QZHJKPHVZLNPIG-UHFFFAOYSA-N 345.311 2.623 5 50 EFBA O=C(OCNC(=O)c1ccccc1Cl)c1cccc([N+](=O)[O-])c1 22014266 BXPYGCAAHIMALT-UHFFFAOYSA-N 334.715 2.793 5 50 EFBA C[C@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc(F)c(Cl)c1 2795270 DBHBMLDJDOIYQF-MRVPVSSYSA-N 326.715 2.859 5 50 EFBA CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCOC1 160188169 IEPHNLWJEICIAD-SECBINFHSA-N 333.266 2.866 5 50 EFBA COc1cccc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 169415 XIJFQUIYWGHABG-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1ccco1 4949632 XPDGICTXPUIDQR-NSHDSACASA-N 333.319 2.678 5 50 EFBA O=C(COc1c(Cl)cc(Br)cc1[N+](=O)[O-])NC1CC1 408518781 ZNLYPDGAMZRAIP-UHFFFAOYSA-N 349.568 2.668 5 50 EFBA C[N+]1(C)C[C@@H]2CCN(c3nc(C(F)(F)F)nc4ccccc34)[C@@H]2C1 1775988561 WKJGFMGXDYLVET-SMDDNHRTSA-N 337.369 2.934 5 50 EFBA O=Cc1ccc(Sc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1 2993443 JPVZUDPUNRAWAJ-UHFFFAOYSA-N 327.325 2.534 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccccc1Cl 442446 DBSVAKVPSHETTA-UHFFFAOYSA-N 326.761 2.727 5 50 EFBA CCC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@](O)(C(C)(C)C)C1 1100265 NFRZVSOKIXLQQY-QGZVFWFLSA-N 333.388 2.870 5 50 EFBA COc1ccc(C(=O)OCC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 2766423 FAUDJPRZSBDSSC-UHFFFAOYSA-N 329.308 2.952 5 50 EFBA O=[N+]([O-])c1cccc(C2=C[C@H](c3ccccc3F)n3nnnc3N2)c1 100851433 RBKNCSKCRKYQDS-OAHLLOKOSA-N 338.302 2.776 5 50 EFBA Cc1n[nH]c(C)c1N1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O 69865 YBFIKHDNXYQJMH-UHFFFAOYSA-N 336.307 2.889 5 50 EFBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1ccco1 4949631 XPDGICTXPUIDQR-LLVKDONJSA-N 333.319 2.678 5 50 EFBA O=C1CCc2cc(C(=O)N3CCc4c3cccc4[N+](=O)[O-])ccc2N1 172360993 OXQHVPVWZDJQGH-UHFFFAOYSA-N 337.335 2.682 5 50 EFBA COc1cc(C(=O)NCc2nc(C)c(C)s2)cc([N+](=O)[O-])c1C 170611202 PDFYFXDHPWBNNJ-UHFFFAOYSA-N 335.385 2.915 5 50 EFBA COC(=O)c1ccc(COC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)o1 763721202 QXRNKLPORAABOW-UHFFFAOYSA-N 339.687 2.985 5 50 EFBA Nc1nc(-c2cccc([N+](=O)[O-])c2)nc2c1c(=O)oc1ccccc12 108221 GYVSHJZPYXMMOG-UHFFFAOYSA-N 334.291 2.894 5 50 EFBA Cc1ccc(OC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 4846122 VVSPTPJCLSOCOP-UHFFFAOYSA-N 342.351 2.959 5 50 EFBA CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 3106613 GJARFAFMBBYFFD-AWEZNQCLSA-N 333.344 2.518 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCOC[C@H]1C[C@H](O)c1ccccc1 253421697 FFLQSCBOGPXHRI-MJGOQNOKSA-N 342.395 2.919 5 50 EFBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCn2c(cc3cc(Cl)ccc32)C1 328588862 XVXJQZKSQOWKFE-UHFFFAOYSA-N 345.746 2.582 5 50 EFBA Cc1cc(O)c([N+](=O)[O-])cc1S(=O)(=O)N1CCCc2ccccc21 156367840 NFURMUIEVXSLAF-UHFFFAOYSA-N 348.380 2.750 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 2754831 JFVCJBJLUHCTAN-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA Cc1ccc(C)c(-n2c(CCn3ccc([N+](=O)[O-])n3)n[nH]c2=S)c1 6912383 UWGODXITETYNAU-UHFFFAOYSA-N 344.400 2.894 5 50 EFBA Cc1c(NS(=O)(=O)c2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] 170609276 IZILJPOBUPZDDK-UHFFFAOYSA-N 349.412 2.766 5 50 EFBA COc1cccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c1 450396 LNERGRVUFMXKRV-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA CC(C)(C)OC(=O)N1C[C@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)O)C1 54965233 PNIVAHKGWKAAIG-OLZOCXBDSA-N 336.344 2.630 5 50 EFBA in-vitro COc1ccc(NC(=O)CSCCc2ccccn2)c([N+](=O)[O-])c1 5034043 ANPQXCIIEINHOI-UHFFFAOYSA-N 347.396 2.913 5 50 EFBA O=[N+]([O-])c1ccc(N2CCC(c3ccnnc3)CC2)c([N+](=O)[O-])c1 1875276276 SXBRIFSJRPOLTI-UHFFFAOYSA-N 329.316 2.677 5 50 EFBA O=C(NCc1ccccc1F)c1cc2cc([N+](=O)[O-])ccc2oc1=O 1052344 XXWGJPLQZQGHKF-UHFFFAOYSA-N 342.282 2.770 5 50 EFBA CN(C)c1ccc(C(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 36020467 MIXZVSXCBHJDAU-UHFFFAOYSA-N 331.284 2.506 5 50 EFBA CN(C)[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 160101498 FTMNMCXTQRNXOF-JTQLQIEISA-N 346.309 2.781 5 50 EFBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCSc1ccccn1 2947689 TZBQVEYLJGCWLU-RMKNXTFCSA-N 329.381 2.912 5 50 EFBA CCOc1cc(CSc2ncnc3[nH]cnc23)ccc1[N+](=O)[O-] 408514599 IZHRQEDIJWLCIL-UHFFFAOYSA-N 331.357 2.952 5 50 EFBA Cc1cc(NCc2nc(-c3ccncc3)n[nH]2)c(F)cc1[N+](=O)[O-] 1186731639 UMKFNKOTUWNUQK-UHFFFAOYSA-N 328.307 2.835 5 50 EFBA COc1ccc(S(=O)(=O)Nc2noc3ccccc23)c([N+](=O)[O-])c1 253418969 GFUGKFLOLJXBDY-UHFFFAOYSA-N 349.324 2.545 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccc(OC)cc2)cc([N+](=O)[O-])c1 434367 JUGSGOFGISMZFH-UHFFFAOYSA-N 330.296 2.642 5 50 EFBA C[C@H](c1cccnc1)N(C(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1 225539532 AHGBDMYXCLOBPA-LLVKDONJSA-N 326.356 2.938 5 50 EFBA O=C(O)C[C@H](c1cccc([N+](=O)[O-])c1)N1Cc2ccccc2C1=O 2509225 HTIMNPHZLWCSOW-OAHLLOKOSA-N 326.308 2.767 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 239637050 BIMUSOHLCZDSNF-NWANDNLSSA-N 331.372 2.982 5 50 EFBA CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCC[C@H]1c1ccccc1 299074819 VOHWRVJNUDMULC-ZFWWWQNUSA-N 340.383 2.861 5 50 EFBA CCOc1ccc(Cl)cc1/C=C/c1nc(O)[nH]c(=O)c1[N+](=O)[O-] 15009413 XMZDODXUPBDYLM-HWKANZROSA-N 337.719 2.606 5 50 EFBA O=C(Nc1ccccc1F)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 291472 AMYZPNZMZKFVBN-LLVKDONJSA-N 343.314 2.726 5 50 EFBA COc1cc([N+](=O)[O-])cc2cc(C(=O)N3CCCC[C@@H]3C)c(=O)oc12 612176 JTPDYSDIOMZWNE-JTQLQIEISA-N 346.339 2.724 5 50 EFBA C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 1053569 XBRRZVRGIGMIBT-LLVKDONJSA-N 328.324 2.743 5 50 EFBA CCCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccccc1[N+](=O)[O-] 2758317 JVMUYUGQUJUING-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA CC1(C)[C@@H](c2ccccc2)CCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 420638107 JBYUXDPLMVUGER-CQSZACIVSA-N 340.383 2.861 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(Cn2cccn2)CC1 126103243 MFXCBVZRCYZQQS-UHFFFAOYSA-N 348.790 2.997 5 50 EFBA CC(=O)c1cc(N2CCN(c3ccccc3O)CC2)ccc1[N+](=O)[O-] 253415453 DXUKTOSVDGQSSG-UHFFFAOYSA-N 341.367 2.830 5 50 EFBA Cc1nc(N[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] 252512293 OWSOHGRCOGBKKM-NWANDNLSSA-N 334.420 2.600 5 50 EFBA COc1cc(C(=O)NCc2nc3cc(F)ccc3[nH]2)ccc1[N+](=O)[O-] 176110613 UXLMZSGLWMIZNU-UHFFFAOYSA-N 344.302 2.549 5 50 EFBA CN(C)[C@H]1CCC[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 170020462 KKGFELSARQRILM-OLZOCXBDSA-N 332.404 2.764 5 50 EFBA C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ncc([N+](=O)[O-])s1 192457206 GDAKYCAPBVNTTP-AAEUAGOBSA-N 333.417 2.769 5 50 EFBA O=C(Cn1cnc2ccc(Cl)cc2c1=O)c1ccc([N+](=O)[O-])cc1 5894187 HSJGXGLMCHSNRE-UHFFFAOYSA-N 343.726 2.841 5 50 EFBA Cc1nc(N2CCOCC2)nc(Nc2ccc(Cl)cc2)c1[N+](=O)[O-] 4143158 LVVXHBAMOSBJAE-UHFFFAOYSA-N 349.778 2.927 5 50 EFBA CCC(=O)Oc1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 43002 DYLWDTRRBLOKCY-UHFFFAOYSA-N 340.291 2.711 5 50 EFBA Cc1c(NC(=O)[C@@H](C)N(C)CC2CCOCC2)cccc1[N+](=O)[O-] 155910319 QKMZZWNPZWSTKI-CYBMUJFWSA-N 335.404 2.589 5 50 EFBA Cc1cccc(NC(=O)[C@@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)n1 195509882 AQJPEYNLBVHGLD-LLVKDONJSA-N 347.400 2.610 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccccc2OCc2ccccc2)N1 90387 PVMKAAOHTYLXNF-YJBOKZPZSA-N 326.352 2.862 5 50 EFBA Cc1ccc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)cc1[N+](=O)[O-] 4600304 XKPSPSYYHAENDZ-UHFFFAOYSA-N 343.343 2.558 5 50 EFBA CC[C@@H](O)CN1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 252483410 FAXHWVAGRDKCNI-LLVKDONJSA-N 348.230 2.795 5 50 EFBA CCn1ncc([N+](=O)[O-])c1C(=O)Nc1nc2c(C)cccc2s1 2755353 WVQJIMSGKFHQEV-UHFFFAOYSA-N 331.357 2.982 5 50 EFBA O=C(Nc1ccc2oc(=O)[nH]c2c1)c1cccc(Cl)c1[N+](=O)[O-] 175349076 MGYQDKYNOPKNOI-UHFFFAOYSA-N 333.687 2.935 5 50 EFBA O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 170004970 LCPCIFRFVQYIQT-YOEHRIQHSA-N 342.351 2.808 5 50 EFBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2)CC1 433085 GEWANDNEKQWJKS-DHZHZOJOSA-N 337.379 2.957 5 50 EFBA CN(C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C1CCCCC1 4747857 IHHSDQRHOKGQHM-UHFFFAOYSA-N 347.415 2.836 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2cccc(OCc3ccccc3)c2)N1 122575 OZIYDKVKDFPAQG-SJLPKXTDSA-N 326.352 2.862 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccc(C(C)=O)cc2)cc([N+](=O)[O-])c1 60842 QWXWZLSHRKCJOV-UHFFFAOYSA-N 342.307 2.836 5 50 EFBA CN(c1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])[C@@H]1CC1(C)C 225605808 HITWHFAGJRCQDC-CQSZACIVSA-N 328.372 2.794 5 50 EFBA CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@H](CO)c1ccccc1)C2 100015780 OEXHQOGQTVQTAT-WYFQJXRYSA-N 332.464 2.854 5 50 EFBA fda O=C1[C@H](Nc2ccc([N+](=O)[O-])cc2F)CCCN1c1cccnc1 253426377 GCBBXFLVJUOGDY-OAHLLOKOSA-N 330.319 2.736 5 50 EFBA O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc2oc(=O)ccc2c1 557402 DENCEQORGJISBH-UHFFFAOYSA-N 340.291 2.719 5 50 EFBA O=C(Nc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)N1CCOCC1 20310921 FYESXUXYWYVZPM-KRWDZBQOSA-N 341.367 2.607 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-] 4913319 NKQQPQURILVHAS-GWCFXTLKSA-N 332.356 2.814 5 50 EFBA COc1cc(C(=O)Nc2ccc3oc(=O)ccc3c2)ccc1[N+](=O)[O-] 154556668 NHHKIUWZPUBJFB-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA CC(C)(C)OC(=O)N1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1 29753782 PNIQRWMAHWHARE-UHFFFAOYSA-N 335.360 2.983 5 50 EFBA CCOc1cc(NC(=O)N[C@H](C)c2nnc(C)o2)ccc1[N+](=O)[O-] 1466990089 FYOAMMMJUKTFGS-MRVPVSSYSA-N 335.320 2.568 5 50 EFBA Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)N1CCCc2ccccc21 196113 NZLABJNWEMVGKD-UHFFFAOYSA-N 334.763 2.733 5 50 EFBA COc1cccc2c1OC[C@@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])C2 172970439 RNJMHXMLJXUORE-ZDUSSCGKSA-N 342.351 2.645 5 50 EFBA O=C(N[C@@H]1CCO[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1O 156096784 LTGFZLONZXXJLT-CZUORRHYSA-N 328.324 2.560 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])cc2NC(=O)c2cccs2)CC1 5049435 IDDRPGVZDZHCTP-UHFFFAOYSA-N 346.412 2.660 5 50 EFBA CC1(C)C(=O)Nc2ccccc2N1C(=O)c1cccc([N+](=O)[O-])c1 238023 SZZKKDWQHSAISY-UHFFFAOYSA-N 325.324 2.972 5 50 EFBA Cc1nn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1ccc(Cl)cc1 4072935 NRXYFWFUAXRCAE-UHFFFAOYSA-N 344.758 2.952 5 50 EFBA COCCNc1ccc(C(=O)Nc2cccc(OC)c2)cc1[N+](=O)[O-] 5064534 GNHSQZHWBLBNQJ-UHFFFAOYSA-N 345.355 2.914 5 50 EFBA CCc1ccc(S(=O)(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)s1 2325737227 IFXFZJZCMSNCNE-UHFFFAOYSA-N 338.410 2.923 5 50 EFBA CCOC(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 146069 BXCCSVJYLFAQLR-UHFFFAOYSA-N 344.323 2.789 5 50 EFBA O=C1c2ccccc2C(=O)N1CCCNc1ccc([N+](=O)[O-])cc1 4757747 MAECRWWGEVYCNP-UHFFFAOYSA-N 325.324 2.693 5 50 EFBA Cc1cc(N2CCC(OC[C@H]3CCCCO3)CC2)ncc1[N+](=O)[O-] 267403541 PVXOPWCCPGXXOF-OAHLLOKOSA-N 335.404 2.853 5 50 EFBA CN(C)[C@@H]1CCC[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 170020454 KKGFELSARQRILM-QWHCGFSZSA-N 332.404 2.764 5 50 EFBA CC1CCC(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 285157 PTGGZJGVOHWIJH-UHFFFAOYSA-N 331.416 2.931 5 50 EFBA O=C(Nc1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1 5049433 IKLMMIZBLWDOIL-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA COc1ccc2[nH]nc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2c1 344783700 PRSJBGZLZUMCTR-UHFFFAOYSA-N 326.312 2.661 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])cc1C 100237450 XMDJOOASZSWWQK-APYUEPQZSA-N 326.352 2.913 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c([N+](=O)[O-])cc1C 101376675 ZNHRNLLNDSREKT-MPTQWLOMSA-N 338.363 2.913 5 50 EFBA C[C@]1(O)CCN(C(=O)c2c3ccccc3cc3ccccc23)C[C@H]1O 1565516812 BXCIQVXTIBTDAT-NQIIRXRSSA-N 335.403 2.951 5 50 EFBA O=C(NC[C@H]1CCCC[C@@H]1O)Nc1cc([N+](=O)[O-])ccc1Cl 170594004 BRWNKCZHIBBQOR-RNCFNFMXSA-N 327.768 2.921 5 50 EFBA CCOc1ccc(C(=O)NC(=S)Nc2ccccn2)cc1[N+](=O)[O-] 454551 AQUXPLOEEHNYET-UHFFFAOYSA-N 346.368 2.515 5 50 EFBA aggregator Cc1cc(NC(=O)N[C@@H]2c3ccccc3C[C@H]2O)ccc1[N+](=O)[O-] 121299921 DYTIVTGKXZVGNW-HZPDHXFCSA-N 327.340 2.683 5 50 EFBA O=[N+]([O-])c1ccc(-c2nc(-c3cn([C@@H]4CC[C@H]4O)nn3)cs2)cc1 1875280733 HGSJHUSRBPIPMN-ZIAGYGMSSA-N 343.368 2.673 5 50 EFBA Cc1ccc(NCCCNC(=O)c2cccc(CO)c2)c([N+](=O)[O-])c1 252503347 VBVFJQYJTJJSPG-UHFFFAOYSA-N 343.383 2.628 5 50 EFBA O=C(Nc1nnn[nH]1)c1ccccc1Sc1ccccc1[N+](=O)[O-] 253432128 WPGMNAMHYFGOLT-UHFFFAOYSA-N 342.340 2.511 5 50 EFBA CCOC(=O)c1cc(C(=O)c2ccc([N+](=O)[O-])cc2)n2ncccc12 4543064 GHEQUVBPYODRAY-UHFFFAOYSA-N 339.307 2.650 5 50 EFBA COc1ccc([N+](=O)[O-])cc1/C=C1/NC(=O)N(c2ccccc2)C1=O 312643 WFQMATFGBKNNAH-GXDHUFHOSA-N 339.307 2.701 5 50 EFBA Cc1nc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1Br 4843222 PNORTQBERIJXQH-UHFFFAOYSA-N 326.106 2.906 5 50 EFBA O=C(NCCNc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1O 5679011 HOWOAXDRAXKFJB-UHFFFAOYSA-N 335.747 2.796 5 50 EFBA C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 270900 JIABFMRDXFPWMC-MEDUHNTESA-N 328.324 2.553 5 50 EFBA CC(C)(C)OC(=O)N1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 41701545 RBEXASHZNSBASY-UHFFFAOYSA-N 335.404 2.690 5 50 EFBA COc1ccc(NC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] 296904451 SCXUJMZHMPNDOJ-NVXWUHKLSA-N 347.371 2.779 5 50 EFBA CN(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 170652862 IVZBDBRXCGOBJQ-MJBXVCDLSA-N 344.371 2.895 5 50 EFBA Cc1ccccc1[C@H](CN(C)C)NC(=O)c1ccccc1[N+](=O)[O-] 1775999806 WPMNJUSYXHNGAK-INIZCTEOSA-N 327.384 2.936 5 50 EFBA Cc1nn([C@H](C)C(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c(C)c1[N+](=O)[O-] 248380803 RFQHDJAINAVSJL-DALJILGISA-N 334.420 2.910 5 50 EFBA C[C@H](O)CCN(C)CC1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 1180199784 YIIISRBDUOMROW-INIZCTEOSA-N 349.475 2.552 5 50 EFBA CC(=O)NCc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(C)n2)o1 253429453 SGYUTRNIJZRBNL-HNNXBMFYSA-N 344.371 2.869 5 50 EFBA COC(=O)CCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)c1ccccn1 13153328 BKYNVISGQMGZGT-UHFFFAOYSA-N 343.339 2.508 5 50 EFBA CC(=O)Nc1cccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])c1 190978 ITAVBTLSOKJNNK-UHFFFAOYSA-N 343.295 2.504 5 50 EFBA COC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(C)cc1 4916915 GJOPUJLGGUNLFW-WJDWOHSUSA-N 340.335 2.847 5 50 EFBA Cc1cc(NC(=O)Cn2ccc([N+](=O)[O-])n2)ccc1Br 1428114 SFJAMJPBOPAJPZ-UHFFFAOYSA-N 339.149 2.501 5 50 EFBA O=[N+]([O-])c1ccccc1OCCOCCOc1ccccc1[N+](=O)[O-] 3114392 LXYSDLCOBFQJMX-UHFFFAOYSA-N 348.311 2.977 5 50 EFBA biogenic CN1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 160331431 GDYWRFOUEIDWEF-UHFFFAOYSA-N 346.309 2.783 5 50 EFBA COc1ccccc1CN1CCN(Cc2ccccc2[N+](=O)[O-])CC1 4094206 LPJKCCVWFQTPSK-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA COc1ccc(NC(=O)CSc2ccccc2N)c([N+](=O)[O-])c1 4718565 HCOVLFDADNIYDP-UHFFFAOYSA-N 333.369 2.916 5 50 EFBA O=C(NCc1ccc(F)cc1)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 2763632 IWZJMRMUCXWPCZ-UHFFFAOYSA-N 344.302 2.502 5 50 EFBA CCOC(=O)Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 613987 IMSXAHWKMPUEKK-UHFFFAOYSA-N 328.324 2.953 5 50 EFBA Cc1cc(Br)ccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1067996 MCSLUFRJPCUFMP-UHFFFAOYSA-N 339.149 2.501 5 50 EFBA CCc1ccc(NC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] 252511602 IONWCFWAQFLRBK-IUODEOHRSA-N 334.420 2.961 5 50 EFBA COc1ccc([C@H](CC(=O)O)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 99591 CSBPMMKTHZWMAV-HNNXBMFYSA-N 344.323 2.549 5 50 EFBA Cc1ccccc1[C@@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CCO1 119057538 RGUXEERZBFRSMI-KRWDZBQOSA-N 342.351 2.823 5 50 EFBA Cc1ccccc1OCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 572099 XOVAVNXXLMHEBL-UHFFFAOYSA-N 329.308 2.708 5 50 EFBA Cc1ccc(C)c(OC(=O)C[S@](=O)c2ccccc2[N+](=O)[O-])c1 2846946 MHGVIMPHYXCORW-HSZRJFAPSA-N 333.365 2.925 5 50 EFBA O=C(C[C@]1(O)C(=O)Nc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1 85922 XORDYPFLHGDIIT-MRXNPFEDSA-N 346.726 2.661 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@H](c2cccc([N+](=O)[O-])c2)CC(=O)N1 4916675 ZIBPBGPZGPCPPA-HNNXBMFYSA-N 344.367 2.958 5 50 EFBA CNC(=O)c1ccc(Cl)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 253417155 CTEOVZBBKRUCLB-UHFFFAOYSA-N 347.758 2.789 5 50 EFBA O=[N+]([O-])c1cnc(NC[C@H](O)c2cccc(Br)c2)s1 253395587 XUVDTMQFSUQYEW-VIFPVBQESA-N 344.190 2.959 5 50 EFBA COC[C@H](C)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 170603116 NFUZWLBWNBYSKM-CQSZACIVSA-N 344.415 2.548 5 50 EFBA O=[N+]([O-])c1ccc(N[C@H](CO)CN2CCCCC2)cc1C(F)(F)F 253431879 YASIPMVOASGDCI-LBPRGKRZSA-N 347.337 2.872 5 50 EFBA Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H](C)C3)o2)c(C)c1[N+](=O)[O-] 2780519 HSIHEDZHBUCHOD-LLVKDONJSA-N 346.387 2.922 5 50 EFBA O=C(NCc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCO2)CC1 187352336 RHINOMGOCAZPBS-INIZCTEOSA-N 333.388 2.695 5 50 EFBA Cc1cc(NC(=O)/C(Cl)=C(/Cl)C(=O)O)c([N+](=O)[O-])cc1C 5792837 SGVBEYUTOBJSRV-KTKRTIGZSA-N 333.127 2.924 5 50 EFBA O=C(C[C@@]1(O)C(=O)Nc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1 85924 XORDYPFLHGDIIT-INIZCTEOSA-N 346.726 2.661 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2)CC1 4810751 FTTLZIRWSCVTMO-UHFFFAOYSA-N 326.356 2.949 5 50 EFBA COc1cc(C(=O)N(C)Cc2ccccc2)c([N+](=O)[O-])cc1OC 445377 QPSXECWWMMAIQN-UHFFFAOYSA-N 330.340 2.884 5 50 EFBA O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CCN(Cc2ccccc2)CC1 55031346 WEYWEMCIDMKDIL-UHFFFAOYSA-N 342.355 2.825 5 50 EFBA O=C(Nc1ccc(-n2nccn2)cc1)c1ccc(F)cc1[N+](=O)[O-] 121154236 MKKVZBRSYDBAGF-UHFFFAOYSA-N 327.275 2.567 5 50 EFBA O=C(Nc1ncn(Cc2cccc(F)c2)n1)c1ccc([N+](=O)[O-])cc1 2794668 URHCVXJTYZVSBS-UHFFFAOYSA-N 341.302 2.626 5 50 EFBA O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(N2C(=O)CCC2=O)c1 5090961 BZBLLAWEFXGVPJ-UHFFFAOYSA-N 339.307 2.501 5 50 EFBA O=C(Nc1ccc(C(F)(F)F)nc1O)c1ccccc1[N+](=O)[O-] 1875256713 UYEKTTQQHYJIRW-UHFFFAOYSA-N 327.218 2.967 5 50 EFBA CCn1cc(C(=O)NC(=S)Nc2c(C)cc(C)cc2[N+](=O)[O-])cn1 5585613 FIEJXNVXERMXSI-UHFFFAOYSA-N 347.400 2.555 5 50 EFBA O=[N+]([O-])c1ccc2c(c1N1CCC(OC[C@@H]3CCCO3)CC1)CCN2 225513071 DBWSICBIIGMAGG-AWEZNQCLSA-N 347.415 2.727 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 17071815 UOAGXQWJYSFNSO-OAHLLOKOSA-N 344.367 2.958 5 50 EFBA Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2Cc3ccccc32)cc1C 170651997 ABOOKMYDWSGUJR-CQSZACIVSA-N 346.408 2.830 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCSC2CCCCC2)c1 5027820 FRYHXHWHQMNBMP-UHFFFAOYSA-N 344.458 2.939 5 50 EFBA COC(=O)c1ccccc1NC(=O)CSc1ccc([N+](=O)[O-])cn1 8743453 HGSSGSZNIVJOQS-UHFFFAOYSA-N 347.352 2.507 5 50 EFBA O=C(OCc1ccc([N+](=O)[O-])cc1)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 100328919 IMHUGTKYYJJCCA-JDPPGYRCSA-N 331.368 2.969 5 50 EFBA CN(CCc1ccc(Cl)cc1)C(=O)c1cc([N+](=O)[O-])c(O)cc1N 408514486 MDRNNWAYJZDRCF-UHFFFAOYSA-N 349.774 2.851 5 50 EFBA O=C(NC1(c2ncon2)CCCC1)c1ccc([N+](=O)[O-])cc1Cl 952992850 KKYBTCCSOPMQKN-UHFFFAOYSA-N 336.735 2.831 5 50 EFBA O=C(O)c1ccc(CNC(=S)Nc2cccc([N+](=O)[O-])c2)cc1 17067984 FVQYHQXPXPBCJC-UHFFFAOYSA-N 331.353 2.780 5 50 EFBA C[C@H](C[C@H](O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 162746645 YHTDEVPYVZYELN-RNCFNFMXSA-N 336.369 2.604 5 50 EFBA Cc1cc(=O)oc(C)c1C(=O)OC[C@@H]1CCC[N@@+]2(C)CCCC[C@H]12 253389852 VJGXIRQJQRPTAG-RZQQEMMASA-N 334.436 2.823 5 50 EFBA biogenic CN1C(=O)c2oc3ccccc3c(=O)c2[C@@H]1c1cccc([N+](=O)[O-])c1 2209396 NMRDKSGLVYEJMZ-HNNXBMFYSA-N 336.303 2.876 5 50 EFBA CCOP(=O)(OCC)[C@@H](OC(N)=O)c1ccc([N+](=O)[O-])cc1 3185549 AZUCIFQBAURMGE-LLVKDONJSA-N 332.249 2.955 5 50 EFBA O=[N+]([O-])c1ccc2oc(CN3CC[C@]4(O)CCCC[C@@H]4C3)nc2c1 160719509 AGBPJQPSEHASLP-SJKOYZFVSA-N 331.372 2.863 5 50 EFBA O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1nccs1 5024415 HPWINJBOYWALLH-UHFFFAOYSA-N 335.370 2.658 5 50 EFBA COc1cc2nc3c4ccccc4n(CC(=O)O)c3nc2cc1OC 4744605 SAJOPMOINVGKFZ-UHFFFAOYSA-N 337.335 2.840 5 50 EFBA CC(C)n1nc(O)c2c1NC(=O)CS[C@@H]2c1cccc([N+](=O)[O-])c1 5686035 ARYVKDDMYXSLLM-CYBMUJFWSA-N 348.384 2.853 5 50 EFBA Cc1nn([C@@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 6527462 WNFZWSKNQXUDJC-GVMDUPDNSA-N 332.404 2.746 5 50 EFBA CCOC(=O)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 124884078 BOPFYBPZRNKJFH-UHFFFAOYSA-N 338.335 2.539 5 50 EFBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2)C1 164972594 LYGNTURYCAAAID-MRXNPFEDSA-N 328.324 2.514 5 50 EFBA CCOC(=O)C1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 2839032 ZIXKAXSFKIRYJL-LBPRGKRZSA-N 334.372 2.500 5 50 EFBA O=C1CCCC(=O)C1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 100014475 OUBCNLGXQFSTLU-UHFFFAOYSA-N 329.230 2.735 5 50 EFBA fda CC1(C)[C@]2(C)CC[C@@]1(C(=O)O)c1nc3cc([N+](=O)[O-])ccc3nc12 531186 HWUDCJQHSCEQFZ-SJORKVTESA-N 327.340 2.952 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)Cc1ccccc1 4091033 NQPYSXCMGOGCRB-UHFFFAOYSA-N 329.381 2.959 5 50 EFBA Cc1[nH]ccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 177643984 NSMJMBVTDSBMSH-UHFFFAOYSA-N 329.356 2.915 5 50 EFBA CCc1nn(C)c(NCC(=O)Nc2ccc(Cl)cc2)c1[N+](=O)[O-] 170615789 FHHDJBMASZKNFF-UHFFFAOYSA-N 337.767 2.595 5 50 EFBA COc1ccc(CCNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 452610 UMUCNUGRTZKFEO-JXMROGBWSA-N 326.352 2.976 5 50 EFBA O=C(C[C@@H]1OCCc2ccccc21)Nc1cc([N+](=O)[O-])ccc1O 135340564 JIKMVLOHGWUQGO-INIZCTEOSA-N 328.324 2.943 5 50 EFBA O=C(c1ccn(COc2ccccc2[N+](=O)[O-])n1)N1CCCCCC1 2800127 YNYLVKDMRIIGLM-UHFFFAOYSA-N 344.371 2.844 5 50 EFBA O=[N+]([O-])c1cc([N+](=O)[O-])c2[nH]c3c([N+](=O)[O-])cc([N+](=O)[O-])cc3c2c1 95827668 JUSWGNJYSBSOFM-UHFFFAOYSA-N 347.199 2.954 5 50 EFBA COC(=O)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 1060046 RVWCLVOLEVJOBU-UHFFFAOYSA-N 344.323 2.707 5 50 EFBA C[C@H]1CN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)N1 4663379 QQXPEFSDYYTWGB-OCAPTIKFSA-N 348.281 2.708 5 50 EFBA Cc1cc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c([N+](=O)[O-])cc1C 101376682 ZNHRNLLNDSREKT-CZPYZCIJSA-N 338.363 2.913 5 50 EFBA O=C1C[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)O1 616970 BDIMBBHVLORZBG-GDBMZVCRSA-N 326.308 2.838 5 50 EFBA c1ccc2c(c1)c1ccccc1n2C[C@H]1C[N+]23CCO[B-]2(OCC3)O1 195796546 DXMWLFUTGSBSNH-QGDMRXHLSA-N 336.200 2.506 5 50 EFBA O=C(NC[C@@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1)c1ccccc1 192477253 FDDHPTCCVGQBLT-LBPRGKRZSA-N 346.412 2.698 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4818978 RNYHKVAMKBTAQE-UHFFFAOYSA-N 347.321 2.835 5 50 EFBA CC1(C)[C@H](c2ccccc2)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1 421723157 SLPFEEXBBLBQQE-INIZCTEOSA-N 342.399 2.976 5 50 EFBA O=[N+]([O-])c1cccc(-c2noc(CN3CCO[C@H]4CCCC[C@H]43)n2)c1 230198299 BJLCAZZXSGCWOB-CABCVRRESA-N 344.371 2.788 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)n1c(C)nc2ccccc21 6234214 ILVCPQPMRPHZSG-UHFFFAOYSA-N 331.353 2.798 5 50 EFBA in-vitro COC(=O)c1ccc(NC(C)=O)cc1OCc1ccc([N+](=O)[O-])cc1 14007257 CVUKWVVZWXRENP-UHFFFAOYSA-N 344.323 2.919 5 50 EFBA O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCOC2(CCCC2)C1 170055310 WRAYXWOSDDPEHH-OAHLLOKOSA-N 347.415 2.928 5 50 EFBA Nc1cc(CC(=O)N[C@@H]2CCCOc3ccccc32)ccc1[N+](=O)[O-] 408515258 SXSUPRIHYHKAOV-OAHLLOKOSA-N 341.367 2.750 5 50 EFBA O=C1C[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)O1 616968 BDIMBBHVLORZBG-GOEBONIOSA-N 326.308 2.838 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1cccs1 4104337 QXZLHTWZXBQUGZ-UHFFFAOYSA-N 337.382 2.792 5 50 EFBA COc1ccc(CN(C)[C@@H]2Cc3ccccc3[C@H]2O)cc1[N+](=O)[O-] 252512621 TVOMOHXIRDWKOQ-SJLPKXTDSA-N 328.368 2.694 5 50 EFBA CCOC(=O)c1c2n(c3cc(Cl)c([N+](=O)[O-])cc3c1=O)CCC2 202017 JUNDUZGFJQOYRB-UHFFFAOYSA-N 336.731 2.686 5 50 EFBA O=[N+]([O-])c1ccc(N2CCOCC2)c(C2=NCCc3ccccc32)c1 4571345 QPUZNJHOYTZJAH-UHFFFAOYSA-N 337.379 2.825 5 50 EFBA CN1C(=O)c2oc3ccccc3c(=O)c2[C@H]1c1cccc([N+](=O)[O-])c1 2209398 NMRDKSGLVYEJMZ-OAHLLOKOSA-N 336.303 2.876 5 50 EFBA Cc1nnc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c34)C2=O)s1 354707 PSRMOLGWPSXUTN-UHFFFAOYSA-N 340.320 2.709 5 50 EFBA O=[N+]([O-])c1cc(Cl)ccc1N1CCC(CO)(NCC2CC2)CC1 408523848 NYMRXNOZSMESNQ-UHFFFAOYSA-N 339.823 2.579 5 50 EFBA NS(=O)(=O)c1cccc(NCc2cc(Cl)ccc2[N+](=O)[O-])c1 225425276 CRURGTUKHSPCDG-UHFFFAOYSA-N 341.776 2.508 5 50 EFBA Nc1ccc([N+](=O)[O-])c(N2CCC[C@H](Oc3ncccc3F)C2)c1 253396515 AOPMIDZHWXUGJT-LBPRGKRZSA-N 332.335 2.759 5 50 EFBA COc1cccc(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)c1[N+](=O)[O-] 194543733 BMBJKUFVBLYGAM-UONOGXRCSA-N 344.371 2.714 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C(=O)O)cccc1[N+](=O)[O-] 2923756 DUZVNHFQMMSBFB-UHFFFAOYSA-N 345.267 2.762 5 50 EFBA COc1cc(CCNC(=O)C2C=CC=CC=C2)c([N+](=O)[O-])cc1OC 241121834 JEEUFFWLHNTROX-UHFFFAOYSA-N 344.367 2.569 5 50 EFBA O=[N+]([O-])c1ccc(Br)cc1I 91301567 VWDMDPDGACOPSR-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA in-vitro COc1nonc1O[C@@H](C)CNc1ccc([N+](=O)[O-])cc1Cl 5354402 MYUDJCOHQWVBHE-ZETCQYMHSA-N 328.712 2.519 5 50 EFBA CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 164693299 PAQVWFWUCQFCTP-WFASDCNBSA-N 336.388 2.872 5 50 EFBA O=C(NC[C@@H](O)c1cccc(F)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 762393560 RBTKLCSSGKCBHX-MRXNPFEDSA-N 343.314 2.679 5 50 EFBA CCC(=O)Oc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 501809 JLAMGKQURBKVSC-UHFFFAOYSA-N 340.291 2.711 5 50 EFBA CCC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@](O)(C(C)(C)C)C1 1100264 NFRZVSOKIXLQQY-KRWDZBQOSA-N 333.388 2.870 5 50 EFBA COC(=O)c1ccc(NC(=O)c2ccccc2CC[N+](=O)[O-])cc1 5355460 KYRILNLIVROCQC-UHFFFAOYSA-N 328.324 2.545 5 50 EFBA COc1cccc(N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1 55291953 NQFYBFBKUGELSD-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA COc1cccc(CCNC(=O)c2cc(F)c([N+](=O)[O-])cc2F)c1 154625777 CNKQDCSWEVKNLZ-UHFFFAOYSA-N 336.294 2.854 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N(c1ccccc1)[C@@H]1CCOC1 192064444 JSNDXSUMEXTNRX-MRXNPFEDSA-N 326.352 2.959 5 50 EFBA CCCN1CCC(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 4333581 WAKCOPSNRVRPLU-UHFFFAOYSA-N 332.448 2.591 5 50 EFBA COc1ccc(NC(=O)CN2CCc3ccccc3C2)c([N+](=O)[O-])c1 4821457 JNCYKNJPKDAWDT-UHFFFAOYSA-N 341.367 2.600 5 50 EFBA Cc1cc([N+](=O)[O-])nn1CCNC(=O)c1ccc(Cl)cc1Cl 2803044 JBFWHXYHJRBCDZ-UHFFFAOYSA-N 343.170 2.837 5 50 EFBA CC(=O)c1cc(NCc2ccc(-n3cncn3)cc2)ccc1[N+](=O)[O-] 341694963 AGFTYJNFQQSKJR-UHFFFAOYSA-N 337.339 2.990 5 50 EFBA O=C(O)C[C@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 263031144 VADHJLQFQTZAEQ-SNVBAGLBSA-N 334.353 2.889 5 50 EFBA C[C@@H](NC(=O)c1cccc(-c2ncn[nH]2)c1)c1cccc([N+](=O)[O-])c1 161087071 QMDKWSNKRUKQCI-LLVKDONJSA-N 337.339 2.871 5 50 EFBA O=C(NCC1(CCO)CC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 170601414 OFTWPFGOEAHNCL-UHFFFAOYSA-N 347.396 2.611 5 50 EFBA O=c1onc(-c2ccncc2)n1Cc1cc([N+](=O)[O-])ccc1Cl 193467288 FXTXKYBWIYFPNG-UHFFFAOYSA-N 332.703 2.508 5 50 EFBA O=C(O)c1cc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)ccc1Cl 4903585 ITLJICJUYWXNPU-UHFFFAOYSA-N 346.682 2.747 5 50 EFBA Cc1cc(C(=O)Nc2nc(C)c(C(=O)N(C)C)s2)ccc1[N+](=O)[O-] 2764696 CXWNPMAAFYADMS-UHFFFAOYSA-N 348.384 2.622 5 50 EFBA CCC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 4994040 YXLSIHSYKBPLCV-UHFFFAOYSA-N 331.294 2.672 5 50 EFBA O=C(Cn1cc([N+](=O)[O-])cn1)N(CC(F)F)c1cccc(Cl)c1 176936028 ITZYIWLAALCKKA-UHFFFAOYSA-N 344.705 2.743 5 50 EFBA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 239433627 YEPKVCZGNVXKKG-MUAIWGBPSA-N 344.754 2.806 5 50 EFBA O=[N+]([O-])c1cc(Br)ccc1I 28278313 XLUAZLDTZYHVSO-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA in-vitro Cc1cc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)no1 2794597 QEDDNUBLUCIDEI-UHFFFAOYSA-N 341.327 2.697 5 50 EFBA C[C@H]1C[C@@H]1c1ccc(CN(c2ncc([N+](=O)[O-])c(N)n2)C2CC2)o1 170620863 VROHXSZELNXUCX-CABZTGNLSA-N 329.360 2.852 5 50 EFBA COc1ccc(CCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 253659 XUETXUJTJYCKIE-IZZDOVSWSA-N 326.352 2.976 5 50 EFBA biogenic CCOc1cc(C=O)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 4813843 SEUZKSFHVBMRAJ-UHFFFAOYSA-N 344.323 2.824 5 50 EFBA N=C1NC(=O)/C(=C/c2ccc(-c3cc([N+](=O)[O-])ccc3O)o2)S1 23128326 XYLXSFPFVTYSKB-SDQBBNPISA-N 331.309 2.699 5 50 EFBA CCOC(=O)c1ccc(NC(=O)c2ccccc2CC[N+](=O)[O-])cc1 1398076 ZSAWVOZQGQWWME-UHFFFAOYSA-N 342.351 2.935 5 50 EFBA Cc1nc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2c(=O)n1-c1ccccc1 4785056 GETFMNWPSONPLP-UHFFFAOYSA-N 326.268 2.511 5 50 EFBA O=c1c2ccccc2c(=O)c2c1ccc1c(=O)c3ccccc3c(=O)c12 43214906 VYXBEALTHSTXNA-UHFFFAOYSA-N 338.318 2.616 5 50 EFBA CN1CCN([C@]23CCCCC2=Cc2cc([N+](=O)[O-])ccc2O3)CC1 80826 QBUOZFOFFOMNGB-SFHVURJKSA-N 329.400 2.888 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCOC[C@H]1C[C@@H](O)c1ccccc1 253421695 FFLQSCBOGPXHRI-IEBWSBKVSA-N 342.395 2.919 5 50 EFBA O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CCCN(c2nccnc2O)C1 276222369 MCTQQSONEBNXBK-LLVKDONJSA-N 349.778 2.825 5 50 EFBA O=C(c1ccc([N+](=O)[O-])o1)N1CCN(c2cccc(Cl)c2)CC1 47039 NVHGUQMIITYUCB-UHFFFAOYSA-N 335.747 2.804 5 50 EFBA CCN(CC)C(=O)CSc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 1430880 UTNSJBYIQUETMW-UHFFFAOYSA-N 334.401 2.945 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1-c1ccc([C@@H]2N[C@@H](C(=O)O)CS2)o1 4974171 FWYBBEHLFYFMNJ-BXUZGUMPSA-N 334.353 2.951 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cn2ccnc2)cc1 170604811 FIHJDVVFYDEFRZ-UHFFFAOYSA-N 337.339 2.674 5 50 EFBA Cc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-] 208613 SRGUYWDYFTUMFY-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA CCOCCc1nnc(NC(=O)c2cccc([N+](=O)[O-])c2C)s1 2877098 WRCIKVRNZJDGFL-UHFFFAOYSA-N 336.373 2.586 5 50 EFBA Cc1cc(C)c(S(=O)(=O)N2CCc3ccccc3C2)cc1[N+](=O)[O-] 4263280 LZLNILUNXVDCMF-UHFFFAOYSA-N 346.408 2.959 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 248662582 HCGQVYVRPQXARF-DZGCQCFKSA-N 333.436 2.573 5 50 EFBA O=[N+]([O-])c1ccc([C@]2(O)C[n+]3ccccc3N2c2ccccc2)cc1 5738305 DJWJJKIPJFKNNF-LJQANCHMSA-N 334.355 2.879 5 50 EFBA Cn1c(CCNC(=O)c2csc([N+](=O)[O-])c2)nc2ccc(F)cc21 347761958 VFNRPGPBIXLJNL-UHFFFAOYSA-N 348.359 2.655 5 50 EFBA CC(=O)c1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] 8730199 CUWRBGCBLGPNCZ-UHFFFAOYSA-N 349.387 2.855 5 50 EFBA O=C(Nc1cccc(-n2ccnc2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc12 194556203 QSUQDAUVRZPSPP-UHFFFAOYSA-N 348.322 2.909 5 50 EFBA CS(=O)(=O)N1N=C(c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 242178843 XBIOSFFTBSFRLN-INIZCTEOSA-N 345.380 2.706 5 50 EFBA CN1CCN(c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2)CC1 4748772 TVRQRQUJLFNZHF-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 17068244 PLARJUONMFLQEI-CQSZACIVSA-N 332.356 2.672 5 50 EFBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 4093675 GDYCQTYHCIAVBY-UHFFFAOYSA-N 325.733 2.968 5 50 EFBA O=C(NCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 192629257 GLDUPYUSJGDHQO-HNNXBMFYSA-N 329.356 2.585 5 50 EFBA CN1C(=O)C(C)(C)N(C(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 238017 NISJTNNYIYXNTE-UHFFFAOYSA-N 339.351 2.997 5 50 EFBA Cc1ccc(Nc2nc(N3CCOCC3)nc(C)c2[N+](=O)[O-])c(C)c1 4758647 GZWGWUWEKQZLEO-UHFFFAOYSA-N 343.387 2.890 5 50 EFBA CCN(CC)CCCN1C(=O)CS[C@@H]1c1cccc([N+](=O)[O-])c1 4905984 JMZHNKUOKISIHP-MRXNPFEDSA-N 337.445 2.901 5 50 EFBA O=C(N=c1[nH]nc(-c2ccsc2)s1)c1ccc([N+](=O)[O-])s1 328586708 CLXCKQQDVVZNCL-UHFFFAOYSA-N 338.395 2.911 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@@](C)(c2ccccc2)C1 156652127 MLWVYERPYCZCGW-GOSISDBHSA-N 341.367 2.686 5 50 EFBA O=C1OC(c2ccccc2[N+](=O)[O-])=N/C1=C\c1ccc2c(c1)OCO2 4557643 LFGKVRCOJCMJLI-GHXNOFRVSA-N 338.275 2.668 5 50 EFBA O=C(NCCO)c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1Cl 194341113 SHVGKDTXSSTOJY-UHFFFAOYSA-N 349.774 2.582 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1ncc(-c2ccccc2)cn1 189755551 CPYDKHJOBXJBMA-UHFFFAOYSA-N 349.350 2.564 5 50 EFBA O=C(NC(=S)Nc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-] 453582 ZMZHRUIODOQPMY-UHFFFAOYSA-N 336.760 2.770 5 50 EFBA Cn1nc(C(C)(C)C)cc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 299071922 SOFIDZKEZOVDFF-UHFFFAOYSA-N 330.388 2.598 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@@H](O)Cc1ccccc1 194938000 QUMRECXUJSQNFH-BBRMVZONSA-N 328.368 2.625 5 50 EFBA O=C(Nc1ccccc1N1CCOCC1)c1cccc([N+](=O)[O-])c1 2819314 JLJLNIVXUPAMTC-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA aggregator CC1=C(C(=O)OCC(C)C)[C@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 124189 PAMHMEJHODULOD-HNNXBMFYSA-N 347.371 2.764 5 50 EFBA COCCNc1c([N+](=O)[O-])c(=O)n(-c2ccccc2)c2ccccc12 4426957 RSQNVNFJLZQTQI-UHFFFAOYSA-N 339.351 2.957 5 50 EFBA CO[C@@H](C)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Br 188372057 QFIJHOSFRBCXEO-YUMQZZPRSA-N 331.166 2.511 5 50 EFBA NC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1Cl 169195 MMRYSQRORXUFDJ-NTEUORMPSA-N 345.742 2.504 5 50 EFBA COC(=O)c1cc(C(=O)N2CCc3ccccc32)cc([N+](=O)[O-])c1 60848 AFOMMKFRRGKKRA-UHFFFAOYSA-N 326.308 2.584 5 50 EFBA COc1ccc(Cl)cc1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 196116 YPRJIDSLFKJXEI-UHFFFAOYSA-N 338.751 2.709 5 50 EFBA Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1[N+](=O)[O-] 8397714 DBTYVPVHEPZTLO-UHFFFAOYSA-N 346.255 2.972 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCN(C[C@H]2C[C@H]3C=C[C@H]2C3)CC1 100709433 WRESZNUCZXPYJA-XYJFISCASA-N 327.428 2.925 5 50 EFBA O=C(CC12CC3CC(CC(C3)C1)C2)NCCn1cc([N+](=O)[O-])cn1 6828512 RAXOCFDEJHRZHA-UHFFFAOYSA-N 332.404 2.514 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCOC2(CCCCCC2)C1 164250507 KVIFRBDFZFHSCN-UHFFFAOYSA-N 334.372 2.866 5 50 EFBA Cc1cccc(C(=O)N[C@H](CC(=O)O)c2cccc([N+](=O)[O-])c2)c1 3623481 KOHPPSZEJGCFQY-OAHLLOKOSA-N 328.324 2.849 5 50 EFBA O=C1/C(=C/c2cc([N+](=O)[O-])ccc2O)NC(=S)N1c1ccccc1 4955073 HBKDIINMVXTTNE-LCYFTJDESA-N 341.348 2.563 5 50 EFBA CCN(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br 4993677 JOUSBFZAXJFDKA-UHFFFAOYSA-N 330.182 2.638 5 50 EFBA CC(C)NS(=O)(=O)c1ccc(NCc2ccccc2[N+](=O)[O-])cc1 120085869 GMDKYZQGWDJMKM-UHFFFAOYSA-N 349.412 2.894 5 50 EFBA Cc1c(NC(=O)CCN2CCO[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] 230127008 HOJASRVGCRIZEQ-SJORKVTESA-N 347.415 2.875 5 50 EFBA Cc1cc(NC(=O)N2CC[C@@H](c3cnn(C)c3)C2)ccc1[N+](=O)[O-] 153720979 UBWZQZXHMTYTKU-GFCCVEGCSA-N 329.360 2.658 5 50 EFBA O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)N1CCOCC1 84746 AKSPAGGQQDAQEH-FNORWQNLSA-N 328.324 2.727 5 50 EFBA C[C@H](OC[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 185453449 WPWFAQRLSSKAQX-NWDGAFQWSA-N 345.355 2.666 5 50 EFBA O=[N+]([O-])c1ccc(CSc2nnnn2-c2ccc(O)cc2)cc1F 170658569 ONHOJEUJMMUWLH-UHFFFAOYSA-N 347.331 2.708 5 50 EFBA COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 265811 ADFHQILEEGJYHM-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=C(Oc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879752 QTHLGHJXCVKVFL-UHFFFAOYSA-N 327.340 2.916 5 50 EFBA O=[N+]([O-])c1ccc(CSc2nnnn2Cc2ccccc2)cc1 4868767 KSHJBYVYGTXWOF-UHFFFAOYSA-N 327.369 2.922 5 50 EFBA CCCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc([N+](=O)[O-])s1 3905820 LVUPYNWNOCBPTD-LBPRGKRZSA-N 339.373 2.628 5 50 EFBA CC(C)SCc1nnc2sc(-c3ccc([N+](=O)[O-])o3)nn12 1775972310 UWYOHQRNROFVAT-UHFFFAOYSA-N 325.375 2.996 5 50 EFBA CCOC(=O)C1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 159825 GHNWRIUGIUCKQR-UHFFFAOYSA-N 340.763 2.664 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccccc2OCc2ccccc2)N1 90392 PVMKAAOHTYLXNF-MAUKXSAKSA-N 326.352 2.862 5 50 EFBA O=C1C[C@H](c2ccc([N+](=O)[O-])cc2)c2cc3c(cc2N1)OCCO3 423368 MJTBXMWHTRZIOX-GFCCVEGCSA-N 326.308 2.840 5 50 EFBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2c(F)c(F)cc(F)c2F)n1 356075 GEROZZPSCIZJOF-UHFFFAOYSA-N 332.213 2.620 5 50 EFBA Cc1cc(NC(=O)c2cc(C)nn2C)c2cc([N+](=O)[O-])ccc2n1 161780257 AOMWJDUCDDELCG-UHFFFAOYSA-N 325.328 2.746 5 50 EFBA CN1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 252477185 JUMDISCTDFHLDB-DOTOQJQBSA-N 343.358 2.909 5 50 EFBA COC[C@H](Cn1nccc1[N+](=O)[O-])c1ccc(Br)cc1 450813685 SRGLJGNWSRBUTD-NSHDSACASA-N 340.177 2.984 5 50 EFBA Cc1nc(C)c(CNc2ncc(Br)cc2[N+](=O)[O-])o1 253393839 UOZKHHBCNHDXSE-UHFFFAOYSA-N 327.138 2.969 5 50 EFBA Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])cc1C 100237446 XMDJOOASZSWWQK-GVAFMPQTSA-N 326.352 2.913 5 50 EFBA O=C(NC1CC(N2CCCCC2)C1)c1ccc(Cl)cc1[N+](=O)[O-] 225436900 RGDYEDQJTONCQH-UHFFFAOYSA-N 337.807 2.995 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N(c1ccccc1)[C@H]1CCOC1 192064449 JSNDXSUMEXTNRX-INIZCTEOSA-N 326.352 2.959 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 178841 FLIUPXFFDCLVLD-OTYXRUKQSA-N 333.344 2.564 5 50 EFBA CC(C)OC(=O)C[S@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4819552 INWSNHNSNKURDR-JOCHJYFZSA-N 339.291 2.673 5 50 EFBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(C2CCCCC2)CC1 20457649 XAQDJOPRYLFPAN-UHFFFAOYSA-N 331.416 2.614 5 50 EFBA Cc1nn(C(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)c(C)c1Cl 1432151 YLPZOGKRHUXLMB-UHFFFAOYSA-N 339.783 2.995 5 50 EFBA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 476649 VVHPOAAQLVZMOX-UHFFFAOYSA-N 349.368 2.662 5 50 EFBA CN1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 556335 MYXGDMIYNUPAKV-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA COC(=O)c1ccc(OC(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 4724943 LRMRSLLIMQYMOR-UHFFFAOYSA-N 345.307 2.918 5 50 EFBA Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cs1 4750462 CRDHPOZAVWDZOL-UHFFFAOYSA-N 331.397 2.927 5 50 EFBA CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCC[C@@H]1c1ccccc1 299074811 VOHWRVJNUDMULC-UKRRQHHQSA-N 340.383 2.861 5 50 EFBA CCc1nc(C2CCN(Cc3cc([N+](=O)[O-])ccc3OC)CC2)n[nH]1 190713801 DIISJUBGKROVDR-UHFFFAOYSA-N 345.403 2.664 5 50 EFBA CCCC1=C(C(=O)OCC)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 175942 UMWRXSTUWPHNJL-CQSZACIVSA-N 333.344 2.566 5 50 EFBA Cc1cccc([C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2O)n1 119313997 ISKOHOSMFBHSBC-CQSZACIVSA-N 327.340 2.981 5 50 EFBA O=C1[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CCCN1c1cccnc1 253427185 XAMNOAJQHAWZFK-GFCCVEGCSA-N 347.762 2.646 5 50 EFBA CCOC(=O)[C@@H](Cc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C 168358718 PVELRGGHRVALPS-CYBMUJFWSA-N 338.360 2.594 5 50 EFBA O=C1CS[C@H](c2cccc([N+](=O)[O-])c2)N1CCN1CCCCC1 208073 PTTQZFIDRHTRRS-MRXNPFEDSA-N 335.429 2.655 5 50 EFBA CCOCc1ccc(-c2noc(-c3nn(C)cc3[N+](=O)[O-])n2)cc1 225591695 JVBMWOOFPKBEKX-UHFFFAOYSA-N 329.316 2.582 5 50 EFBA C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H]1CO 190239398 PHDNBKBHIUSECT-QPUJVOFHSA-N 347.293 2.848 5 50 EFBA O=C(NC[C@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1)c1ccccc1 192477264 FDDHPTCCVGQBLT-GFCCVEGCSA-N 346.412 2.698 5 50 EFBA Cn1cc(-c2oncc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cn1 225495968 HSVPEWCZMDARJD-UHFFFAOYSA-N 347.718 2.889 5 50 EFBA COc1cc(N[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C)ccc1[N+](=O)[O-] 252477369 MQMACDRHCXUVHG-NUEKZKHPSA-N 349.431 2.905 5 50 EFBA Cc1nn(C)c(NCCc2c[nH]c3cnc(Cl)cc23)c1[N+](=O)[O-] 1775985654 JPLWYYAIZHOEFL-UHFFFAOYSA-N 334.767 2.821 5 50 EFBA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 248171830 WQJDSPULIYMXRJ-TYNCELHUSA-N 334.372 2.693 5 50 EFBA CC1=C(Br)CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 282105124 YJEKDMYMRSJKTC-UHFFFAOYSA-N 340.177 2.573 5 50 EFBA COc1ccccc1C[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 4644550 ZZZIXVXAOAJZNO-CYBMUJFWSA-N 340.335 2.726 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(c2nccs2)CC1 194975249 LSDIGVFOCUJDKO-UHFFFAOYSA-N 347.400 2.796 5 50 EFBA O=C(NCc1ccccc1)c1cn(Cc2ccc([N+](=O)[O-])cc2)cn1 71775358 WEBWPAPOXXSVFZ-UHFFFAOYSA-N 336.351 2.770 5 50 EFBA C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ncc([N+](=O)[O-])s1 192457201 GDAKYCAPBVNTTP-YPMHNXCESA-N 333.417 2.769 5 50 EFBA Cc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 4117516 VDNYAALBMPTPBM-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2cccc([N+](=O)[O-])c2)N1 188516 CYXGKHWORVZUGJ-CVEARBPZSA-N 337.335 2.764 5 50 EFBA biogenic CC(=O)Nc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 318835 INRVXXKFRUNFTH-UHFFFAOYSA-N 329.312 2.571 5 50 EFBA Cc1cc(F)c(NC(=O)[C@@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] 253396600 QUJFTWBJRIQRCV-SNVBAGLBSA-N 332.335 2.834 5 50 EFBA COc1ccc([N+](=O)[O-])c(N2CCN(C(=O)OC(C)(C)C)CC2)c1 40456613 OGPKHZOURJVUKL-UHFFFAOYSA-N 337.376 2.661 5 50 EFBA in-vitro COc1ccc(C(=O)Nc2nnc(CC(C)C)s2)cc1[N+](=O)[O-] 468722 UYFKIXKUIYFHQN-UHFFFAOYSA-N 336.373 2.906 5 50 EFBA CN(CC(=O)Nc1ccc(Cl)cn1)Cc1ccccc1[N+](=O)[O-] 192637366 YHKRFFACTLYJHF-UHFFFAOYSA-N 334.763 2.714 5 50 EFBA CC(C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4187891 UWZNZESRCZDAID-UHFFFAOYSA-N 325.796 2.943 5 50 EFBA COc1ccc(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC 4978720 NXPFHSRJTSRICB-UHFFFAOYSA-N 345.355 2.976 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 156012053 LBQFSUATHLWQMY-JKSUJKDBSA-N 327.340 2.683 5 50 EFBA CCOc1ccc2c(c1)CN(C(=O)c1cccc([N+](=O)[O-])c1O)CC2 127470643 IKSOFXWFDUUFEL-UHFFFAOYSA-N 342.351 2.898 5 50 EFBA COc1cc(N[C@@H]2CCN(Cc3ccccc3)C2=O)ccc1[N+](=O)[O-] 266468730 ZPXAYTGJUQDHKA-OAHLLOKOSA-N 341.367 2.816 5 50 EFBA CCc1nc2ccccc2n1C[C@H](O)COc1ccc([N+](=O)[O-])cc1 447026 BSKGLBYLEXISQI-AWEZNQCLSA-N 341.367 2.947 5 50 EFBA O=C(Cn1cnc2ccc(Cl)cc2c1=O)c1ccccc1[N+](=O)[O-] 3121736 AJPANXSNOWINDP-UHFFFAOYSA-N 343.726 2.841 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1 17068221 UBSYTORUDLHNLU-IINYFYTJSA-N 332.356 2.814 5 50 EFBA CCO[C@@H]1C[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C12CCC2 183598795 FNLBUBPYIXMQND-UONOGXRCSA-N 334.376 2.801 5 50 EFBA Nc1ccc([N+](=O)[O-])c(N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)c1 193527111 RYTPJXRGNLZBPD-CQSZACIVSA-N 344.346 2.529 5 50 EFBA CCC(=O)Nc1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 859413 ILFSUSXHJFZXOP-UHFFFAOYSA-N 343.339 2.961 5 50 EFBA O=C(NCc1nc(-c2cccs2)c[nH]1)c1ccc(O)c([N+](=O)[O-])c1 170614240 VHUQOPMKEWURQX-UHFFFAOYSA-N 344.352 2.682 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 92588 ZIBIRUTZKIEBIT-VIFPVBQESA-N 338.307 2.558 5 50 EFBA Cc1nn(C[C@H](O)c2ccc(F)c(Br)c2)cc1[N+](=O)[O-] 185069188 LYNZSYUJEIJPIT-LBPRGKRZSA-N 344.140 2.735 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cn2cccn2)cc1 170604939 PNYFCAQTPOKGPZ-UHFFFAOYSA-N 337.339 2.674 5 50 EFBA C[C@H]1CO[C@H](c2ccccc2)CN1c1ccc2ncc([N+](=O)[O-])n2n1 192655480 OBESSNOQVWVFME-JSGCOSHPSA-N 339.355 2.604 5 50 EFBA CC(C)n1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 281262638 WNVGLXMOCUDQCZ-UHFFFAOYSA-N 344.780 2.826 5 50 EFBA O=C(CCc1cccc([N+](=O)[O-])c1)Nc1nc2ccc(Cl)cn2n1 157034036 BBXGPHQNUMWEAC-UHFFFAOYSA-N 345.746 2.862 5 50 EFBA COc1ccc(C(=O)NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 620828 DYLKXPHHGMLAPV-UHFFFAOYSA-N 329.312 2.874 5 50 EFBA O=C(Nc1ncc([N+](=O)[O-])s1)c1ccc([N+](=O)[O-])c(Cl)c1 44682013 XCHLNGBTHLJLFG-UHFFFAOYSA-N 328.693 2.865 5 50 EFBA in-vitro COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC2(CCC2)C1 170662459 QPSRZENISPQAKZ-UHFFFAOYSA-N 333.388 2.808 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1NCc1nc2ccc(F)c(F)c2[nH]1 1875275306 SPXMDKNZIUHHJH-UHFFFAOYSA-N 336.302 2.886 5 50 EFBA Nc1c(NC(=O)C2CC=CC2)ccc(Br)c1[N+](=O)[O-] 1775993154 BQZLMSSTLIHKQM-UHFFFAOYSA-N 326.150 2.844 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC[C@@H]3CCC[C@H]32)s1 230103595 APNQSFZRNDMVJV-VHSXEESVSA-N 330.431 2.829 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(n2cncc2C)CC1 253430227 XZRVYUGACSQTRL-UHFFFAOYSA-N 328.372 2.885 5 50 EFBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(O)cc1C(=O)O 2950206 DAZJNKGUDVHJLN-FPYGCLRLSA-N 328.280 2.651 5 50 EFBA CCCn1c(C)nnc1COC(=O)/C=C/c1cccc([N+](=O)[O-])c1 135042204 CTDSTGSREPQGDI-BQYQJAHWSA-N 330.344 2.661 5 50 EFBA COc1ccccc1C(=O)NCCCNc1ccc([N+](=O)[O-])cc1 4543990 IHADTXMTDBWXIG-UHFFFAOYSA-N 329.356 2.835 5 50 EFBA Cc1ncc(COC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)s1 170591142 YYNKTVHKPFJIQS-UHFFFAOYSA-N 344.352 2.902 5 50 EFBA Cc1cc(F)c(NC(=O)[C@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] 253396589 QUJFTWBJRIQRCV-JTQLQIEISA-N 332.335 2.834 5 50 EFBA O=C(C[C@H]1OCCc2ccccc21)Nc1cc([N+](=O)[O-])ccc1O 135340542 JIKMVLOHGWUQGO-MRXNPFEDSA-N 328.324 2.943 5 50 EFBA CCN(CC)c1ccc(NC(=O)c2c([N+](=O)[O-])cnn2CC)cc1 2763797 JDENLIUTGHHOLJ-UHFFFAOYSA-N 331.376 2.910 5 50 EFBA O=C(NCc1ccn2ccnc2c1)c1ccc([N+](=O)[O-])cc1Cl 178058132 SOHSAXIIQUZYEC-UHFFFAOYSA-N 330.731 2.826 5 50 EFBA CCOc1ccc([C@H]2C([N+](=O)[O-])=C(C)N(C)C(=O)N2C)cc1OC 334919 APQSBIWSPAOSRK-HNNXBMFYSA-N 335.360 2.640 5 50 EFBA O=[N+]([O-])c1cccc(NC(=S)NCc2ccc3c(c2)OCO3)c1 612335 ZXFSKCIWQHJVLO-UHFFFAOYSA-N 331.353 2.810 5 50 EFBA Cn1cccc1[C@@H]1COCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 131946756 DHRRDNCZBOULSQ-HNNXBMFYSA-N 342.355 2.648 5 50 EFBA O=C(N[C@H]1CCO[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1O 156097044 LTGFZLONZXXJLT-BBRMVZONSA-N 328.324 2.560 5 50 EFBA Cc1oc(-c2ccsc2)nc1CC(=O)Nc1c([N+](=O)[O-])cnn1C 191276654 QRSSNPLFRGKBID-UHFFFAOYSA-N 347.356 2.534 5 50 EFBA COc1ccccc1N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 55543369 YYAHBHPMMMRUNN-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA O=C1[C@@H]2[C@@H](C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=C[C@H]2C12CC2 101357945 KQVNUOKAKUTQMC-JYILRKAJSA-N 344.754 2.950 5 50 EFBA COC(=O)[C@@H]1CN(c2cc(N)ccc2[N+](=O)[O-])C[C@H]1c1ccccc1 370286226 TYLFZRHMCYNPEX-LSDHHAIUSA-N 341.367 2.570 5 50 EFBA Cn1c(CCNC(=O)NC2CCCCC2)nc2cc([N+](=O)[O-])ccc21 13227695 VIHKIFLOYVVJQK-UHFFFAOYSA-N 345.403 2.656 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]3CCCC[C@H]32)s1 230218322 UVKJACMRZXODCC-WDEREUQCSA-N 330.431 3.000 5 50 EFBA Cc1c([N+](=O)[O-])c(C(=O)NCC23CC4CC(CC(C4)C2)C3)nn1C 6526686 SHNHFCHFWBWSEA-UHFFFAOYSA-N 332.404 2.583 5 50 EFBA COC(=O)c1nc([C@@H]2CCCN2c2ncccc2[N+](=O)[O-])sc1C 253431100 QCBUSXFVHOVXGH-NSHDSACASA-N 348.384 2.883 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@@H](CO)c1ccccc1)C2 253476027 OEXHQOGQTVQTAT-KWLWEVDOSA-N 332.464 2.854 5 50 EFBA fda O=[N+]([O-])c1c(O)nc(/C=C/c2ccc(Br)cc2)nc1O 18212739 XUGRMNSECXVKIV-ZZXKWVIFSA-N 338.117 2.729 5 50 EFBA CN(Cc1nc2c(s1)CCCC2)C(=O)c1ccc(O)c([N+](=O)[O-])c1 119124578 YFJGATSKUSLIKD-UHFFFAOYSA-N 347.396 2.908 5 50 EFBA Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2CCOC(C)(C)C2)c1F 324506687 HLWWJCATFGARLR-VIFPVBQESA-N 328.315 2.869 5 50 EFBA C[C@]1(F)CCN(c2ccc([N+](=O)[O-])c(N3CC[C@](C)(F)C3)n2)C1 408391629 DUYKWJBAKNRBCE-GJZGRUSLSA-N 326.347 2.866 5 50 EFBA CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCC[C@@H]1c1ccccc1 299074801 VOHWRVJNUDMULC-HIFRSBDPSA-N 340.383 2.861 5 50 EFBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2ccn[nH]2)C1 193850892 KGNNVVHYVFLQJW-STQMWFEESA-N 343.387 2.525 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1ccc(C(=O)O)cc1 5041950 QKQVUYKCUCGPID-UHFFFAOYSA-N 331.284 2.946 5 50 EFBA COc1ccc(OC)c(NC(=O)COc2ccccc2[N+](=O)[O-])c1 115671 JGZFWHGRHGANLJ-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA COc1ccc(CNCc2cc3c(cc2[N+](=O)[O-])OCO3)c(OC)c1 4891840 KQGRLSGTOCLTCT-UHFFFAOYSA-N 346.339 2.631 5 50 EFBA Cn1c(-c2ccccc2)cn(CC(=O)c2cccc([N+](=O)[O-])c2)c1=N 334157529 HAIZGHQOVDADBJ-UHFFFAOYSA-N 336.351 2.764 5 50 EFBA CCc1cc(N2CC(CN(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 408522843 MLZBGDFKPOKECX-UHFFFAOYSA-N 341.415 2.612 5 50 EFBA O=[N+]([O-])c1ccc(/C=C/c2nnnn2-c2ccc([N+](=O)[O-])cc2)cc1 5092935 NVGLBHXAWIDTNG-XCVCLJGOSA-N 338.283 2.649 5 50 EFBA COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] 14007315 ANJMFNJMNNJGRU-UHFFFAOYSA-N 337.376 2.661 5 50 EFBA in-vitro COc1ccc(NC(=O)c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 4842297 VHRNCGCFIXZYSW-UHFFFAOYSA-N 330.296 2.627 5 50 EFBA COc1ccc2oc(=O)c(C(=O)Nc3cccc([N+](=O)[O-])c3)cc2c1 105713 OGKPENASLWGVEU-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA COc1ccc(C(=O)NC(=S)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 4313503 YLBLGMNEKHBGRX-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA O=C(/C=C/c1ccco1)NC(=S)Nc1cc([N+](=O)[O-])ccc1F 456276 YZLJCAPQRUAAAI-GQCTYLIASA-N 335.316 2.853 5 50 EFBA COc1ccc(OC)c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 103340 TUWMOTBNNQLNKV-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 270901 JIABFMRDXFPWMC-BDJLRTHQSA-N 328.324 2.553 5 50 EFBA COC(=O)c1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 471374 ACDAOWSHAREXIE-UHFFFAOYSA-N 344.323 2.707 5 50 EFBA Cc1ccc(NC(=O)c2cc(C(=O)O)ccc2C(=O)O)c([N+](=O)[O-])c1 4313713 POWYJHGUZIKTFV-UHFFFAOYSA-N 344.279 2.552 5 50 EFBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H](c2ccsc2)O1 150868502 WIHOTYRXFLBTMZ-BMIGLBTASA-N 348.380 2.964 5 50 EFBA COc1cc(NC(=O)c2ccc(OC)c(OC)c2)cc([N+](=O)[O-])c1 2761569 QGXBAIJNNQYQQX-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 169994284 KBZULBQZHGSTSD-VQISRLSMSA-N 329.356 2.619 5 50 EFBA COc1c(OC)c(OC)c2c(c1OC)c(=O)c1ccccc1n2C 4098841 URPVDDXMEZAEJY-UHFFFAOYSA-N 329.352 2.726 5 50 EFBA biogenic,in-vitro CCOc1ccc(NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)cc1 4359573 HCPVQVOKZCHMGE-UHFFFAOYSA-N 347.352 2.555 5 50 EFBA Cc1cc(-c2nnc(SCC(=O)c3ccc([N+](=O)[O-])cc3)o2)no1 4735847 YPQVBABCBIKBAS-UHFFFAOYSA-N 346.324 2.916 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](c2ccc(F)cc2)C1 328588049 NQMLZOBVKPOOMX-LBPRGKRZSA-N 329.331 2.946 5 50 EFBA NC(=O)CCC1CCN(c2ccnc3c([N+](=O)[O-])cccc23)CC1 432321225 SVKGUDQQABXLEG-UHFFFAOYSA-N 328.372 2.625 5 50 EFBA O=c1[nH]c(O)nc(/C=C/c2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] 4501633 DWZDSROOLHIPKM-ZZXKWVIFSA-N 327.218 2.573 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccc(OCc3ccccc3)cc2)N1 89583 FVICUYAPMJJFFN-FUHWJXTLSA-N 326.352 2.862 5 50 EFBA O=C(OC[C@@H]1O[C@@H]1COCc1ccccc1)c1ccc([N+](=O)[O-])cc1 2584433 XBAOYRZETQXAAE-SJORKVTESA-N 343.335 2.736 5 50 EFBA CC1=NN(C(=O)c2ccccc2)[C@@](O)(c2ccc([N+](=O)[O-])cc2)C1 440682 GKMHMKOVWXCQHI-KRWDZBQOSA-N 325.324 2.662 5 50 EFBA O=C1[C@@H](Nc2ccc([N+](=O)[O-])cc2F)CCCN1c1cccnc1 253426374 GCBBXFLVJUOGDY-HNNXBMFYSA-N 330.319 2.736 5 50 EFBA CN(Cc1ccc(C(N)=O)cc1)c1ccnc2c([N+](=O)[O-])cccc12 1261233412 RBYSYYWVKVABHR-UHFFFAOYSA-N 336.351 2.878 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 17071816 UOAGXQWJYSFNSO-HNNXBMFYSA-N 344.367 2.958 5 50 EFBA COCc1cccc(-c2noc(-c3c([N+](=O)[O-])c(C)nn3C)n2)c1 273672540 BTYKXBXFPLYVCO-UHFFFAOYSA-N 329.316 2.500 5 50 EFBA COc1ccc(NC(=O)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 12420911 JOMFKECMUKJALA-UHFFFAOYSA-N 339.307 2.906 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCc1ccc2c(c1)OCO2 456866 XIXMIEGVHBUMEW-FNORWQNLSA-N 326.308 2.653 5 50 EFBA C[C@H](CCc1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 318661 NVARDQYWSBCUEA-CYBMUJFWSA-N 334.397 2.894 5 50 EFBA N=c1[nH]c(NCc2nc(-c3ccccc3F)cs2)ncc1[N+](=O)[O-] 364807790 LTQJZADBPKWDDU-UHFFFAOYSA-N 346.347 2.672 5 50 EFBA COc1cccc(C(=O)N[C@H](c2nccs2)C2CC2)c1[N+](=O)[O-] 194471073 HIDXZWTUIXXKNV-LBPRGKRZSA-N 333.369 2.941 5 50 EFBA COc1ccccc1C(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1 453745 DCYPMIMOAYBIQE-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA CNc1nn(C(=O)Nc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 5209326 NXKFZMZWMDAZIN-UHFFFAOYSA-N 329.238 2.932 5 50 EFBA CCc1nnc(CNc2cc(Br)cc([N+](=O)[O-])c2)o1 253415871 LKWLWPRDAVFTMH-UHFFFAOYSA-N 327.138 2.915 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(C2CCCCC2)C1 206324 FISAEQLGNNVXOB-LBPRGKRZSA-N 331.372 2.715 5 50 EFBA C[C@@H](CCc1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 318659 NVARDQYWSBCUEA-ZDUSSCGKSA-N 334.397 2.894 5 50 EFBA CCO[C@@H]1C[C@@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])[C@]12CCCO2 273521202 SAHYZSKYYWUHMV-BRWVUGGUSA-N 334.372 2.936 5 50 EFBA 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5 50 EFBA CC(=O)Nc1ccc(C(=O)O)c([N+](=O)[O-])c1OCc1ccccc1 669369659 FKGIADPYTSIXLG-UHFFFAOYSA-N 330.296 2.830 5 50 EFBA COc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc(OC)c1 5060025 JJVVBOTVBVPRMJ-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA O=[N+]([O-])c1ccc(N[C@H](CO)Cc2nccs2)cc1OC(F)F 1775994462 PKFWPWBRPKJGSW-VIFPVBQESA-N 345.327 2.668 5 50 EFBA COc1cc(C(=O)OCc2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 467115 BQYSBNRFOOXCSU-UHFFFAOYSA-N 347.323 2.978 5 50 EFBA O=C(c1ccccc1F)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19347625 DBKMEGPCWITIRR-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2ccccc2oc1=O 145358 YEVFIOZHCZDGCZ-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)c1c(O)c2ccccc2oc1=O 187286 FNDIXALEVBRVRC-UHFFFAOYSA-N 326.264 2.659 5 50 EFBA CCOc1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c([N+](=O)[O-])c1 4894103 YXRPEKKZQFSYDN-NWDGAFQWSA-N 334.328 2.599 5 50 EFBA CC[C@@H](c1nc2c3ccccc3ncn2n1)n1nc([N+](=O)[O-])cc1C 2806644 KGHHBRINFWMRTL-ZDUSSCGKSA-N 337.343 2.690 5 50 EFBA O=[N+]([O-])c1cc(Br)c(F)cc1OCCC1OCCO1 188649449 CKSWDILIJIOTTR-UHFFFAOYSA-N 336.113 2.638 5 50 EFBA Cc1ccc(S(=O)(=O)n2cnc3cc([N+](=O)[O-])ccc32)cc1C 4616142 PCBUKBMZHNZWFM-UHFFFAOYSA-N 331.353 2.798 5 50 EFBA O=C(Nc1cccc(F)c1)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 215060 KANLPVAKTDEWTO-UHFFFAOYSA-N 330.275 2.824 5 50 EFBA O=C(Nc1cccnc1Cl)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 2762367 MLEKCUYNNVVIHT-UHFFFAOYSA-N 347.718 2.733 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1cccc([N+](=O)[O-])c1 62711 XDYUYEYDZPQVEI-OAHLLOKOSA-N 330.296 2.893 5 50 EFBA O=C(NCc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4088052 WLTNBBLLKITBMP-UHFFFAOYSA-N 333.731 2.503 5 50 EFBA COc1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 52721393 HRLRESZPZXUMAI-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 456472 RZWRPUYOFHNSMR-JTQLQIEISA-N 340.763 2.664 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C(F)(F)F)nn1C 2762077 ABVBLJKNNBGKKB-UHFFFAOYSA-N 328.250 2.908 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(c2ccccc2)C1 115105346 FBQITMLNFZKOKQ-MRXNPFEDSA-N 339.395 2.923 5 50 EFBA O=C(CCn1cc(Br)cn1)Nc1ccccc1[N+](=O)[O-] 164576092 XJYPSZULDMSGOY-UHFFFAOYSA-N 339.149 2.583 5 50 EFBA COc1cccc(C(=O)N[C@@H](CC(=O)O)c2cccc([N+](=O)[O-])c2)c1 111570 HDOOBAXIEVZOIJ-HNNXBMFYSA-N 344.323 2.549 5 50 EFBA N=c1c2c(=O)oc3ccccc3c2ccn1C[C@H](O)c1cccc(O)c1 1848443031 SJDNQPAWIDBRDU-INIZCTEOSA-N 348.358 2.666 5 50 EFBA O=[N+]([O-])c1ccccc1OCc1nc(-c2ccc3c(c2)OCO3)no1 4745629 SVNIUCJNQZUYQO-UHFFFAOYSA-N 341.279 2.953 5 50 EFBA COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@H](C)Cn1ccnc1 225387930 MZAATBWUFPTFLW-LLVKDONJSA-N 332.360 2.635 5 50 EFBA COC(=O)c1ccc(S(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 259811 AMEPIXUADUTMFD-UHFFFAOYSA-N 335.337 2.523 5 50 EFBA COCCN1C(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2C1=O 2881238 OUUUXDCWLOVYQF-UHFFFAOYSA-N 342.307 2.630 5 50 EFBA O=C(Nc1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 102105833 ZRVLRHOWKLIQPJ-UHFFFAOYSA-N 332.228 2.664 5 50 EFBA COC(=O)c1cc(NC(=O)c2ccc(Cl)cn2)cc([N+](=O)[O-])c1 136151952 GTTAGJOYMXBPTM-UHFFFAOYSA-N 335.703 2.682 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCN(c2ccccn2)C1 162764525 ZHYUAXLWBUQNBR-CYBMUJFWSA-N 341.371 2.699 5 50 EFBA Cc1ccc(N2C[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)cc1 4402361 WTALWZCRMRDCSK-CYBMUJFWSA-N 339.351 2.895 5 50 EFBA COc1ccc(CCNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 1077102 HTXZWULWBPBZBP-UHFFFAOYSA-N 345.355 2.976 5 50 EFBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2CC=C(Cl)C[C@@H]2C1=O 100634207 QMBQBFXCJNMJBG-QWRGUYRKSA-N 336.731 2.626 5 50 EFBA Cc1csc(NC(=O)CSc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 45068043 SIEWUWNPNWDEFY-UHFFFAOYSA-N 349.397 2.967 5 50 EFBA C[C@H](NC(=O)c1cccc(-c2ncn[nH]2)c1)c1cccc([N+](=O)[O-])c1 161086943 QMDKWSNKRUKQCI-NSHDSACASA-N 337.339 2.871 5 50 EFBA CN(C)[C@@H]1CCC[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 170020460 KKGFELSARQRILM-CHWSQXEVSA-N 332.404 2.764 5 50 EFBA CC(C)n1nc(O)c2c1NC(=O)CS[C@@H]2c1ccc([N+](=O)[O-])cc1 5863074 XLQYNWJRBUWNPL-CYBMUJFWSA-N 348.384 2.853 5 50 EFBA O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1ncc(F)cc1F 192272976 QRDAODLVXBGZEE-UHFFFAOYSA-N 345.265 2.706 5 50 EFBA O=C(N[C@@H](Cc1ccccc1)C(=O)O)OCc1ccc([N+](=O)[O-])cc1 2379262 RUKBCUZWCLRSJT-HNNXBMFYSA-N 344.323 2.517 5 50 EFBA COc1ccc(F)cc1[C@@H](O)Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1 1875291408 XVRDQEBFYAUANT-JTQLQIEISA-N 349.240 2.691 5 50 EFBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC2(CCCCCC2)C1 119234574 CMNIJHMFQBESFO-UHFFFAOYSA-N 334.372 2.866 5 50 EFBA Cc1cccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)O)c1 446778 XROKULWYVKEDCT-XNTDXEJSSA-N 326.308 2.759 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)/C=C/c1ccco1 4687351 NZWNEKSUNKGJSM-FNORWQNLSA-N 347.352 2.723 5 50 EFBA COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 4814476 FXGWYHOWSCHUBK-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccccc1-n1cccn1 363044611 UKWQVHUPKYETQL-UHFFFAOYSA-N 336.351 2.639 5 50 EFBA O=C1[C@H]2[C@H]3C=C[C@H]([C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1C[C@@H]31 239433628 YEPKVCZGNVXKKG-XQLQCCRHSA-N 344.754 2.806 5 50 EFBA O=C(Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1)N(C1CCCC1)C1CC1 170081212 BSSUDGUQFHXVFS-UHFFFAOYSA-N 346.309 2.744 5 50 EFBA COCCNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C)n1 5050049 MMTNSFNOVSGUMC-UHFFFAOYSA-N 330.344 2.609 5 50 EFBA COc1ccc(C(=O)Nc2cc(C(=O)O)ccc2C)cc1[N+](=O)[O-] 2876506 YMBJKPFQRRGWRE-UHFFFAOYSA-N 330.296 2.862 5 50 EFBA Cc1cc(NCCCc2nc[nH]n2)nc(-c2cccc([N+](=O)[O-])c2)n1 225407515 FTQACMFBPZPDLR-UHFFFAOYSA-N 339.359 2.523 5 50 EFBA CCC(=O)NC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 952990691 GYYOXAYEDFTBCH-UHFFFAOYSA-N 328.372 2.638 5 50 EFBA COC(=O)c1cc([N+](=O)[O-])cc(I)c1Cl 160776694 UXLAEKLSJLBNEF-UHFFFAOYSA-N 341.488 2.639 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(OC)c(OC)c1 60766 SHKUDXHSJXAEKY-UHFFFAOYSA-N 346.339 2.802 5 50 EFBA Cc1c(CC(=O)N(C)c2nc3ccccc3n2C)cccc1[N+](=O)[O-] 120621660 STPUYTIFVNHZEH-UHFFFAOYSA-N 338.367 2.995 5 50 EFBA O=C(COc1cccc([N+](=O)[O-])c1)N1CCOC[C@H]1c1ccccc1 374143390 SBOGQTPQZZJDQV-KRWDZBQOSA-N 342.351 2.574 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCCCC[C@@H]1c1ncon1 184177238 VHONVTWWNNNVKC-CQSZACIVSA-N 330.344 2.664 5 50 EFBA CN(C[C@@H]1OCCc2ccccc21)C(=O)c1ccc([N+](=O)[O-])c(O)c1 169974688 HOZMRDCGWUNSLE-KRWDZBQOSA-N 342.351 2.686 5 50 EFBA COCc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1cc(C)oc1C 183142778 QAGPKCGARCZJAD-UHFFFAOYSA-N 340.357 2.752 5 50 EFBA COC1(c2nccn2C)CCN(c2ccc([N+](=O)[O-])cc2F)CC1 952991593 BIGDLBFCBKHNEP-UHFFFAOYSA-N 334.351 2.610 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@H](O)Cc1ccccc1 194937988 QUMRECXUJSQNFH-CZUORRHYSA-N 328.368 2.625 5 50 EFBA O=C(CCn1c(=O)oc2ccccc21)Nc1cccc([N+](=O)[O-])c1 4121563 JHKHMPDHFRHADU-UHFFFAOYSA-N 327.296 2.532 5 50 EFBA COc1ccccc1[C@H](NC(=O)[C@H]1C[C@H]1[N+](=O)[O-])c1ccccc1 248121436 DZGOHFAGNUTSCJ-ZMSDIMECSA-N 326.352 2.566 5 50 EFBA O=[N+]([O-])c1ccc(N[C@H]2CCN(c3ncc(Cl)cc3F)C2)nc1 170686944 YVTYURKZQLRHRY-JTQLQIEISA-N 337.742 2.868 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 196582 XCJXNOYRXJZLLS-HNNXBMFYSA-N 347.371 2.764 5 50 EFBA NC(=O)[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 129674711 GBYZBYHUPYYQGP-GFCCVEGCSA-N 325.246 2.651 5 50 EFBA Cc1cccc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)n1 188422741 OZSVKEUOXYYMDM-INIZCTEOSA-N 326.356 2.858 5 50 EFBA Cc1ccc(C(=O)COC(=O)c2cccc(C)c2O)cc1[N+](=O)[O-] 453344 NHSCRJVJGANFED-UHFFFAOYSA-N 329.308 2.957 5 50 EFBA O=C(Cn1ccc([N+](=O)[O-])n1)NCCC12CC3CC(CC(C3)C1)C2 4784713 PZACTDLIUIFJQT-UHFFFAOYSA-N 332.404 2.514 5 50 EFBA COc1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 4754519 JPNHPZVHJUEYEX-UHFFFAOYSA-N 336.369 2.737 5 50 EFBA COc1ccccc1CCNCc1cc2c(cc1[N+](=O)[O-])OCO2 19720798 HHTRHBOPSBJOLL-UHFFFAOYSA-N 330.340 2.664 5 50 EFBA COc1ccc([C@H](CC(=O)O)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 99596 SVHWGYATCSUPBY-HNNXBMFYSA-N 344.323 2.549 5 50 EFBA O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 36047598 XTTPNXZKPNBKAB-UHFFFAOYSA-N 325.368 2.600 5 50 EFBA O=C1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 4052627 JBGDIBGTICXDLM-UHFFFAOYSA-N 333.222 2.691 5 50 EFBA O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC(c2cnc[nH]2)CC1 408514112 XJKWJGLBYVKZMD-UHFFFAOYSA-N 334.763 2.991 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NC12CC3CC(CC(C3)C1)C2 4005826 CTOICCNUBNYAQA-UHFFFAOYSA-N 336.413 2.842 5 50 EFBA O=C(Nc1nc(-c2ccc(F)cc2)cs1)c1n[nH]cc1[N+](=O)[O-] 6414044 VRFGSTSLEZXUMR-UHFFFAOYSA-N 333.304 2.833 5 50 EFBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCS[C@@H]2CCCC[C@@H]21 176235529 QNBIZEJMWPGFRW-UONOGXRCSA-N 346.412 2.971 5 50 EFBA C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F 290064926 JRKNIEWPQHFGTA-YFKPBYRVSA-N 328.193 2.877 5 50 EFBA O=[N+]([O-])c1ncn(CCCN2CCC(Cc3ccccc3)CC2)n1 952994965 YCLZGGCMCLDTRE-UHFFFAOYSA-N 329.404 2.531 5 50 EFBA O=[N+]([O-])c1cc(CN2CCN(c3ccccc3F)CC2)ccc1O 4980243 HSEUUTOEHRHZIB-UHFFFAOYSA-N 331.347 2.762 5 50 EFBA COC(=O)c1nc([C@H]2CCCN2c2ncccc2[N+](=O)[O-])sc1C 253431039 QCBUSXFVHOVXGH-LLVKDONJSA-N 348.384 2.883 5 50 EFBA CCCC1=C(C(=O)OCC)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 36239 PMCGKMXYGYODTJ-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA CC1(C)CC(=O)c2cnc(NC(=O)c3ccc([N+](=O)[O-])cc3)nc2C1 290936 ZYKSASLQIFBQLL-UHFFFAOYSA-N 340.339 2.792 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCC(C2CCOCC2)CC1 124393695 LETCBCUYKPKJMJ-UHFFFAOYSA-N 334.372 2.579 5 50 EFBA Cc1nn([C@H](C)C(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c(C)c1[N+](=O)[O-] 248380804 RFQHDJAINAVSJL-ZRXSREQCSA-N 334.420 2.910 5 50 EFBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 19537148 ACRJTTIIGUWXAN-UHFFFAOYSA-N 342.355 2.825 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccccc1[N+](=O)[O-] 2754263 LUXNNFMREWLSTH-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA O=C1CC(c2ccc([N+](=O)[O-])cc2)=NN1c1ccc([N+](=O)[O-])cc1 3817306 GANFIKBVCOCILH-UHFFFAOYSA-N 326.268 2.644 5 50 EFBA COc1ccc(C(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 4309979 GVRHSWXDSDPECU-UHFFFAOYSA-N 342.351 2.671 5 50 EFBA Cc1c(NC(=O)[C@H](C)N2CCC[C@@H](CCO)CC2)cccc1[N+](=O)[O-] 421013891 JPIOGORMABHHPH-LSDHHAIUSA-N 349.431 2.715 5 50 EFBA COc1ccccc1[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1 248121433 DZGOHFAGNUTSCJ-BFYDXBDKSA-N 326.352 2.566 5 50 EFBA O=C(O)c1ccc(CNC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 5041737 SMPTVCLORGKULD-UHFFFAOYSA-N 331.353 2.780 5 50 EFBA Cc1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)cc1[N+](=O)[O-] 63411 WGUNYQZWEYGYBM-AWEZNQCLSA-N 340.339 2.665 5 50 EFBA C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])ccc1N 188394803 CKPZDFISFNCXKM-JTQLQIEISA-N 345.330 2.707 5 50 EFBA O=C(CCCn1cc([N+](=O)[O-])cn1)Nc1nc2ccccc2s1 1067270 IZMQKFQHWBTMSS-UHFFFAOYSA-N 331.357 2.820 5 50 EFBA O=C(c1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N1CCOCC1 4838752 DVCWRDKFJQZHAI-UHFFFAOYSA-N 328.324 2.860 5 50 EFBA CN1CCN(c2ccc(C(=O)Nc3ccccc3)cc2[N+](=O)[O-])CC1 4983569 KJMRDIBDDOYEKR-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](c2ccn[nH]2)C1 123084162 KREIAJXMYNLAHB-LLVKDONJSA-N 345.359 2.738 5 50 EFBA Cn1c(Cn2cc([N+](=O)[O-])c(C(F)(F)F)n2)nc2ccccc21 170612974 DHPJPLPLYADNID-UHFFFAOYSA-N 325.250 2.745 5 50 EFBA COc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc(OC)c1OC 222487 XASHOUQQWOXQNP-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=[N+]([O-])c1cc(Br)cnc1NCCc1csc(O)n1 357784361 DCRYQGQFULWKQF-UHFFFAOYSA-N 345.178 2.569 5 50 EFBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2ccn[nH]2)C1 193850908 KGNNVVHYVFLQJW-OLZOCXBDSA-N 343.387 2.525 5 50 EFBA O=C1C[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)O1 616969 BDIMBBHVLORZBG-ZBFHGGJFSA-N 326.308 2.838 5 50 EFBA O=C(c1cccs1)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4846220 MZLUOJRDYFVYAO-UHFFFAOYSA-N 335.360 2.758 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2F)CC1 19349139 NSPKESWHPWBITJ-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA COc1ccc([C@@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)cc1 299607505 ONEDZFFPWLRHMO-CQSZACIVSA-N 341.367 2.815 5 50 EFBA CCn1c(Sc2ccc([N+](=O)[O-])cn2)nnc1-c1ccncc1 470585 GXUHWXFUQLFQKS-UHFFFAOYSA-N 328.357 2.814 5 50 EFBA COc1ccc([C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c(O)c3)C2)cc1 156118449 GRIQNRCJBNONMJ-AWEZNQCLSA-N 342.351 2.939 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC(c2nccs2)CC1 239352074 AAZMHDVUASGDSH-UHFFFAOYSA-N 333.369 2.777 5 50 EFBA Cc1ccc(Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])cc1F 4826801 QJMKEKZFGOZECT-UHFFFAOYSA-N 329.291 2.605 5 50 EFBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ccno3)c2)n1 1432484 SFYLNXJSHYUFDR-UHFFFAOYSA-N 327.300 2.719 5 50 EFBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCc2cn[nH]c21 253425559 DEZCDOWXMOCRSN-LBPRGKRZSA-N 345.359 2.916 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@@H](c2cccc([N+](=O)[O-])c2)CC(=O)N1 4916681 ZIBPBGPZGPCPPA-OAHLLOKOSA-N 344.367 2.958 5 50 EFBA Cc1nn(C)c(C(=O)N(C)C23CC4CC(CC(C4)C2)C3)c1[N+](=O)[O-] 8299726 SJRREORQOHZIHG-UHFFFAOYSA-N 332.404 2.678 5 50 EFBA CO[C@H](C)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C 240333647 FEPISPZYBOAJJS-DTWKUNHWSA-N 345.193 2.819 5 50 EFBA CC(=O)Oc1ccc(C)cc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 434892 WCFTVYVZSFNSNI-UHFFFAOYSA-N 340.291 2.629 5 50 EFBA Cc1cccc2s/c(=N\S(=O)(=O)c3ccccc3[N+](=O)[O-])[nH]c12 2865404 LNQVPCFFDPPAEY-UHFFFAOYSA-N 349.393 2.736 5 50 EFBA COc1cc(CN2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])c1O 3879206 PEDYYYBJKXTZER-UHFFFAOYSA-N 343.383 2.631 5 50 EFBA CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccccc1[N+](=O)[O-] 67420 XSQNHMFJCYAFHC-CQSZACIVSA-N 333.344 2.518 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](c3noc(C4CC4)n3)C2)n1 253419444 UDMONJQSAYPWQH-LBPRGKRZSA-N 329.360 2.943 5 50 EFBA CC(C)[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ncc[nH]1 285765165 VRRVIDBEBTUNDJ-ZDUSSCGKSA-N 338.389 2.531 5 50 EFBA Cc1cccc(NC(=O)[C@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)n1 195509884 AQJPEYNLBVHGLD-NSHDSACASA-N 347.400 2.610 5 50 EFBA COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(OC)c1OC 4870240 WPTFUYMUOFIFIU-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA CC[C@@H]1C[C@H](Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCO1 252551721 UFUAPUSRYYJGQU-ZYHUDNBSSA-N 332.360 2.975 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](c2ccn[nH]2)C1 123083891 KREIAJXMYNLAHB-NSHDSACASA-N 345.359 2.738 5 50 EFBA Cc1nc2c(s1)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)CCC2 170605206 SADKMBSTHCLMBN-ZDUSSCGKSA-N 332.385 2.749 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1-c1ccc([C@@H]2N[C@H](C(=O)O)CS2)o1 4974169 FWYBBEHLFYFMNJ-SMDDNHRTSA-N 334.353 2.951 5 50 EFBA Cc1ccc(CN2CCC(Nc3cccnn3)CC2)cc1[N+](=O)[O-] 120290987 FEFDLNJKQDQAME-UHFFFAOYSA-N 327.388 2.770 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1c2ccccc2C[C@H]1O 163058703 LBQFSUATHLWQMY-HZPDHXFCSA-N 327.340 2.683 5 50 EFBA O=C(Cc1ccccc1)NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1 457121 XXODRZQUVWTKCX-UHFFFAOYSA-N 333.344 2.790 5 50 EFBA NC(=O)CCN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 152870508 AEICZOOWYDJFTD-UHFFFAOYSA-N 347.758 2.770 5 50 EFBA CN1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)c2ccccc21 176800926 MFXCQGLKGMUXDT-UHFFFAOYSA-N 326.356 2.664 5 50 EFBA CO[C@@H]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 190817250 YPMDITQNUNQUJA-RKDXNWHRSA-N 343.177 2.655 5 50 EFBA CC(C)C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 5607108 XMGJOLVLDXUJOK-UHFFFAOYSA-N 345.321 2.918 5 50 EFBA O=C(O)[C@@H](Cc1ccccc1)Nc1sc([N+](=O)[O-])cc1[N+](=O)[O-] 5377260 JQDKTSWFZUFLCP-SECBINFHSA-N 337.313 2.672 5 50 EFBA O=[N+]([O-])c1cnc(NC[C@H]2CCC=CO2)nc1NC[C@H]1CCC=CO1 849478412 SSGOXUVYDUJQSR-CHWSQXEVSA-N 347.375 2.594 5 50 EFBA Cc1nn(CCC(=O)NC(C)(C)c2cccc(F)c2)c(C)c1[N+](=O)[O-] 134930773 HXGIYCPFOBTENN-UHFFFAOYSA-N 348.378 2.989 5 50 EFBA CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCC[C@H]1c1ccccc1 299074791 VOHWRVJNUDMULC-DZGCQCFKSA-N 340.383 2.861 5 50 EFBA CCOC(=O)[C@H](Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 301455 VSYDVQZDAMATBR-MRXNPFEDSA-N 342.351 2.955 5 50 EFBA CCOc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c([N+](=O)[O-])c1 4894098 YXRPEKKZQFSYDN-NEPJUHHUSA-N 334.328 2.599 5 50 EFBA COc1ccc([C@@H](CC(=O)O)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 99587 CSBPMMKTHZWMAV-OAHLLOKOSA-N 344.323 2.549 5 50 EFBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCS[C@H]2CCCC[C@@H]21 176235513 QNBIZEJMWPGFRW-KBPBESRZSA-N 346.412 2.971 5 50 EFBA CCO[C@@H]1C[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C12CCC2 183598834 FNLBUBPYIXMQND-ZIAGYGMSSA-N 334.376 2.801 5 50 EFBA CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 164693415 PAQVWFWUCQFCTP-SWLSCSKDSA-N 336.388 2.872 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(F)cc2)CC1 247056 SPGLEXSZQJDAGS-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA CN(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C 252515343 IVZBDBRXCGOBJQ-MGPQQGTHSA-N 344.371 2.895 5 50 EFBA C[C@H]1Cc2n[nH]cc2CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1651748156 UTJSRZGQEVWAJX-JTQLQIEISA-N 339.355 2.634 5 50 EFBA CC1=NN(C(=O)c2ccccc2)[C@](O)(c2ccc([N+](=O)[O-])cc2)C1 440683 GKMHMKOVWXCQHI-QGZVFWFLSA-N 325.324 2.662 5 50 EFBA CN1CCN(C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)CC1 2881350 CVTOTQYMVLHNAJ-UHFFFAOYSA-N 341.367 2.775 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(n2ccnc2)CC1 162525484 BUXIDAZAYIRKNM-UHFFFAOYSA-N 329.360 2.969 5 50 EFBA COc1cccc(N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 55291948 KYRVPIIORIDAGZ-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA COc1ccccc1[C@H](CNc1cc(N)ccc1[N+](=O)[O-])N(C)C 328589468 NZCHTMXSPFYWJK-INIZCTEOSA-N 330.388 2.900 5 50 EFBA COC(=O)c1cc(-c2ccc(F)c(C(=O)OC)c2)cc([N+](=O)[O-])c1 97757219 YEAACQIXEHCQBQ-UHFFFAOYSA-N 333.271 2.974 5 50 EFBA C[C@H]1CCCN(c2nc(N3C[C@H](C)C[C@@H](C)C3)nc(N)c2[N+](=O)[O-])C1 238923913 QGYVHIFPKBVXAE-YNEHKIRRSA-N 348.451 2.686 5 50 EFBA COc1cc(C=O)cc(OC)c1OC(=O)c1ccc([N+](=O)[O-])cc1 313536 UJDLGMJRXWPCSJ-UHFFFAOYSA-N 331.280 2.644 5 50 EFBA CC1CCN(c2cc(N3CCN(C)CC3)c([N+](=O)[O-])cc2F)CC1 4819071 ULBWQCMIBFRXCZ-UHFFFAOYSA-N 336.411 2.722 5 50 EFBA O=C1CS[C@H](c2ccc([N+](=O)[O-])cc2)N1CCN1CCCCC1 208068 AXHYAPSQGFHFST-MRXNPFEDSA-N 335.429 2.655 5 50 EFBA COC(=O)[C@@H](CCSC)Nc1c([N+](=O)[O-])cc(C)cc1[N+](=O)[O-] 3879711 NGBNHLXIZOMLKU-SECBINFHSA-N 343.361 2.518 5 50 EFBA Cc1nc(N[C@@H]2CCN(C[C@@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] 252512294 OWSOHGRCOGBKKM-VHDGCEQUSA-N 334.420 2.600 5 50 EFBA C[N+]1(C[C@H](O)Cn2c3ccccc3c3ccccc32)CCOCC1 303665 MHBPESFEIGWDIW-MRXNPFEDSA-N 325.432 2.632 5 50 EFBA COc1ccc(CCNC(=O)c2cccc([N+](=O)[O-])c2C)cc1OC 447470 GENBKNUOGCEQQY-UHFFFAOYSA-N 344.367 2.893 5 50 EFBA COC(=O)c1cc(C(=O)NCc2ccccc2Cl)cc([N+](=O)[O-])c1 621565 OYNDMKMVKFKZSW-UHFFFAOYSA-N 348.742 2.965 5 50 EFBA CC1CCN(c2ccc(C(=O)NC[C@H]3CCCO3)cc2[N+](=O)[O-])CC1 4865812 WSNLFQMWPPFLTE-OAHLLOKOSA-N 347.415 2.740 5 50 EFBA COC(=O)c1ccc(Oc2ccc(C=O)cc2[N+](=O)[O-])c(OC)c1 168810 PVGHJIMJEWHLPL-UHFFFAOYSA-N 331.280 2.995 5 50 EFBA Cc1cc([N+](=O)[O-])nn1CC(=O)NCCC12CC3CC(CC(C3)C1)C2 4784715 NLOAYUXHQPCAHU-UHFFFAOYSA-N 346.431 2.822 5 50 EFBA C[C@@H]1CSc2ccccc2N(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 253425722 LYEFDNHWECQHOA-JTQLQIEISA-N 332.385 2.717 5 50 EFBA O=C(CCn1ccc([N+](=O)[O-])n1)NCC12CC3CC(CC(C3)C1)C2 6829977 FOLHGXYSXMYIKB-UHFFFAOYSA-N 332.404 2.514 5 50 EFBA CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(O)c2)C12CCC2 160540414 BCBBIPLQKAEXOY-CABCVRRESA-N 334.372 2.720 5 50 EFBA CC(C)(C)[C@H](CO)NCc1ccc(Br)c([N+](=O)[O-])c1 278674394 LTTYPDDQTQSDPR-LBPRGKRZSA-N 331.210 2.854 5 50 EFBA O=C(Nc1ccccc1)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 448538 YXMZGYPLPFNODI-LBPRGKRZSA-N 325.324 2.586 5 50 EFBA O=C(COc1cccc([N+](=O)[O-])c1)N1CCOC[C@@H]1c1ccccc1 374143391 SBOGQTPQZZJDQV-QGZVFWFLSA-N 342.351 2.574 5 50 EFBA COc1cccc(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)c1[N+](=O)[O-] 194543723 BMBJKUFVBLYGAM-ZIAGYGMSSA-N 344.371 2.714 5 50 EFBA O=C(Nc1c(F)cc(Br)cc1[N+](=O)[O-])C(F)(F)F 575600414 VZELOODIDWMMKC-UHFFFAOYSA-N 331.019 2.997 5 50 EFBA COc1cccc([C@H](O)CNc2c([N+](=O)[O-])ccc3c2CCN3)c1 170614928 MJWPSWUPPGONKZ-MRXNPFEDSA-N 329.356 2.717 5 50 EFBA O=[N+]([O-])c1cc2c(c(CN3CCO[C@@H]4CCCC[C@H]43)c1)OCOC2 230251150 KPGNJRASZDWHGY-HZPDHXFCSA-N 334.372 2.605 5 50 EFBA CC(=O)c1ccc(N[C@H](C(N)=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 129639993 XRMVGACXBWSRMD-HNNXBMFYSA-N 331.303 2.575 5 50 EFBA Cc1cccc(-n2c(S)nnc2Cn2nc(C)c([N+](=O)[O-])c2C)c1 13133487 LSXPJLREELNKNA-UHFFFAOYSA-N 344.400 2.634 5 50 EFBA CN(Cc1ccco1)S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1F 170619829 YKHYRFCFLRKJIX-UHFFFAOYSA-N 348.739 2.801 5 50 EFBA O=c1[nH]c(O)nc(/C=C/c2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] 5050500 PSBFCQQVNOWSIV-DUXPYHPUSA-N 328.111 2.861 5 50 EFBA C[C@@]1(C(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc2C(=O)O1 5064930 OKDQBZHWPXBWKH-KRWDZBQOSA-N 326.308 2.705 5 50 EFBA O=C(c1ccccc1)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19774056 MWMNDOGSFBADCC-UHFFFAOYSA-N 325.368 2.553 5 50 EFBA COc1cccc(C(=O)N[C@H](CC(=O)O)c2cccc([N+](=O)[O-])c2)c1 111574 HDOOBAXIEVZOIJ-OAHLLOKOSA-N 344.323 2.549 5 50 EFBA C[C@@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc(F)c(Cl)c1 2795269 DBHBMLDJDOIYQF-QMMMGPOBSA-N 326.715 2.859 5 50 EFBA Cc1cccc2nc(CNC(=O)CCc3cccc([N+](=O)[O-])c3)cn12 176346362 PXELTFJHJIDBPL-UHFFFAOYSA-N 338.367 2.800 5 50 EFBA Cc1nnc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N)cc2)o1 170598496 MGNGHPUFGDCSPY-UHFFFAOYSA-N 339.311 2.788 5 50 EFBA Cn1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccco1 146578 ADUHKDZEKNBUMU-UHFFFAOYSA-N 344.352 2.958 5 50 EFBA CC[N+](C)(CC)CCOC(=O)C(O)(c1ccccc1)c1ccccc1 1718373 HDAMOICMOAXFLJ-UHFFFAOYSA-N 342.459 2.952 5 50 EFBA in-man CC[C@H]1C[C@@H](Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCO1 252551714 UFUAPUSRYYJGQU-JQWIXIFHSA-N 332.360 2.975 5 50 EFBA O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1Cl 2797664 PWTFCWNGFNQNBY-UHFFFAOYSA-N 329.143 2.528 5 50 EFBA O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@H](Cc2ccccc2)C1 182155439 GUAGRGKBPAYZEB-HNNXBMFYSA-N 344.342 2.818 5 50 EFBA COC(=O)c1cc([N+](=O)[O-])c(Br)cc1Br 575713553 XPRSPZBCUQBPHL-UHFFFAOYSA-N 338.939 2.906 5 50 EFBA O=[N+]([O-])c1cnc2c(ccn2S(=O)(=O)c2ccccc2)c1Cl 72266010 VDNRYINHXTYMIT-UHFFFAOYSA-N 337.744 2.835 5 50 EFBA in-vitro CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OC(=O)Cn1cccc([N+](=O)[O-])c1=O 229763623 MKAKENOVYSQKDA-IPYPFGDCSA-N 336.388 2.761 5 50 EFBA Cc1nc2cc(NC(=O)c3c(N)cccc3[N+](=O)[O-])ccc2n1C 170593227 RURJYHPDAPNWDI-UHFFFAOYSA-N 325.328 2.624 5 50 EFBA O=C(OCc1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc([N+](=O)[O-])c1 2534637 KVNVUVCDHDBEHY-UHFFFAOYSA-N 346.251 2.589 5 50 EFBA O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4906812 WRRSESWHQVIJFU-UHFFFAOYSA-N 335.747 2.804 5 50 EFBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1noc2ccccc12 253418960 DSPSRSDUBKMOSR-UHFFFAOYSA-N 349.324 2.545 5 50 EFBA CC[C@@H]1CC[C@@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)O1 863947900 NOKJHXKVKBTRMB-SKDRFNHKSA-N 330.743 2.961 5 50 EFBA Cc1nc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)cs1 189979198 GKTZKNCTRANOEE-CQSZACIVSA-N 332.385 2.919 5 50 EFBA Cc1cc(C)n(-c2cc(Sc3nncn3C)ccc2[N+](=O)[O-])n1 1071090 OYAGFCBAHSWCIB-UHFFFAOYSA-N 330.373 2.677 5 50 EFBA O=C(NCCCNc1ccccn1)c1c[nH]c2cc([N+](=O)[O-])ccc12 346269748 DGQBTPAYZOASBN-UHFFFAOYSA-N 339.355 2.703 5 50 EFBA CC(C)COC(=O)N(CCCN(C)C)c1ncc([N+](=O)[O-])s1 96027539 HFRJBHWLLBBFGF-UHFFFAOYSA-N 330.410 2.602 5 50 EFBA CC(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4187893 WYGQSZJKQLNWFX-UHFFFAOYSA-N 346.431 2.864 5 50 EFBA O=C(OCn1c(=O)sc2ccccc21)c1ccc([N+](=O)[O-])cc1 5740038 AEFGDTCVXIWXBY-UHFFFAOYSA-N 330.321 2.786 5 50 EFBA COC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 318568 JDRJTXRQGTYURW-NSHDSACASA-N 328.752 2.566 5 50 EFBA CC(C)(c1nc(-c2ccc([N+](=O)[O-])cc2)cs1)S(C)(=O)=O 928995570 BNRLYGASRQASGI-UHFFFAOYSA-N 326.399 2.998 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(Cc2ccccc2)C1 101164 FKGASZQZQFCFGC-CQSZACIVSA-N 339.351 2.582 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(Cc2ccccc2)C1 101161 FKGASZQZQFCFGC-AWEZNQCLSA-N 339.351 2.582 5 50 EFBA O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCc2ccccc2C1 2070822 MEYRFAQUTWSIPQ-UHFFFAOYSA-N 327.296 2.702 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCSC2CCCCC2)cc1 2864289 NAMDWVSQIXGFDM-UHFFFAOYSA-N 344.458 2.939 5 50 EFBA O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(-c2ccccc2)o1 121834861 WVSJDRQTGYRSQZ-UHFFFAOYSA-N 344.352 2.599 5 50 EFBA CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(O)c2)C12CCC2 160540287 BCBBIPLQKAEXOY-HUUCEWRRSA-N 334.372 2.720 5 50 EFBA COc1cc2c(cc1O)[C@H]1Cc3cc(O)c(OC)cc3[N@@+]1(C)CC2 252490218 KMJDZTDWUQFSHS-FOIQADDNSA-O 328.388 2.906 5 50 EFBA biogenic O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC(C2CCOCC2)CC1 119347525 SKLMTANXRAKGMM-UHFFFAOYSA-N 334.372 2.579 5 50 EFBA CN(C)[S@](=O)(=NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 101014859 ZYLDZVLMCQUFDB-HSZRJFAPSA-N 333.369 2.739 5 50 EFBA CCCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc([N+](=O)[O-])s1 3905819 LVUPYNWNOCBPTD-GFCCVEGCSA-N 339.373 2.628 5 50 EFBA Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 198711 VOCCOZOHNBVHNV-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA Cc1ccc([N+](=O)[O-])c(OCC(=O)OCC(=O)c2ccccc2)c1 436273 FYVQTTYEVISKFY-UHFFFAOYSA-N 329.308 2.708 5 50 EFBA C[C@H]1CN(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(=O)O1 4187200 IQGRETMLRRJDGI-QMMMGPOBSA-N 333.266 2.866 5 50 EFBA CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCCO2)CC1 4838893 QYBKYDXKLHAJNR-HNNXBMFYSA-N 347.415 2.740 5 50 EFBA O=C1CS[C@H](c2ccccc2)N1C[C@H](O)c1ccc([N+](=O)[O-])cc1 191468 MGXILCXZIMQAAN-DOTOQJQBSA-N 344.392 2.902 5 50 EFBA O=C(Cn1cncc1-c1ccc([N+](=O)[O-])cc1)NC1CCCCC1 458700 YXIBFNRHPZYAHR-UHFFFAOYSA-N 328.372 2.907 5 50 EFBA COc1ccccc1NC(=O)COc1ccc(/C=C\[N+](=O)[O-])cc1 4545125 VLIUFMRYSRTLPT-KHPPLWFESA-N 328.324 2.960 5 50 EFBA O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1C[C@H]2CC[C@@H](O)[C@H]2C1 2325762215 QCXNDZVQVMBIDL-PZPSRYQVSA-N 348.402 2.524 5 50 EFBA COCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)c1ccccc1 2990783 DQJPYJWEBAKQMT-GHRIWEEISA-N 326.352 2.898 5 50 EFBA NC(=O)c1ccccc1NC(=O)/C=C/c1cc([N+](=O)[O-])ccc1Cl 2561771 MYPVMOJAAPBFGX-VMPITWQZSA-N 345.742 2.999 5 50 EFBA CCOC(=O)c1sc(=S)n(-c2ccc([N+](=O)[O-])cc2)c1N 2576548 KBRDKRWIWFVKGJ-UHFFFAOYSA-N 325.371 2.935 5 50 EFBA O=C(NC(=O)C(Cl)(Cl)Cl)Nc1ccccc1[N+](=O)[O-] 15636070 DNHRZGRLOABUIY-UHFFFAOYSA-N 326.523 2.613 5 50 EFBA COc1cc2nc(-c3ccc([N+](=O)[O-])cc3)oc(=O)c2cc1OC 62957 SHEMIUCVLMATCO-UHFFFAOYSA-N 328.280 2.780 5 50 EFBA O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2cccc([N+](=O)[O-])c2)N1 188518 CYXGKHWORVZUGJ-HOTGVXAUSA-N 337.335 2.764 5 50 EFBA biogenic CC(=O)Nc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 4980333 COWXBMSNTRCULX-UHFFFAOYSA-N 349.368 2.662 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1[C@@H]2c3ccccc3C[C@H]21 252536939 JVDIDQUKWIFDCW-KBRIMQKVSA-N 344.392 2.749 5 50 EFBA O=C(CN1C2=NCCCN2c2ccccc21)c1cccc([N+](=O)[O-])c1 100484477 YEAXYQFWOFWFNO-UHFFFAOYSA-N 336.351 2.864 5 50 EFBA Cc1cn2c(=O)c3ccccc3nc2nc1Nc1ccccc1C(=O)O 445147 AJKVJXBJOOICBS-UHFFFAOYSA-N 346.346 2.993 5 50 EFBA biogenic O=[N+]([O-])c1cccc(-c2ccc(N3C[C@H]4CC[C@@H](O)C[C@H]4C3)nn2)c1 1775999781 YEEJKZYBWLPQTR-IJEWVQPXSA-N 340.383 2.649 5 50 EFBA CCC1(O)CCN(c2ccc(-c3cccc([N+](=O)[O-])c3)nn2)CC1 1775998880 LQBKMJZZMNKXGU-UHFFFAOYSA-N 328.372 2.793 5 50 EFBA COc1cc(N[C@@H]2CCN(C[C@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] 252477368 MQMACDRHCXUVHG-FVQBIDKESA-N 349.431 2.905 5 50 EFBA O=[N+]([O-])c1cnn(-c2ccccc2)c1NCCCCn1ccnc1 2325784045 WTCVDOVKLLTZKY-UHFFFAOYSA-N 326.360 2.869 5 50 EFBA CCOc1cc(CC(=O)OC)c([N+](=O)[O-])c(OCC)c1OCC 34929011 RTEJDAWLBLDSBB-UHFFFAOYSA-N 327.333 2.506 5 50 EFBA O=C(O)C[C@@H](NC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 100081 VBEXHHPJLOOALZ-CQSZACIVSA-N 332.287 2.680 5 50 EFBA O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1F)c1cccc(F)c1 361090 QPOPSCXAQZUXCO-UHFFFAOYSA-N 337.307 3.000 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1-c1ccc([C@H]2N[C@H](C(=O)O)CS2)o1 4974170 FWYBBEHLFYFMNJ-FZMZJTMJSA-N 334.353 2.951 5 50 EFBA CCOCCCN1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C)[C@@H](C)C1 229697197 AYFLDVMVFUWDAK-GOEBONIOSA-N 336.436 2.847 5 50 EFBA Cn1ncc([N+](=O)[O-])c1NC(=O)Cc1csc(-c2cccs2)n1 170598542 BQZLTZFJGLTPPC-UHFFFAOYSA-N 349.397 2.695 5 50 EFBA O=[N+]([O-])c1cccc(NS(=O)(=O)c2cccc3cccnc23)c1 284250 ACTSYSYEGYKYCS-UHFFFAOYSA-N 329.337 2.944 5 50 EFBA Cc1cc(NC(=O)N2CC[C@H](c3cnn(C)c3)C2)ccc1[N+](=O)[O-] 153720890 UBWZQZXHMTYTKU-LBPRGKRZSA-N 329.360 2.658 5 50 EFBA O=[N+]([O-])c1ccc(-c2nc(-c3ccnc(-n4ccnc4)c3)no2)s1 762055942 ZTUXLHAOONUDML-UHFFFAOYSA-N 340.324 2.954 5 50 EFBA CC[C@@H]1C[C@@H](Cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)CCO1 252551430 UFUAPUSRYYJGQU-CMPLNLGQSA-N 332.360 2.975 5 50 EFBA O=C(c1ccccc1F)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19347619 WDMDHGKWYRBSJV-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA Cc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)c(O)c1 456738 QMTJIDCTHGKTAY-UHFFFAOYSA-N 331.353 2.736 5 50 EFBA O=C(NCc1ccc2c(c1)OCO2)c1cc(Cl)ccc1[N+](=O)[O-] 476756 MRLWWENIGZVBOR-UHFFFAOYSA-N 334.715 2.907 5 50 EFBA Cc1ccc(C(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 4313652 TVZUNWVYDPOKLT-UHFFFAOYSA-N 326.352 2.971 5 50 EFBA O=C(N[C@@H]1CCCOc2c1ccc1ccccc21)[C@@H]1C[C@H]1[N+](=O)[O-] 225412315 PMSAOCVUKADPJK-BZUAXINKSA-N 326.352 2.835 5 50 EFBA C[C@@H]1COc2ccccc2CN1C(=O)Cc1ccccc1[N+](=O)[O-] 328587213 ICPUXVGYOZXIDU-CYBMUJFWSA-N 326.352 2.947 5 50 EFBA CC(=O)N/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)NC1CCCCC1 5012053 MYQQRGBQUJDYCC-WJDWOHSUSA-N 331.372 2.521 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)OC12CCCCC2 93326 NYDAEDZQKQFADH-LBPRGKRZSA-N 348.355 2.808 5 50 EFBA COc1ccc(NS(=O)(=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 3833431 BFFQNTWGQGDMKD-UHFFFAOYSA-N 326.305 2.543 5 50 EFBA O=C([C@H]1C[C@H]2CC[C@H]1C2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 101634085 AJIXIENUVVGOBB-ZQIUZPCESA-N 329.400 2.680 5 50 EFBA Cc1n[nH]c(-c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)n1 172917982 UUZSZZLCADLMID-UHFFFAOYSA-N 337.339 2.870 5 50 EFBA CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 169994277 KBZULBQZHGSTSD-KMUNFCNLSA-N 329.356 2.619 5 50 EFBA Cc1nc([C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)cs1 189979178 GKTZKNCTRANOEE-AWEZNQCLSA-N 332.385 2.919 5 50 EFBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H](c2ccsc2)O1 150868482 WIHOTYRXFLBTMZ-ZUZCIYMTSA-N 348.380 2.964 5 50 EFBA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 239637079 BISFSMMUOBROKG-DVOMOZLQSA-N 347.415 2.656 5 50 EFBA Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)c([N+](=O)[O-])cc1C 239339050 LQCHEPDDRNPJCI-DPNLBMGJSA-N 338.363 2.769 5 50 EFBA Cc1nn([C@H](C)C(=O)N2CCCc3ccccc32)c(C)c1[N+](=O)[O-] 1068512 KUAFTSNQOQQASR-CYBMUJFWSA-N 328.372 2.949 5 50 EFBA COc1ccccc1C[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 100562211 ZZZIXVXAOAJZNO-ZDUSSCGKSA-N 340.335 2.726 5 50 EFBA O=C(c1cncc(F)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 132367435 VWNVNRZZPDMQCN-UHFFFAOYSA-N 345.330 2.813 5 50 EFBA Cc1cc2ncn(S(=O)(=O)c3ccccc3[N+](=O)[O-])c2cc1C 53252 HWPZNQLNSZMPRL-UHFFFAOYSA-N 331.353 2.798 5 50 EFBA CCOC(=O)c1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1 115679 KNDXKRDGTNGJCT-UHFFFAOYSA-N 344.323 2.789 5 50 EFBA O=C(NC1CCCCCC1)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 376008 OHYGCVGBUAAFHR-UHFFFAOYSA-N 332.360 2.885 5 50 EFBA O=C1N[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N2CCCC[C@H]12 124844719 ZPTQRAKNKSXTSO-CZUORRHYSA-N 327.340 2.838 5 50 EFBA O=C(NC[C@@H](O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1F 1875259879 AZLMMULGJRJOFH-LLVKDONJSA-N 325.321 2.651 5 50 EFBA C[C@@H](CNc1ccc([N+](=O)[O-])c2ncccc12)CN1CCOCC1 413153771 LXSRPVQLASJZJA-ZDUSSCGKSA-N 330.388 2.523 5 50 EFBA COc1cccc([C@@H](O)CNc2c([N+](=O)[O-])ccc3c2CCN3)c1 170614929 MJWPSWUPPGONKZ-INIZCTEOSA-N 329.356 2.717 5 50 EFBA CC(C)COc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1 5041616 GBVXXHIXDAOYGO-VMPITWQZSA-N 331.328 2.589 5 50 EFBA CC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 3131889 HAXWNKSQKIPSGK-UHFFFAOYSA-N 329.268 2.958 5 50 EFBA Cc1c(-c2nc3ccccc3c(=O)o2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 2170830 IBINBWKVQAEZOH-UHFFFAOYSA-N 327.252 2.980 5 50 EFBA COc1nonc1O[C@H](C)CNc1ccc([N+](=O)[O-])cc1Cl 5357301 MYUDJCOHQWVBHE-SSDOTTSWSA-N 328.712 2.519 5 50 EFBA CCc1c(C)sc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1C(N)=O 475355 UMELUIUPMMRVNF-UHFFFAOYSA-N 333.369 2.878 5 50 EFBA CNc1ccc(C(=O)O[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)cc1[N+](=O)[O-] 225396920 AOBCVWJPONCFBR-BYCMXARLSA-N 334.372 2.997 5 50 EFBA CO[C@H]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 190817269 YPMDITQNUNQUJA-BDAKNGLRSA-N 343.177 2.655 5 50 EFBA NC(=O)c1c(SCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3670014 XUFKWRLMYACYFO-UHFFFAOYSA-N 333.325 2.894 5 50 EFBA C[C@@H](O)CCN(C)CC1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 1180199785 YIIISRBDUOMROW-MRXNPFEDSA-N 349.475 2.552 5 50 EFBA C[N+]1(C)CCC[C@H](OC(=O)C(O)(c2ccccc2)c2ccccc2)C1 449 GKNPSSNBBWDAGH-IBGZPJMESA-N 340.443 2.705 5 50 EFBA fda COc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-] 117045 VRHIFKIMRXOVHD-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA COC(=O)c1cc(C(=O)N(C)Cc2ccccc2)cc([N+](=O)[O-])c1 434423 LSTMTMJTELSXGN-UHFFFAOYSA-N 328.324 2.654 5 50 EFBA CCOP(=O)(OCC)[C@H](OC(N)=O)c1cccc([N+](=O)[O-])c1 3185550 ROOJJQYMRGMFNE-NSHDSACASA-N 332.249 2.955 5 50 EFBA COc1cc(N[C@H]2CCN(Cc3ccccc3)C2=O)ccc1[N+](=O)[O-] 266468727 ZPXAYTGJUQDHKA-HNNXBMFYSA-N 341.367 2.816 5 50 EFBA CN1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)c2ccccc21 111072170 SMLKBRRTHQNOFU-UHFFFAOYSA-N 337.339 2.568 5 50 EFBA O=[N+]([O-])c1cc(Cl)ccc1N[C@H]1CCCN(c2nccnc2O)C1 276222374 MCTQQSONEBNXBK-NSHDSACASA-N 349.778 2.825 5 50 EFBA C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1cc([N+](=O)[O-])ccc1N 188394824 CKPZDFISFNCXKM-SNVBAGLBSA-N 345.330 2.707 5 50 EFBA C[C@@H]1CO[C@H](c2ccccc2)CN1c1ccc2ncc([N+](=O)[O-])n2n1 192655462 OBESSNOQVWVFME-OCCSQVGLSA-N 339.355 2.604 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1Sc1nnc(-c2ccco2)n1C 195341647 XDUJGIOCHUJTJO-UHFFFAOYSA-N 334.361 2.659 5 50 EFBA O=[N+]([O-])c1ccc(NCCCN2CCOCC2)c(C(F)(F)F)c1 19798797 RPMPWWZKOMVOIX-UHFFFAOYSA-N 333.310 2.748 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC[C@@H](C(F)(F)F)C1 92596 JFLLFVAEUVXDLN-SECBINFHSA-N 338.307 2.558 5 50 EFBA O=C(Cn1cnc2cc(Cl)ccc2c1=O)c1ccccc1[N+](=O)[O-] 3124315 FQRBXXLEQGRWAJ-UHFFFAOYSA-N 343.726 2.841 5 50 EFBA CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@@H](CO)c1ccccc1)C2 100015775 OEXHQOGQTVQTAT-VQCHGODESA-N 332.464 2.854 5 50 EFBA fda Cc1c(NC(=O)[C@@H](C)N2CCC[C@H](CCO)CC2)cccc1[N+](=O)[O-] 421013879 JPIOGORMABHHPH-CABCVRRESA-N 349.431 2.715 5 50 EFBA Nc1cc(CC(=O)NCCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] 408515267 ZTVWMSUPOKBWMI-UHFFFAOYSA-N 333.775 2.732 5 50 EFBA CCn1cc(CN(C)C(=S)Nc2ccc([N+](=O)[O-])cc2)c(C)n1 5041821 MNMJKCCTXCRHFO-UHFFFAOYSA-N 333.417 2.948 5 50 EFBA Cc1nscc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 183275572 NOVKBSCDADITTL-UHFFFAOYSA-N 329.341 2.798 5 50 EFBA Cc1c(NC(=O)[C@@H]2CCCO2)cc(Br)cc1[N+](=O)[O-] 280851255 ZVHOVCZFOKGJBB-NSHDSACASA-N 329.150 2.783 5 50 EFBA O=[N+]([O-])c1c(Br)cc(F)cc1N[C@@H]1C=C[C@H](CO)C1 849478185 NORSXTMYRZVWAR-IONNQARKSA-N 331.141 2.845 5 50 EFBA Cc1cc(C)nc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])n1 453323 UVADKUNEJLYWJR-UHFFFAOYSA-N 339.398 2.556 5 50 EFBA O=C(NC[C@H](O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1F 1875259880 AZLMMULGJRJOFH-NSHDSACASA-N 325.321 2.651 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2cccc(F)c2)C1 170780816 DQJDZBFISXWMHF-INIZCTEOSA-N 345.330 2.651 5 50 EFBA Cc1cccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 137276787 KPCMFYMFXLJSDI-UHFFFAOYSA-N 341.776 2.777 5 50 EFBA COc1ccc2c(c1)C[C@H](C(=O)OCc1ccc([N+](=O)[O-])cc1)CO2 123951595 DAGIPZKLKADIMU-AWEZNQCLSA-N 343.335 2.898 5 50 EFBA CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](C)Oc2ncccc21 279888371 CUENJQIPEFFSKE-NSHDSACASA-N 343.339 2.816 5 50 EFBA COc1ccc(S(=O)(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 304352 BTSDZERPLVBESL-UHFFFAOYSA-N 326.305 2.543 5 50 EFBA Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)n1 253418190 HGEMOPZVJCHNGK-GFCCVEGCSA-N 334.763 2.959 5 50 EFBA Cn1cccc1[C@@H]1COCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 170613491 MUWHJRPLAPZZCT-HNNXBMFYSA-N 330.344 2.539 5 50 EFBA C[C@@H](CNC(=O)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 1121170 JCHHLBASVILAJH-NSHDSACASA-N 328.324 2.857 5 50 EFBA O=C1N[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N2CCCC[C@@H]12 124845094 ZPTQRAKNKSXTSO-XJKSGUPXSA-N 327.340 2.838 5 50 EFBA Cc1cnc(COC(=O)c2cc3nc[nH]c3cc2F)c(C)c1[N+](=O)[O-] 328596753 YTNYFACTULHICL-UHFFFAOYSA-N 344.302 2.979 5 50 EFBA C[C@H]1COc2ccccc2CN1C(=O)Cc1ccccc1[N+](=O)[O-] 328587214 ICPUXVGYOZXIDU-ZDUSSCGKSA-N 326.352 2.947 5 50 EFBA Cc1n[nH]c(C)c1N1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O 313019 WPQZBOTUUBNWFO-UHFFFAOYSA-N 336.307 2.889 5 50 EFBA COc1ccccc1N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 55543464 QCJFPXMVFSMVEZ-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA Cc1cc(N2CCC3(CC2)C[C@H]3C(=O)N2CCCC2)ncc1[N+](=O)[O-] 253422895 GJJPSHXQXBZMQE-AWEZNQCLSA-N 344.415 2.527 5 50 EFBA O=C(Nc1sccc1C(=O)NC1CC1)c1ccc([N+](=O)[O-])cc1 3613262 WQUMMRZUHPNIAK-UHFFFAOYSA-N 331.353 2.801 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CC1 4618741 YZYHZAQWPWGUTA-UHFFFAOYSA-N 325.368 2.578 5 50 EFBA CN1CCN(c2ccccc2NC(=O)c2ccccc2[N+](=O)[O-])CC1 5068242 DYAMYSSTASMFAO-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA O=C(O)C[C@H](NC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 100074 VBEXHHPJLOOALZ-AWEZNQCLSA-N 332.287 2.680 5 50 EFBA CCN(c1ccc(O)cc1)S(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 193346232 UQEZSMCUQIEKFS-UHFFFAOYSA-N 340.332 2.655 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccccc1[N+](=O)[O-] 2754262 LUXNNFMREWLSTH-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 247826978 JSXIRLUEQBULMC-YUELXQCFSA-N 332.356 2.541 5 50 EFBA C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1)c1cccs1 170596264 UWTMDNYZEXIMJN-SSDOTTSWSA-N 348.306 2.749 5 50 EFBA COC(=O)c1cc(C(=O)Nc2cccc(OC)c2)cc([N+](=O)[O-])c1 183855 SHYFMGGYGMWLCV-UHFFFAOYSA-N 330.296 2.642 5 50 EFBA O=C(CSC(=S)N1CCSCC1)c1ccc([N+](=O)[O-])cc1 267445 OJLQIKGVWJNRMW-UHFFFAOYSA-N 342.467 2.844 5 50 EFBA O=C1[C@H](Oc2ccc([N+](=O)[O-])c(CO)c2)CCCN1c1ccccc1 328595882 IOXIFMCPAQGWNJ-QGZVFWFLSA-N 342.351 2.662 5 50 EFBA CCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 2754648 OHCVKBQKLUCPTO-AWEZNQCLSA-N 333.344 2.518 5 50 EFBA CCOC(=O)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 455833 DXHPANJSEMRWAH-JTQLQIEISA-N 340.763 2.664 5 50 EFBA Cc1cc(Br)ccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 2883391 YQWWUHSFMOPQFO-UHFFFAOYSA-N 339.149 2.501 5 50 EFBA CCNc1cc(N2CCN(C(=O)c3ccco3)CC2)ccc1[N+](=O)[O-] 4703658 KGHDFKXDUOQDDX-UHFFFAOYSA-N 344.371 2.582 5 50 EFBA O=c1cc2c(nn1Cc1cccc([N+](=O)[O-])c1)-c1ccccc1CC2 6243038 DLLBJZZYUKMQES-UHFFFAOYSA-N 333.347 2.965 5 50 EFBA CNc1ccc(CN[C@@H]2CCN(C3CCCCC3)C2=O)cc1[N+](=O)[O-] 131553885 XRMWXNPLQKAUEX-MRXNPFEDSA-N 346.431 2.660 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)COc1ccccc1 5552656 IRIKBEAXALYDFB-UHFFFAOYSA-N 345.380 2.795 5 50 EFBA Cc1ccccc1OCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 225600 NMTBOWYIOOEQBO-UHFFFAOYSA-N 329.308 2.708 5 50 EFBA O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 43952 ONWDBWGQAYVOML-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA NC(=O)c1c(Sc2ccc(F)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3669499 AVUBVMPXFUVMNT-UHFFFAOYSA-N 337.288 2.892 5 50 EFBA Cc1ccc2c(c1)C(=O)[C@]1(O)CCN(c3ccc([N+](=O)[O-])cc3)C1=N2 1772768824 KAUXNLHXGQGFOS-GOSISDBHSA-N 337.335 2.771 5 50 EFBA CN(C)C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 169725452 MFNNVHBONZUPSA-UHFFFAOYSA-N 328.210 2.888 5 50 EFBA Cc1ccc(S(=O)(=O)NCCCNc2ccc([N+](=O)[O-])cc2)cc1 4543475 CIVGVODNLUBRQU-UHFFFAOYSA-N 349.412 2.684 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@@H]2C[C@H]3C=C[C@H]2C3)CC1 100609672 CGJACONVLRMRBF-XIRDDKMYSA-N 341.411 2.565 5 50 EFBA COc1cccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2F)c1 361396 DBZINTCATOBAJN-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA O=C(NCCCO)c1cc([N+](=O)[O-])cc2c1C=Cc1ccccc1O2 4698561 GGHHMTNRWCATPN-UHFFFAOYSA-N 340.335 2.983 5 50 EFBA COc1ccccc1NC(=S)NC(=O)c1cccc([N+](=O)[O-])c1 2985327 KSSXSRYBLGOJAU-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)OC12CCCCC2 4845010 LCZASDAFYIJYLA-GFCCVEGCSA-N 348.355 2.808 5 50 EFBA CCOc1ncccc1C(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1 183460109 APFPGVGIVIKDRL-UHFFFAOYSA-N 345.355 2.812 5 50 EFBA Cc1c(C(=O)N2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] 216510 PQJSYUUSBWXPLA-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 270904 JIABFMRDXFPWMC-ZBEGNZNMSA-N 328.324 2.553 5 50 EFBA COc1ccccc1N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 83311 IMTAQEITLHUVOL-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA COc1cccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 2883604 PZRSFBJNQVFXQN-UHFFFAOYSA-N 332.312 2.630 5 50 EFBA CCc1nc(C)cn1S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 283098 RJOCNWDIEWQPMK-UHFFFAOYSA-N 329.765 2.553 5 50 EFBA Cc1nc(N[C@@H](COC(=N)O)Cc2ccccc2)ccc1[N+](=O)[O-] 496523216 HWWWYCXRZQBUAL-CYBMUJFWSA-N 330.344 2.831 5 50 EFBA O=[N+]([O-])c1ccc(CN2CCCN(c3nccs3)CC2)cc1F 240555800 GXHUHMNWASDXMA-UHFFFAOYSA-N 336.392 2.903 5 50 EFBA CC(C)(C)OC(=O)N1C[C@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)O)C1 54965231 GSPFANURARKSQW-OLZOCXBDSA-N 336.344 2.630 5 50 EFBA Cc1cnccc1NC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 121111557 NGNLGJYCIZCHHX-UHFFFAOYSA-N 341.371 2.652 5 50 EFBA C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 162746778 YHTDEVPYVZYELN-TVQRCGJNSA-N 336.369 2.604 5 50 EFBA CCc1nc(C2CCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)n[nH]1 190718976 CPGDRISFIONOSU-UHFFFAOYSA-N 333.367 2.794 5 50 EFBA Cc1ccc(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 1760487 XMJOAZKUTPHAQT-UHFFFAOYSA-N 336.325 2.953 5 50 EFBA O=c1[nH]c(/C=C\c2cccc(C(F)(F)F)c2)nc(O)c1[N+](=O)[O-] 9010335 JMMHVQHXMCZGOR-PLNGDYQASA-N 327.218 2.573 5 50 EFBA Cc1nn(Cc2ccc(C(=O)N3CCC[C@H](C)C3)o2)c(C)c1[N+](=O)[O-] 2780520 HSIHEDZHBUCHOD-NSHDSACASA-N 346.387 2.922 5 50 EFBA CCc1cc(N2CCC[C@H](Nc3cc(N)ccc3[N+](=O)[O-])C2)ncn1 193429087 MOXJXRSIQJMAIS-AWEZNQCLSA-N 342.403 2.610 5 50 EFBA O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N1CCOCC1 539595 KLAQNCVNXUTFQR-UHFFFAOYSA-N 336.731 2.981 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccccc2OCc2ccccc2)N1 90402 PVMKAAOHTYLXNF-CRAIPNDOSA-N 326.352 2.862 5 50 EFBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1ccc2c(c1)OCO2 463503 NZFOXGFNFBKIAQ-SOFGYWHQSA-N 326.308 2.653 5 50 EFBA CC(C)OC(=O)c1ccccc1C(=O)c1ccc(N)c([N+](=O)[O-])c1 3879148 WWLNITKFPXGJAS-UHFFFAOYSA-N 328.324 2.973 5 50 EFBA COCc1cccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 4980330 MEBCTCBQGZATRS-UHFFFAOYSA-N 336.369 2.850 5 50 EFBA O=C(OCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(c2ccccc2)C1 282671 LXBRAFWTZVOUAU-CQSZACIVSA-N 340.335 2.691 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1N1CCN(C(=O)c2ccccc2)CC1 4125029 BBEJNZZNHCGYHR-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA CC(=O)Nc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 4740415 HWXYKPYBRCGUCP-UHFFFAOYSA-N 329.312 2.571 5 50 EFBA C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)C(=O)NCc1ccco1 301770258 FJXYUIAWAHRRFI-QMMMGPOBSA-N 325.271 2.583 5 50 EFBA Cc1cc(C)nc(SCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])n1 192465648 XOYLQYHMAFTLQZ-UHFFFAOYSA-N 346.412 2.752 5 50 EFBA O=C(CCc1cccc([N+](=O)[O-])c1)NCc1cccc2c1OCO2 125237713 ACSPKVZWNKDKDX-UHFFFAOYSA-N 328.324 2.573 5 50 EFBA CC[N+](CC)(CC)CCCCCN1C(=O)c2ccc(N)cc2C1=O 2900789 MGOAUYOLLIRVNI-UHFFFAOYSA-O 332.468 2.912 5 50 EFBA CCCCNc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-] 4158833 APUCFSDHUNEOJT-UHFFFAOYSA-N 341.433 2.981 5 50 EFBA COC(=O)[C@H](CCSC)Nc1c([N+](=O)[O-])cc(C)cc1[N+](=O)[O-] 3879710 NGBNHLXIZOMLKU-VIFPVBQESA-N 343.361 2.518 5 50 EFBA CCOC(=O)[C@@H]1[C@H]2C=C[C@@H](c3c2cccc3[N+](=O)[O-])[C@H]1C(=O)OCC 253611280 MTKCNYRBENZGCV-YXAMBPQSSA-N 345.351 2.704 5 50 EFBA O=C(CN1C2=NCCCN2c2ccccc21)c1ccc([N+](=O)[O-])cc1 6270112 ODXNWSYYWOIYHU-UHFFFAOYSA-N 336.351 2.864 5 50 EFBA C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 176730978 AQRTXXBZISOOED-DIFFPNOSSA-N 346.362 2.760 5 50 EFBA COc1cc(C(=O)Nc2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OC 442621 QDRINKICCIYFRW-UHFFFAOYSA-N 345.355 2.930 5 50 EFBA CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])cc1 613862 WHSKJZCBHCMSKQ-UHFFFAOYSA-N 349.368 2.662 5 50 EFBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(C(F)(F)F)ccc1F 376015 HNRJLXFKJQHKDO-UHFFFAOYSA-N 332.213 2.588 5 50 EFBA O=C1N[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N2CCCC[C@H]12 124844901 ZPTQRAKNKSXTSO-CJNGLKHVSA-N 327.340 2.838 5 50 EFBA CNc1ccc(C(=O)O[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)cc1[N+](=O)[O-] 239475406 AOBCVWJPONCFBR-KCPJHIHWSA-N 334.372 2.997 5 50 EFBA CCc1oc(C(=O)OC)cc1Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1 2325737450 RTOYYYIBIRLQJO-UHFFFAOYSA-N 347.249 2.800 5 50 EFBA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 229927209 FCYQQISDGGSKJH-QYAIJTBZSA-N 332.743 2.950 5 50 EFBA Cc1cccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)n1 456875 XPAONIKPJUGOHB-UHFFFAOYSA-N 330.369 2.733 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@H](C(=O)O)c1ccccc1 4738196 LCIYTCHGMLWPSO-SCOAYWHSSA-N 326.308 2.550 5 50 EFBA CC[S@](=O)[C@H]1CCC[C@@H](NCc2ccc([N+](=O)[O-])c(OC)c2)C1 222140562 HMZRGKHIUYOPBT-XXAQJILISA-N 340.445 2.773 5 50 EFBA CC(C)(CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccncc1 170604959 DMWXBJQNLRAQKK-UHFFFAOYSA-N 349.412 2.783 5 50 EFBA O=[N+]([O-])c1cc(Br)c(F)cc1OC[C@H](O)C(F)(F)F 190702728 NCTPPOIUIWRBIG-QMMMGPOBSA-N 348.046 2.798 5 50 EFBA O=c1/c(=C/c2cc([N+](=O)[O-])ccc2F)sc2nc3ccccc3n12 6645848 SSNRHAASIKDWRR-ZSOIEALJSA-N 341.323 2.504 5 50 EFBA O=C(Cc1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4662540 GVHVRGIMZJRSBO-UHFFFAOYSA-N 343.358 2.625 5 50 EFBA CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 164693661 PAQVWFWUCQFCTP-IUODEOHRSA-N 336.388 2.872 5 50 EFBA COc1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 3960237 OGHWCNDAOKXAJB-XVNBXDOJSA-N 342.307 2.984 5 50 EFBA O=[N+]([O-])c1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 55543795 KVNONDCPTRPNHC-UHFFFAOYSA-N 342.355 2.825 5 50 EFBA O=C(O)c1cccc(Nc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c1 17574343 POECFHVTFLONRY-UHFFFAOYSA-N 348.227 2.853 5 50 EFBA Cc1ccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 1628058 NQXDAKVRYHXNPE-UHFFFAOYSA-N 338.297 2.579 5 50 EFBA biogenic CC(=O)c1sc(NC(=O)COc2ccc([N+](=O)[O-])cc2)nc1C 148470 ZGZYIJMPLSJGGC-UHFFFAOYSA-N 335.341 2.580 5 50 EFBA CCCCNc1ccc(S(=O)(=O)NCCCC)cc1[N+](=O)[O-] 4158838 QFRRPLODAZLLKS-UHFFFAOYSA-N 329.422 2.885 5 50 EFBA O=C(NCCc1ccccc1[N+](=O)[O-])c1ccoc1Br 344076091 LNNIKCCFSCKCIX-UHFFFAOYSA-N 339.145 2.923 5 50 EFBA COc1ccccc1Nc1cc(N(C)C)c2nonc2c1[N+](=O)[O-] 3904310 LBPJPVHZTKDFHG-UHFFFAOYSA-N 329.316 2.949 5 50 EFBA O=[N+]([O-])c1cc([N+](=O)[O-])c(Nc2ccccc2CO)c([N+](=O)[O-])c1 100288819 BRRNCNFTEPRLHZ-UHFFFAOYSA-N 334.244 2.647 5 50 EFBA C[C@H](NCCn1cccn1)c1ccc([N+](=O)[O-])cc1Br 888098237 DRQCSMJVMPTGHK-JTQLQIEISA-N 339.193 2.905 5 50 EFBA CN(Cc1ccccc1N1CCOCC1)c1cc(N)ccc1[N+](=O)[O-] 193377253 TXAREEIZYSMQBI-UHFFFAOYSA-N 342.399 2.650 5 50 EFBA CN1CCC[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1cccs1 245316727 KIZGVNQVNBGSTA-MFKMUULPSA-N 348.432 2.524 5 50 EFBA Cc1cc([N+](=O)[O-])nn1Cc1ccc(C(=O)Nc2nccs2)cc1 2756020 ILUBGCNKZMJDBQ-UHFFFAOYSA-N 343.368 2.857 5 50 EFBA CCN(c1ccc(O)cc1)S(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 253398392 VBMDAWOQNRITEU-UHFFFAOYSA-N 342.398 2.886 5 50 EFBA CCn1cnnc1C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 132028924 IOGCELINWLAZSI-UHFFFAOYSA-N 344.375 2.618 5 50 EFBA CN(Cc1cccc(N(C)C)c1)C(=O)c1cc([N+](=O)[O-])ccc1O 182135269 ACXCTMIVEFGVDE-UHFFFAOYSA-N 329.356 2.639 5 50 EFBA COC(=O)[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)c(C)c1 183830739 DXIFITHVOVPKPU-OAHLLOKOSA-N 346.314 2.686 5 50 EFBA O=[N+]([O-])c1ccc(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1 72400618 MTDLIOADHKERAQ-UHFFFAOYSA-N 348.227 2.910 5 50 EFBA in-vitro O=C(Nc1ccc(C(=O)O)c([N+](=O)[O-])c1O)OCc1ccccc1 670432139 XQTNBHXQUVQXIQ-UHFFFAOYSA-N 332.268 2.747 5 50 EFBA Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(-c2ccc(F)cc2)o1 194585040 DCCCTTOICXPZQC-UHFFFAOYSA-N 330.275 2.980 5 50 EFBA CC(C)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 468905 AWWQOOIRXJLKPO-UHFFFAOYSA-N 327.340 2.985 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 3947410 UEOWDZALSKFUNI-UHFFFAOYSA-N 337.313 2.612 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@@H](C(=O)O)c1ccccc1 4738197 LCIYTCHGMLWPSO-ZNFPLGDCSA-N 326.308 2.550 5 50 EFBA O=C(Nc1ccnn1CCc1ccccc1)c1ccc([N+](=O)[O-])o1 123352475 WVEFCHQANNXJFM-UHFFFAOYSA-N 326.312 2.879 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCN(c2ccccn2)C1 162764643 ZHYUAXLWBUQNBR-ZDUSSCGKSA-N 341.371 2.699 5 50 EFBA O=[N+]([O-])c1cc(Br)c(F)cc1OCCn1cccn1 188637592 BBQWRYRZEANOAZ-UHFFFAOYSA-N 330.113 2.772 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 195678 LTFWCPVQIQEGIE-OAHLLOKOSA-N 347.371 2.764 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(CN2CCOCC2)cc1 20137296 JQVICMCQCSVQNU-UHFFFAOYSA-N 341.367 2.679 5 50 EFBA C[C@H](C(=O)NCC12CC3CC(CC(C3)C1)C2)n1cc([N+](=O)[O-])cn1 6524282 KTJMVBRDZOUBQJ-SFCYXTAJSA-N 332.404 2.685 5 50 EFBA CC1CCN(C[C@H](O)CNc2nccc3ccc([N+](=O)[O-])cc23)CC1 413145325 ZQEDBDWCLSFQLD-MRXNPFEDSA-N 344.415 2.648 5 50 EFBA CCOCCCN1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C)[C@@H](C)C1 229697208 AYFLDVMVFUWDAK-HOCLYGCPSA-N 336.436 2.847 5 50 EFBA CCOC(=O)Cc1csc(CNc2ccc(F)cc2[N+](=O)[O-])n1 952994675 TVSQJLQOUDTCPR-UHFFFAOYSA-N 339.348 2.908 5 50 EFBA Cc1ccc(N[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 2876684 DSHJOOHBRVCGIR-HNNXBMFYSA-N 325.324 2.647 5 50 EFBA O=C1C[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)O1 616967 BDIMBBHVLORZBG-HOCLYGCPSA-N 326.308 2.838 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](c2ccc(F)cc2)C1 328588048 NQMLZOBVKPOOMX-GFCCVEGCSA-N 329.331 2.946 5 50 EFBA O=C(c1cccc(F)c1)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19773796 KQSNODABNQYPDX-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA CN1C[C@H](c2ccccc2)[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 371528342 LCHOWKGOEIPVOA-CVEARBPZSA-N 343.358 2.562 5 50 EFBA Cn1c2nc3ccccc3nc2c2c(=O)n(Cc3ccccc3)cnc21 4858104 XKUWPMOPQMBDRM-UHFFFAOYSA-N 341.374 2.880 5 50 EFBA O=C(Nc1ccccc1N1CCOCC1)c1ccccc1[N+](=O)[O-] 460616 OORLUFBHFYYATC-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA C[C@@H]1C(c2ccc(F)cc2)=[N+]([O-])[C@](C)(c2ccc([N+](=O)[O-])cc2)N1O 4819945 JSTIHOYGIPKDHH-PIGZYNQJSA-N 345.330 3.000 5 50 EFBA O=c1c([N+](=O)[O-])c(N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@H]23)nc2ccccn12 252457325 ZCBJXWWIUXMSLT-IKOXMDCHSA-N 340.383 2.839 5 50 EFBA CC[C@]1(O)CCCN(C(=O)c2cc(C)c(Cl)c([N+](=O)[O-])c2)C1 1875279033 VCQCBOSMFUYIDA-HNNXBMFYSA-N 326.780 2.934 5 50 EFBA COC(=O)c1cccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1C 467184 JJYWIMTWCLPSMZ-UHFFFAOYSA-N 344.323 2.951 5 50 EFBA C[C@H]1C(c2cccs2)=[N+]([O-])[C@@](C)(c2cccc([N+](=O)[O-])c2)N1O 4315146 RSYWLMKGYLYSKM-BONVTDFDSA-N 333.369 2.922 5 50 EFBA Cn1c(Sc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1cnccn1 225560531 LKHXEPQMDNXWLW-UHFFFAOYSA-N 348.775 2.985 5 50 EFBA Cc1cccc2s/c(=N\S(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c12 17072547 ZKVRXBXPUUTBLG-UHFFFAOYSA-N 349.393 2.736 5 50 EFBA C[N+]1(C)C[C@@H]2CCN(c3nc(C(F)(F)F)nc4ccccc34)[C@H]2C1 1775988559 WKJGFMGXDYLVET-FZMZJTMJSA-N 337.369 2.934 5 50 EFBA CCOc1cccc(N2CCC(C(=O)N3CCCC3)CC2)c1[N+](=O)[O-] 302220811 MFJKXHMJHKPEPS-UHFFFAOYSA-N 347.415 2.832 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccccc2Cl)c1 4313582 CUFRGFRWDNWYBH-UHFFFAOYSA-N 326.761 2.727 5 50 EFBA O=C(NCc1cscn1)c1cccc([N+](=O)[O-])c1Br 156228677 OFBHGJPFMFQPAQ-UHFFFAOYSA-N 342.174 2.744 5 50 EFBA Cc1ccc(NC(=O)C2CCN(c3ncc([N+](=O)[O-])s3)CC2)nc1 195509862 CKELPSOTDGFBCH-UHFFFAOYSA-N 347.400 2.610 5 50 EFBA COc1ccc(-c2nn(-c3ccccc3)cc2CO)cc1[N+](=O)[O-] 176749 YETNOSQFJWYCSI-UHFFFAOYSA-N 325.324 2.948 5 50 EFBA COC(=O)c1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1C 555161 JZDIWSWFWGYGGA-UHFFFAOYSA-N 328.324 2.871 5 50 EFBA C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 176730995 AQRTXXBZISOOED-GTNSWQLSSA-N 346.362 2.760 5 50 EFBA Cc1c(C(=O)NCc2ccc[nH]2)cc(Br)cc1[N+](=O)[O-] 134664096 XAXAQKLKCHKDMI-UHFFFAOYSA-N 338.161 2.924 5 50 EFBA COc1ccc(NC(=O)CNC2[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])c1 182953307 RURJHTQSFLLRPA-VXGBXAGGSA-N 335.404 2.956 5 50 EFBA Cc1nn(C)c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] 1002057 FEWLUAMDALALCA-UHFFFAOYSA-N 344.249 2.788 5 50 EFBA COc1nc(C)ccc1C(=O)N1CCCc2c1cccc2[N+](=O)[O-] 328593028 YKLCUOWODWOXNV-UHFFFAOYSA-N 327.340 2.900 5 50 EFBA O=C(c1cc([N+](=O)[O-])cnc1O)N1CC[C@H](Cc2ccc(F)cc2)C1 129304683 HYGISDWJMJKYGU-GFCCVEGCSA-N 345.330 2.539 5 50 EFBA CC(=O)N1C(=O)NC(c2ccccc2)=C([N+](=O)[O-])[C@H]1c1ccccc1 2813040 RWXFGGZHHUWHQS-MRXNPFEDSA-N 337.335 2.945 5 50 EFBA CCOc1ccc(NC(=O)c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 3899982 UUFJWBUOTUSGGZ-UHFFFAOYSA-N 330.296 2.975 5 50 EFBA CC(=O)OC(C)(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 22341673 FAVNALHACFAFMT-UHFFFAOYSA-N 334.250 2.894 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@](C)(c2ccccc2)C1 156652252 MLWVYERPYCZCGW-SFHVURJKSA-N 341.367 2.686 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC[C@H](C(F)(F)F)C1 92607 JFLLFVAEUVXDLN-VIFPVBQESA-N 338.307 2.558 5 50 EFBA O=C(CSc1nc2ccccc2[nH]1)Nc1ccc([N+](=O)[O-])cc1O 4755250 XLIIDEAFONGZGT-UHFFFAOYSA-N 344.352 2.908 5 50 EFBA COc1cc(OC)cc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c1 4842846 QKZYHQKSQHRFKB-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=c1c([N+](=O)[O-])c(N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@H]32)nc2ccccn12 252457327 ZCBJXWWIUXMSLT-XGFWRYKXSA-N 340.383 2.839 5 50 EFBA COc1cccc2c1OC[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])C2 172970434 RNJMHXMLJXUORE-CYBMUJFWSA-N 342.351 2.645 5 50 EFBA O=C(Cn1c(=O)sc2cc([N+](=O)[O-])ccc21)OCc1ccccc1 5736882 QKJKOGIMTVFBOQ-UHFFFAOYSA-N 344.348 2.715 5 50 EFBA CC[C@H](Sc1nnc(N)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 2846975 YUFCRDNYHIUNRO-VIFPVBQESA-N 339.402 2.538 5 50 EFBA Cc1cccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2O)c1 4676489 QIUWQXIQVASFDA-UHFFFAOYSA-N 331.353 2.736 5 50 EFBA COc1cccc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1 169355 FXOZDKFILJWIOD-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA Cc1ccc(CNc2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-] 225443766 NFRCLJGXCHIGFF-UHFFFAOYSA-N 349.412 2.766 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2cccc(OCc3ccccc3)c2)N1 2602687 OZIYDKVKDFPAQG-AEFFLSMTSA-N 326.352 2.862 5 50 EFBA Cn1cc([N+](=O)[O-])c(C(=O)N2CC3(CCCC3)c3c(F)cccc32)n1 253418223 JTAFMJFGLBZRBO-UHFFFAOYSA-N 344.346 2.940 5 50 EFBA O=c1c2ccccc2oc2nc3ccn(N4CCCCC4)c(=O)c3cc12 1395618 PDSDFKWNBKXSTN-UHFFFAOYSA-N 347.374 2.778 5 50 EFBA CN1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 371528344 LCHOWKGOEIPVOA-HZPDHXFCSA-N 343.358 2.562 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4543932 UQEFOWMLLCAWDR-UHFFFAOYSA-N 347.321 2.835 5 50 EFBA COc1ccc([C@@H](CC(=O)O)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 99593 SVHWGYATCSUPBY-OAHLLOKOSA-N 344.323 2.549 5 50 EFBA Cn1ncc(C2CC2)c1CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 952992981 LTZPYNAIYAVGDK-UHFFFAOYSA-N 348.790 2.718 5 50 EFBA CCOc1cc(/C=C/[N+](=O)[O-])cc(I)c1O 475143 CXTWTQFEUFZRHZ-ONEGZZNKSA-N 335.097 2.643 5 50 EFBA COc1cc(/C=C2/SC(=S)N=C2O)c([N+](=O)[O-])cc1OC 1194415 PDHLPWGLBDIAAP-ONNFQVAWSA-N 326.355 2.941 5 50 EFBA O=[N+]([O-])c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1 3877219 LDSZMVZOUJLXLX-UHFFFAOYSA-N 329.337 2.944 5 50 EFBA CCCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccccc1[N+](=O)[O-] 2758318 JVMUYUGQUJUING-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA CCc1[nH]nc(C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] 172377475 SNMQQFOVVIMGDM-LBPRGKRZSA-N 346.362 2.724 5 50 EFBA O=c1[nH]c(/C=C/c2cc(Cl)c(O)c(Cl)c2)nc(O)c1[N+](=O)[O-] 9065596 WEFRBGPFQWCEPE-OWOJBTEDSA-N 344.110 2.567 5 50 EFBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)cn1 43535 WSNACONTIPRCGH-UHFFFAOYSA-N 336.145 2.934 5 50 EFBA CCCC1=C(C(=O)OCC)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 175944 UMWRXSTUWPHNJL-AWEZNQCLSA-N 333.344 2.566 5 50 EFBA CC1(C)C(=O)Nc2ccccc2N1C(=O)c1ccc([N+](=O)[O-])cc1 238032 XJWBTAXRXBRJTQ-UHFFFAOYSA-N 325.324 2.972 5 50 EFBA CCOC(=O)c1ccccc1NC(=O)COc1ccccc1[N+](=O)[O-] 115686 YBZRNXCDGYWUIV-UHFFFAOYSA-N 344.323 2.789 5 50 EFBA COC(=O)[C@@H](CC(C)C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 303026 GXCIPISFQFCFNB-GFCCVEGCSA-N 328.752 2.566 5 50 EFBA Cc1nonc1OCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4004278 WAJMNCWBNJIZPW-UHFFFAOYSA-N 332.238 2.796 5 50 EFBA O=C(Nc1cccc(N2CCCNC2=O)c1)c1cccc([N+](=O)[O-])c1 174096080 QFBFVALCQAJUIX-UHFFFAOYSA-N 340.339 2.767 5 50 EFBA Cn1nnc2cc(C(=O)Nc3ccc([N+](=O)[O-])c4ncccc34)ccc21 185456587 TZMHRIRFYQJWAY-UHFFFAOYSA-N 348.322 2.677 5 50 EFBA COC(=O)c1[nH]c(C)c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1C 178397905 DYCDTEBTOIAVDG-UHFFFAOYSA-N 345.355 2.599 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1 17068223 UBSYTORUDLHNLU-YGRLFVJLSA-N 332.356 2.814 5 50 EFBA O=C(O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 239235622 WIVIBAYEYWRCMI-GYBADROVSA-N 336.731 2.710 5 50 EFBA Cc1ccc(C(=O)N/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O)cc1 5002783 BYPKLDODFSDYKL-GDNBJRDFSA-N 326.308 2.759 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cc(=O)[nH]c2ccccc12 225562232 CHBSTRZUISNUSH-UHFFFAOYSA-N 337.335 2.675 5 50 EFBA CC1(C)COCCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] 279418661 XZJFDYWNXSRPIW-UHFFFAOYSA-N 330.743 2.567 5 50 EFBA O=[N+]([O-])c1cc(Cl)ccc1NC1=NS(=O)(=O)c2ccccc21 4821376 RXSQYXCKIZPCCY-UHFFFAOYSA-N 337.744 2.809 5 50 EFBA CCOc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c([N+](=O)[O-])c1 4894099 YXRPEKKZQFSYDN-RYUDHWBXSA-N 334.328 2.599 5 50 EFBA O=C(O)[C@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4517261 HJQHTLAEPSKXQJ-ZDUSSCGKSA-N 331.284 2.611 5 50 EFBA in-vitro CCc1c(NCc2cn(C)nc2[N+](=O)[O-])cnn1-c1ccccc1C 902043527 ORWYVRVAIRLSIR-UHFFFAOYSA-N 340.387 2.997 5 50 EFBA CN1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 4185794 IOIWNQFKYZGKBN-UHFFFAOYSA-N 325.368 2.578 5 50 EFBA CC[C@H](O)CN1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 252483411 FAXHWVAGRDKCNI-NSHDSACASA-N 348.230 2.795 5 50 EFBA O=C(NC[C@@H]1CCCC[C@H]1O)Nc1cc([N+](=O)[O-])ccc1Cl 170594005 BRWNKCZHIBBQOR-TVQRCGJNSA-N 327.768 2.921 5 50 EFBA O=c1[nH]cnc2cc(NCCOC3CCCCCC3)c([N+](=O)[O-])cc12 170631080 RVRWQBAFKAJMLW-UHFFFAOYSA-N 346.387 2.983 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccccc1[N+](=O)[O-] 4017923 VKQCDGNQTPNRPW-HNNXBMFYSA-N 330.296 2.893 5 50 EFBA O=C(CN1CCCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] 4993636 BGRVIKTZGQRTGG-UHFFFAOYSA-N 342.193 2.782 5 50 EFBA CC(C)[N@+]1(C)[C@H]2CC[C@H]1C[C@@H](OC(=O)[C@@H](CO)c1ccccc1)C2 253387918 OEXHQOGQTVQTAT-MFPFFRNPSA-N 332.464 2.854 5 50 EFBA COc1ccc(C(=O)NCCOCc2ccccc2)cc1[N+](=O)[O-] 2870070 REQYTMLJQFIEOB-UHFFFAOYSA-N 330.340 2.550 5 50 EFBA biogenic C[C@H]1CCC[C@@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 4700888 QGQQGJRYAOYXPD-WMLDXEAASA-N 331.416 2.931 5 50 EFBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCc2cn[nH]c21 253425554 DEZCDOWXMOCRSN-GFCCVEGCSA-N 345.359 2.916 5 50 EFBA Cc1c([N+](=O)[O-])cnn1CCC(=O)NC12CC3CC(CC(C3)C1)C2 6921777 VSHMPQJHKCIBAJ-UHFFFAOYSA-N 332.404 2.575 5 50 EFBA CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C 39050540 KVEDDVRFINSSND-ZDUSSCGKSA-N 338.360 2.594 5 50 EFBA Cn1c(CCNC(=O)C2CCCCC2)nc2cc([N+](=O)[O-])ccc21 12970266 MOENMGADWCQLDG-UHFFFAOYSA-N 330.388 2.721 5 50 EFBA Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4820965 NOVBJWKIIGJFMI-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA CCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 2754649 OHCVKBQKLUCPTO-CQSZACIVSA-N 333.344 2.518 5 50 EFBA C[C@]1(c2ccsc2)CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O 328594274 NURUKMILUOGQSD-MRXNPFEDSA-N 330.365 2.873 5 50 EFBA N=C1NC(=O)/C(=C/c2ccc(Oc3ccc([N+](=O)[O-])cn3)cc2)S1 33933261 XWTBCBVPLDSBBI-GHXNOFRVSA-N 342.336 2.921 5 50 EFBA CCc1[nH]nc(C(=O)NCC(C)(C)c2ccccc2F)c1[N+](=O)[O-] 171666084 LCTKJPQPZFICEY-UHFFFAOYSA-N 334.351 2.727 5 50 EFBA CC(=O)[C@@H](Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 146391 HUKMPYQTVOVJAI-MRXNPFEDSA-N 333.365 2.569 5 50 EFBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccn[nH]2)C1 249375898 KGNNVVHYVFLQJW-CHWSQXEVSA-N 343.387 2.525 5 50 EFBA Cc1[nH]nc(Nc2ccc(I)cc2)c1[N+](=O)[O-] 4321172 UPAKAFUGYAYBQW-UHFFFAOYSA-N 344.112 2.975 5 50 EFBA CN1CCC[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1cccs1 245316726 KIZGVNQVNBGSTA-GWCFXTLKSA-N 348.432 2.524 5 50 EFBA COc1ccc(C2=NO[C@@H](CNc3ccc([N+](=O)[O-])cn3)C2)cc1 239672483 BTGMXCKWFHKJST-CQSZACIVSA-N 328.328 2.604 5 50 EFBA COc1ccc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 68836 HGHDOLGYCOVGAZ-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA CN(C[C@H]1OCCc2ccccc21)C(=O)c1ccc([N+](=O)[O-])c(O)c1 169974683 HOZMRDCGWUNSLE-QGZVFWFLSA-N 342.351 2.686 5 50 EFBA Cc1ccc(OCC(=O)NC(=S)Nc2ccccc2[N+](=O)[O-])cc1 4561298 MTHLTBCNHQXGAX-UHFFFAOYSA-N 345.380 2.795 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccccc2F)C1 620560 NOPFOAFXNSGHKX-LLVKDONJSA-N 343.314 2.726 5 50 EFBA C[C@@H]1CCC[C@@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 4700887 QGQQGJRYAOYXPD-RHSMWYFYSA-N 331.416 2.931 5 50 EFBA COc1cccc(C(=O)NC(=S)Nc2ccccc2[N+](=O)[O-])c1 4706666 OSECBZDMGVFJFJ-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA CCOC(=O)c1cn(CCNc2ccc([N+](=O)[O-])cc2Cl)cn1 225534348 JUGINKSZAIDWMW-UHFFFAOYSA-N 338.751 2.734 5 50 EFBA CC[C@H](c1nc2c3ccccc3ncn2n1)n1nc([N+](=O)[O-])cc1C 2806645 KGHHBRINFWMRTL-CYBMUJFWSA-N 337.343 2.690 5 50 EFBA O=C(c1cccs1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19799541 RFBYKNLZAYHRTD-UHFFFAOYSA-N 331.397 2.614 5 50 EFBA O=C(CSCC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1ccccc1 2870310 ISRWSQAIWVGUTF-UHFFFAOYSA-N 345.380 2.905 5 50 EFBA COc1nonc1OCCCNc1cc(Cl)ccc1[N+](=O)[O-] 4565402 YZGQDQPOGQEZAA-UHFFFAOYSA-N 328.712 2.521 5 50 EFBA Cc1nc(C)c(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)o1 173424098 DRNYZEYCJUBDFY-UHFFFAOYSA-N 345.355 2.883 5 50 EFBA O=C(Nc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])c(O)c1 180602124 UIZGFZCQGIMILG-UHFFFAOYSA-N 327.218 2.967 5 50 EFBA C[N+]1(C[C@@H](O)Cn2c3ccccc3c3ccccc32)CCOCC1 303667 MHBPESFEIGWDIW-INIZCTEOSA-N 325.432 2.632 5 50 EFBA CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 455834 DXHPANJSEMRWAH-SNVBAGLBSA-N 340.763 2.664 5 50 EFBA O=[N+]([O-])c1cccc(OCCN2CCN(Cc3ccccc3)CC2)c1 4832350 KXDBZZVWAKXDGI-UHFFFAOYSA-N 341.411 2.791 5 50 EFBA COc1cc2c(cc1OC)CN(Cc1ccc(O)c([N+](=O)[O-])c1)CC2 4986611 HWLMCFZFSNGSDZ-UHFFFAOYSA-N 344.367 2.876 5 50 EFBA COc1cc(CNCc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC 19720658 HFFIKFDYYWGLOP-UHFFFAOYSA-N 346.339 2.631 5 50 EFBA O=[N+]([O-])c1ccc(NCCCNS(=O)(=O)Cc2ccccc2)cc1 4359157 HOLVJBMUQNXEGG-UHFFFAOYSA-N 349.412 2.516 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccccc2OCc2ccccc2)N1 90397 PVMKAAOHTYLXNF-QAPCUYQASA-N 326.352 2.862 5 50 EFBA COc1cccc(NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)c1 356002 BDSOPECASMENNW-UHFFFAOYSA-N 342.311 2.694 5 50 EFBA COc1ccccc1OS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C 175058796 JFFXNVQZPWINII-UHFFFAOYSA-N 337.353 2.988 5 50 EFBA O=C(Cc1ccc(Br)cc1)Nc1ncc([N+](=O)[O-])s1 4679159 CPJLEFWHDGPJKX-UHFFFAOYSA-N 342.174 2.995 5 50 EFBA COc1ccccc1NC(=S)NC(=O)c1ccccc1[N+](=O)[O-] 4687359 KUEBRCVCLQFLOK-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA Cc1cc(OCC(=O)N2CCn3cccc3[C@@H]2C)ccc1[N+](=O)[O-] 280883289 UKQDVJBIDKIUNZ-ZDUSSCGKSA-N 329.356 2.687 5 50 EFBA Cc1c(CC(=O)Nc2ccc3c(c2)NC(=O)CC3)cccc1[N+](=O)[O-] 125389683 NFKTXIGQHBXRDS-UHFFFAOYSA-N 339.351 2.969 5 50 EFBA COc1c(NCc2ccccc2[N+](=O)[O-])cc(Cl)cc1C(N)=O 253415878 OKXIBPNLEJBBLX-UHFFFAOYSA-N 335.747 2.968 5 50 EFBA O=[N+]([O-])c1ccccc1NCc1nnc2n1CC[C@H](C(F)(F)F)C2 952992977 DQBBMYDYZJZETF-VIFPVBQESA-N 341.293 2.923 5 50 EFBA COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1cccc([N+](=O)[O-])c1 62712 XDYUYEYDZPQVEI-HNNXBMFYSA-N 330.296 2.893 5 50 EFBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1N1CCc2ccccc2C1 4188683 LYCMUSXSBANFJT-UHFFFAOYSA-N 339.395 2.994 5 50 EFBA Cc1cccc(NC(=O)c2[nH]nc([N+](=O)[O-])c2Br)c1C 113849 GMZBMDOUZLUAMY-UHFFFAOYSA-N 339.149 2.950 5 50 EFBA COc1ccc(OC)c(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 3061371 LCOJCEQDSCAZCK-UHFFFAOYSA-N 347.283 2.773 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc(Cl)cc2)c1 4313583 OMCVPIJPIUPUHT-UHFFFAOYSA-N 326.761 2.727 5 50 EFBA O=C(Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1 4998354 HKOMWHHIQURRQY-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA O=C(C[C@@]1(O)C(=O)Nc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 312427 HHFRTRAUPLVFSG-INIZCTEOSA-N 346.726 2.661 5 50 EFBA CC(=O)Oc1ccc(C)cc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 313105 IXGCHWFZAQTUAY-UHFFFAOYSA-N 340.291 2.629 5 50 EFBA O=C(c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1 2880126 JILIMWLQMUOCKL-UHFFFAOYSA-N 328.324 2.860 5 50 EFBA O=[N+]([O-])c1ccc(N2CCNCC2)cc1NCCc1ccccc1 4182966 LIMYVGPNCAUDCT-UHFFFAOYSA-N 326.400 2.659 5 50 EFBA CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)c1cccc(F)c1 252484574 FZOICVLGYQDWTI-AWEZNQCLSA-N 348.330 2.596 5 50 EFBA Cc1cc(N2CCC3(CC2)C[C@@H]3C(=O)N2CCCC2)ncc1[N+](=O)[O-] 253422896 GJJPSHXQXBZMQE-CQSZACIVSA-N 344.415 2.527 5 50 EFBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@@H]1/C=C/c1cccs1 253418833 AMHZREZBENZSKN-BTDICHCPSA-N 332.385 2.557 5 50 EFBA CCOC(=O)c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 285207 PLTFXFUCXCPWRZ-UHFFFAOYSA-N 340.291 2.572 5 50 EFBA CN1C(=O)c2oc3ccccc3c(=O)c2[C@H]1c1ccc([N+](=O)[O-])cc1 4851256 DBPXOCHTHNFXGC-OAHLLOKOSA-N 336.303 2.876 5 50 EFBA COc1cc([N+](=O)[O-])cc2c1NC(c1cccc([N+](=O)[O-])c1)=NO2 3878807 PQXGDQYDXIYBFA-UHFFFAOYSA-N 330.256 2.678 5 50 EFBA COc1ccccc1N1CCN(Cc2ccc(O)c([N+](=O)[O-])c2)CC1 4639275 DLAZZMNIQIPAFK-UHFFFAOYSA-N 343.383 2.631 5 50 EFBA CN(C)C1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 169725426 JINFDSVVZZEHRE-UHFFFAOYSA-N 328.210 2.888 5 50 EFBA O=C(CNc1c(Cl)cc([N+](=O)[O-])cc1Cl)NCC(F)(F)F 121774517 JYSBFPMVIVOWHV-UHFFFAOYSA-N 346.092 2.992 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1O)N1CCO[C@H](c2cccs2)C1 163244284 KFEHJRSBORRXSK-LBPRGKRZSA-N 334.353 2.576 5 50 EFBA CCn1cc(CN(C)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(C)n1 474782 IOPONBAIRFWHHC-JXMROGBWSA-N 328.372 2.791 5 50 EFBA O=c1cc2c(=O)[nH]c3ccccc3n2c2c(F)c(F)c(F)c(F)c12 16134047 ZNIJCTBBHDICMG-UHFFFAOYSA-N 334.228 2.851 5 50 EFBA Cc1ccc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 20367226 QAPOEBZQKWGILG-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA CC1(C)[C@H]([N+](=O)[O-])[C@@H](c2ccco2)N[C@@H](c2ccco2)[C@H]1[N+](=O)[O-] 239235645 WKSGTJWBIMDLLN-XJFOESAGSA-N 335.316 2.575 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 192706323 HCGQVYVRPQXARF-UKRRQHHQSA-N 333.436 2.573 5 50 EFBA O=[N+]([O-])c1ccc(NC(=S)N2CCN(c3ccccn3)CC2)cc1 18251136 BEXHDVXPLXAICZ-UHFFFAOYSA-N 343.412 2.509 5 50 EFBA O=C(Nc1ccccc1O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 309616 PUCQRHZQVSMUQE-UHFFFAOYSA-N 326.264 2.659 5 50 EFBA O=C(NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(F)cc1 452708 ZUKUYMDMKZAGIJ-UHFFFAOYSA-N 337.307 3.000 5 50 EFBA Cc1cccc(C(=O)N2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] 465427 RTRHUXQOHMZIQD-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA CN(Cc1ccccc1)C(=S)NC(=O)c1cccc([N+](=O)[O-])c1 587337 BGSSGEPBVHAOQB-UHFFFAOYSA-N 329.381 2.742 5 50 EFBA CCOC(=O)[C@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4975497 SLJSZVXIXLCLIH-MRXNPFEDSA-N 342.351 2.955 5 50 EFBA N[C@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 237843970 GKILFNBQTOLTCM-QGZVFWFLSA-N 325.368 2.570 5 50 EFBA CCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 1403356 MATFYDNPOIZRQL-JTQLQIEISA-N 338.747 2.689 5 50 EFBA c1ccc(N(C[C@@H]2CO[B-]34OCC[N+]23CCO4)c2ccccc2)cc1 198005401 BOXJTFNKAGOEMC-VRKFHHGPSA-N 338.216 2.536 5 50 EFBA O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccccc2[N+](=O)[O-])N1 33180 ZKQJJSPFSANANO-GOEBONIOSA-N 337.335 2.764 5 50 EFBA biogenic COc1ccc(C(=O)NC(=S)Nc2ccccc2[N+](=O)[O-])cc1 4551177 DOEAAZCLPVZNKY-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@H](CCc1ccccc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2754463 HSPPUSZOYWFMNN-CYBMUJFWSA-N 334.397 2.894 5 50 EFBA O=C(O)C[C@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4599348 GGLUURJRYCGAJJ-ZDUSSCGKSA-N 328.324 2.867 5 50 EFBA O=C(NCc1nc2cc(F)ccc2[nH]1)c1ccc(F)cc1[N+](=O)[O-] 136076667 HFXVMBPFCPBNDF-UHFFFAOYSA-N 332.266 2.679 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1[C@H]2Cc3ccccc3[C@H]21 252536938 JVDIDQUKWIFDCW-IAOVAPTHSA-N 344.392 2.749 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCc2cnn(C(C)C)c2C1 365671473 DVSJEUCXUKGOTB-CQSZACIVSA-N 342.399 2.968 5 50 EFBA CCOC(=O)N(CCCN(CC)CC)c1ncc([N+](=O)[O-])s1 96027540 ZZZCSNHLYBIUJX-UHFFFAOYSA-N 330.410 2.746 5 50 EFBA C[C@H]1C[C@H](C)CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)C1 1060581 DMHYHMHYHDBQLI-QWRGUYRKSA-N 330.340 2.819 5 50 EFBA Cc1ccc(C)c(OC(=O)C[S@@](=O)c2ccccc2[N+](=O)[O-])c1 4387507 MHGVIMPHYXCORW-QHCPKHFHSA-N 333.365 2.925 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3noc(C4CC4)n3)C2)n1 253419443 UDMONJQSAYPWQH-GFCCVEGCSA-N 329.360 2.943 5 50 EFBA CCCOc1ccnc(SCC(=O)Nc2cccc([N+](=O)[O-])c2)n1 2791594 KWNMKNYNDMFKSG-UHFFFAOYSA-N 348.384 2.904 5 50 EFBA Cn1ccnc1C[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 151506881 YBZSVIKCYFZSDZ-ZDUSSCGKSA-N 343.387 2.815 5 50 EFBA Cc1nn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1cccc(Cl)c1 4072925 YEATYSCCXZAURT-UHFFFAOYSA-N 344.758 2.952 5 50 EFBA COc1cc(CN(C)CCc2ccccn2)c([N+](=O)[O-])cc1OC 19606641 MMWFZGKXPGIQGO-UHFFFAOYSA-N 331.372 2.682 5 50 EFBA CCN(CC)C(=O)[C@H]1CCCN(Cc2ccc([N+](=O)[O-])s2)C1 6661993 DJGCGKWXQLJPRQ-LBPRGKRZSA-N 325.434 2.737 5 50 EFBA Cc1cc(NC(=O)N[C@H]2c3ccccc3C[C@H]2O)ccc1[N+](=O)[O-] 121300114 DYTIVTGKXZVGNW-CVEARBPZSA-N 327.340 2.683 5 50 EFBA O=c1[nH]c(O)nc(/C=C/c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] 4011483 JNLJIKYEDOPSIG-DUXPYHPUSA-N 328.111 2.861 5 50 EFBA Nc1cc(C(F)(F)F)c([N+](=O)[O-])cc1I 40564494 LIFWKVXKKCOJPY-UHFFFAOYSA-N 332.019 2.800 5 50 EFBA Cc1c([N+](=O)[O-])ncn1CCOc1ccccc1Br 1775991975 IDEDGQDVQWJWOO-UHFFFAOYSA-N 326.150 2.941 5 50 EFBA C[C@@H]1C[C@@H](C)CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)C1 1060580 DMHYHMHYHDBQLI-GHMZBOCLSA-N 330.340 2.819 5 50 EFBA CC[C@H](C)OC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-] 4913313 NKQQPQURILVHAS-GXFFZTMASA-N 332.356 2.814 5 50 EFBA Cc1ocnc1C(=O)O[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 170605085 AJSIFUOQQHXUAP-GFCCVEGCSA-N 349.318 2.856 5 50 EFBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccc(OCc3ccccc3)cc2)N1 89591 FVICUYAPMJJFFN-SJLPKXTDSA-N 326.352 2.862 5 50 EFBA Cc1cccc([C@H]2CCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)n1 119248881 MTWHAZNPBJYCNL-CQSZACIVSA-N 327.340 2.981 5 50 EFBA COCCCNc1cc(C(=O)OC)c([N+](=O)[O-])cc1Br 1875327050 WXJNWDYBAGEXFV-UHFFFAOYSA-N 347.165 2.592 5 50 EFBA COC(=O)c1cc(C(=O)NCc2ccc(Cl)cc2)cc([N+](=O)[O-])c1 859654 RNAGYUFWOIULCB-UHFFFAOYSA-N 348.742 2.965 5 50 EFBA CCOC(=O)Cc1csc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 9012708 LAQSUDXMKAVPKA-UHFFFAOYSA-N 349.368 2.718 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1c2ccccc2C[C@H]1O 156057707 LBQFSUATHLWQMY-CVEARBPZSA-N 327.340 2.683 5 50 EFBA O=[N+]([O-])c1ccc(I)c(Br)c1 1675949 CJUZKENURNQSDJ-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA in-vitro O=C(c1ccc(SCc2ccco2)c([N+](=O)[O-])c1)N1CCOCC1 1061236 QEMRFELCVYMAMP-UHFFFAOYSA-N 348.380 2.953 5 50 EFBA Cc1ccc([N+](=O)[O-])c(N2CC[C@@H](OCc3c(C)noc3C)C2)n1 368769276 GGMMJVNEXTYDLS-CYBMUJFWSA-N 332.360 2.699 5 50 EFBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2c([nH]c3ccccc23)C1 170605173 YBGUMDPPIYQTMC-UHFFFAOYSA-N 336.351 2.857 5 50 EFBA CCOC(=O)c1sc(NC(=O)c2ccccc2[N+](=O)[O-])nc1C 131491 HTTDWYYGDSPLHO-UHFFFAOYSA-N 335.341 2.789 5 50 EFBA CO[C@@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(F)cc1 119107057 ZGXGRHIJLQDSOP-HNNXBMFYSA-N 334.303 2.557 5 50 EFBA COc1n[nH]c(C(=O)NCc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] 6381601 QVZARHLETVNLAM-UHFFFAOYSA-N 345.142 2.563 5 50 EFBA O=C(COc1ccc2ccc(=O)oc2c1)c1cccc([N+](=O)[O-])c1 609228 MZZCYPLIYVFACN-UHFFFAOYSA-N 325.276 2.963 5 50 EFBA CC(C)(C)c1nc(=NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)s[nH]1 411973470 QZZFGFFVIIKIFR-NWDGAFQWSA-N 346.412 2.908 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H](O)Cc1ccccc1 194937973 QUMRECXUJSQNFH-XJKSGUPXSA-N 328.368 2.625 5 50 EFBA O=C(Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1N1CCOCC1 5049691 VGPFVURQZKCIPJ-UHFFFAOYSA-N 341.367 2.613 5 50 EFBA CCOC(=O)c1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 243075 BTXZNKLLUSGMDZ-UHFFFAOYSA-N 340.291 2.572 5 50 EFBA Cc1cccc(C)c1-n1c(C)nn(Cc2ccc([N+](=O)[O-])cc2)c1=O 4088859 CYPPNEMDKWCCNE-UHFFFAOYSA-N 338.367 2.916 5 50 EFBA Cc1ccccc1CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 19237220 SIPLCMPYQSANLN-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ccc(F)cc2)CC1 445431 MNLSBYVMMYMDOB-UHFFFAOYSA-N 343.358 2.625 5 50 EFBA COc1ccc(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 1602975 BDOHQEPUDCPQMJ-UHFFFAOYSA-N 332.268 2.751 5 50 EFBA biogenic O=C(OCc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc([N+](=O)[O-])cc1 2534539 AXEOPFBUTAPVPS-UHFFFAOYSA-N 346.251 2.589 5 50 EFBA Cc1nn(C[C@@H](O)COc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] 179858916 YQFTZXUIRNTXTH-SECBINFHSA-N 346.170 2.846 5 50 EFBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC(=S)N1CCCCCC1 431985 OFRVNOKPNSYHSU-JXMROGBWSA-N 333.413 2.885 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])c(Sc3ccccn3)c2)CC1 4575590 PCXLBFJAJPIVSE-UHFFFAOYSA-N 330.413 2.893 5 50 EFBA CC[N+](CC)(CC)CCOC(=O)c1cc(OC)c(OC)c(OC)c1 1626909 UDKQGBNUPIFBSJ-UHFFFAOYSA-N 340.440 2.746 5 50 EFBA in-man NC(=O)[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 129674499 GBYZBYHUPYYQGP-LBPRGKRZSA-N 325.246 2.651 5 50 EFBA Cc1sc2ncn3nc([C@H](C)n4cc([N+](=O)[O-])cn4)nc3c2c1C 2808528 BCELRVOYYYVYLL-QMMMGPOBSA-N 343.372 2.670 5 50 EFBA COc1ccc(C(=O)CS(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 614873 HHENWXDOPOYXHS-UHFFFAOYSA-N 349.364 2.568 5 50 EFBA COc1cc(CCN)c(-c2n[nH]c3ccc([N+](=O)[O-])cc23)cc1OC 1857526892 JOVWZGUCSZMOJC-UHFFFAOYSA-N 342.355 2.657 5 50 EFBA O=C(CSCC(=O)Nc1ccccc1[N+](=O)[O-])Nc1ccccc1 4573097 ACEXCQAWDLWJNK-UHFFFAOYSA-N 345.380 2.905 5 50 EFBA O=C(O)C[C@@H](NC(=O)c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 4686331 ZRUWELAFCDOBPG-LLVKDONJSA-N 338.703 2.787 5 50 EFBA Cc1ccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 100815261 DSHJOOHBRVCGIR-OAHLLOKOSA-N 325.324 2.647 5 50 EFBA COc1ccc(C(=O)CSc2nc(C)cc(C)n2)cc1[N+](=O)[O-] 255566 XZGGKKQDXAIYAY-UHFFFAOYSA-N 333.369 2.985 5 50 EFBA CCCCOC(=O)N(CCCN(C)C)c1ncc([N+](=O)[O-])s1 96027538 URUDSCYXABOTOS-UHFFFAOYSA-N 330.410 2.746 5 50 EFBA Cc1cc(C)cc(Nc2c([N+](=O)[O-])cc(C(N)=O)cc2[N+](=O)[O-])c1 670417720 CAACCFPEJGYQSE-UHFFFAOYSA-N 330.300 2.962 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc(C(C)(C)C)on1 225443439 IEBVJOMIOISLPW-UHFFFAOYSA-N 339.373 2.990 5 50 EFBA O=C(C[C@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)cc1 5065444 SLKXWSJBCZVRTI-MRXNPFEDSA-N 346.726 2.661 5 50 EFBA O=C(O)C[C@H](NC(=O)c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 4686330 ZRUWELAFCDOBPG-NSHDSACASA-N 338.703 2.787 5 50 EFBA C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 450948 AFOZTEKAECGBDC-NSHDSACASA-N 328.324 2.857 5 50 EFBA C[C@H]1CN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)N1 4663380 QQXPEFSDYYTWGB-YUMQZZPRSA-N 348.281 2.708 5 50 EFBA Cc1cc(NC(=O)c2c[nH]nc2[N+](=O)[O-])cc(C)c1Br 225791546 RYBMQWOZABXTLD-UHFFFAOYSA-N 339.149 2.950 5 50 EFBA C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)C(=O)NCc1ccco1 301770257 FJXYUIAWAHRRFI-MRVPVSSYSA-N 325.271 2.583 5 50 EFBA C[C@@H]1C(c2cccs2)=[N+]([O-])[C@](C)(c2cccc([N+](=O)[O-])c2)N1O 4315155 RSYWLMKGYLYSKM-MEBBXXQBSA-N 333.369 2.922 5 50 EFBA CN(C)[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1cccs1 131651938 SFRCBKGRRLECIS-ZDUSSCGKSA-N 337.376 2.828 5 50 EFBA CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 164693533 PAQVWFWUCQFCTP-DOMZBBRYSA-N 336.388 2.872 5 50 EFBA Cc1c(C(F)(F)F)nn(C)c1NC(=O)Cc1cccc([N+](=O)[O-])c1 186116692 RHJJQAYSUOLZRU-UHFFFAOYSA-N 342.277 2.837 5 50 EFBA C[C@H]1[C@H](C(=O)N(C=O)c2cccc([N+](=O)[O-])c2)[C@H]2C=C[C@H]1C21CC1 101857276 IABITEUDZCOMLK-MPESAESLSA-N 326.352 2.933 5 50 EFBA CC(C)(C)C(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 4187966 TXTNIFWEXPBIGK-UHFFFAOYSA-N 325.796 2.943 5 50 EFBA C[C@@H]1CN(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C(=O)O1 4187197 IQGRETMLRRJDGI-MRVPVSSYSA-N 333.266 2.866 5 50 EFBA CN1C2=NC(=O)/C(=C/c3ccc([N+](=O)[O-])s3)N2c2ccccc21 100610667 HIZVBUYQLGBYNF-WQLSENKSSA-N 326.337 2.850 5 50 EFBA O=C1[C@@H](Oc2ccc([N+](=O)[O-])c(CO)c2)CCCN1c1ccccc1 328595881 IOXIFMCPAQGWNJ-KRWDZBQOSA-N 342.351 2.662 5 50 EFBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(c3ccncc3)CC2)n1 287912355 WAIDRCFAOQZFRG-UHFFFAOYSA-N 342.355 2.555 5 50 EFBA CN1CCN(c2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2)CC1 5050678 KVSLWVVJTUCSMP-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA CN(CCc1ccccc1)S(=O)(=O)c1csc([N+](=O)[O-])c1 119606147 BICMYQUABZQXSB-UHFFFAOYSA-N 326.399 2.520 5 50 EFBA Nc1ccc(C(=O)N(CC2CCC2)CC(F)(F)F)cc1[N+](=O)[O-] 121945118 BKQMARCLUGIEPT-UHFFFAOYSA-N 331.294 2.982 5 50 EFBA O=C(NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1F 361089 TYUVMPIYKFBLEE-UHFFFAOYSA-N 337.307 3.000 5 50 EFBA O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@@H]12 247362529 ZZUHCLYKPZDJLG-NIFZNCRKSA-N 330.384 2.915 5 50 EFBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)c1ncccc1C(F)(F)F 166177549 AJMFVKPIDSXPSH-UHFFFAOYSA-N 327.218 2.967 5 50 EFBA Cc1c(C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)cccc1[N+](=O)[O-] 4695626 DHVLEMHWKXBQHZ-UHFFFAOYSA-N 344.279 2.552 5 50 EFBA O=C(NCc1cccnc1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 4703812 OXHTUAVSXJFYTJ-UHFFFAOYSA-N 340.383 2.910 5 50 EFBA Cc1ccnc(N2CCN(c3cc(Cl)ccn3)CC2)c1[N+](=O)[O-] 952994168 WAZRZNBNTOLWLE-UHFFFAOYSA-N 333.779 2.673 5 50 EFBA O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CCOC2(CCCC2)C1 170055313 WRAYXWOSDDPEHH-HNNXBMFYSA-N 347.415 2.928 5 50 EFBA Cc1ccc(OCC(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 4599311 RVDVHFQJLSLAFV-UHFFFAOYSA-N 345.380 2.795 5 50 EFBA CC[C@](C)(NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)O 262461452 QUTOJCAVWNAVPT-HNNXBMFYSA-N 349.368 2.701 5 50 EFBA CCN1C(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)OC(C)C)=C1C 127024 OZIILXMYIGXSGV-HNNXBMFYSA-N 347.371 2.907 5 50 EFBA O=C(Nc1cc(NC(=O)C(F)(F)F)cc([N+](=O)[O-])c1)C(F)(F)F 1234977 OJRUHYZAQUQQNT-UHFFFAOYSA-N 345.155 2.596 5 50 EFBA C[C@H](Cc1cn(C)nn1)Nc1c(Br)cccc1[N+](=O)[O-] 952992554 NTKBEZLKXKPAQE-MRVPVSSYSA-N 340.181 2.529 5 50 EFBA COc1cccc(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)c1[N+](=O)[O-] 194543697 BMBJKUFVBLYGAM-KGLIPLIRSA-N 344.371 2.714 5 50 EFBA O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2Nc1cccc(Cl)c1 4372951 NVHGWODQAURQLD-UHFFFAOYSA-N 337.744 2.809 5 50 EFBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H](C)[S@@]1=O 1875262296 URHBFOJKOMJZIL-VABWDCHUSA-N 336.335 2.959 5 50 EFBA CO[C@@H]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 190817219 YPMDITQNUNQUJA-DTWKUNHWSA-N 343.177 2.655 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc2ccccc2oc1=O 4036839 XMXGEUAJAQDGRS-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA C[C@@H]1[C@H]2C=C[C@H]([C@@H]1C(=O)N(C=O)c1cccc([N+](=O)[O-])c1)C21CC1 101857269 IABITEUDZCOMLK-RAEVTNRLSA-N 326.352 2.933 5 50 EFBA CC(=O)c1cc(N2CCN(c3ncccc3F)CC2)ccc1[N+](=O)[O-] 240744102 HUMIJVBRRIUVRT-UHFFFAOYSA-N 344.346 2.658 5 50 EFBA N[C@@H](CSCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4521200 HOZQMLJHNCMSRC-HNNXBMFYSA-N 331.397 2.794 5 50 EFBA in-vitro Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c2cccnc2c1C 173119405 BCVHGAYQORLFJH-UHFFFAOYSA-N 339.355 2.985 5 50 EFBA O=C1CCCC[C@@H]1[C@@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] 170657208 IMHIMCXVBUVGCO-HIFRSBDPSA-N 345.399 2.757 5 50 EFBA C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H]1CO 190239432 PHDNBKBHIUSECT-UFBFGSQYSA-N 347.293 2.848 5 50 EFBA Cc1ccc(NC(=O)CCC(=O)N2CCC(C)CC2)c([N+](=O)[O-])c1 4856230 XRUBYCPPZUZDGU-UHFFFAOYSA-N 333.388 2.880 5 50 EFBA O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2ccccn2)CC1 4953576 JCZPTOPPTOWQOQ-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA CCOC(=O)[C@@H]1[C@@H](C(=O)OCC)[C@H]2C=C[C@H]1c1cccc([N+](=O)[O-])c12 216290375 MTKCNYRBENZGCV-APYUEPQZSA-N 345.351 2.704 5 50 EFBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2cccc(F)c2)C1 181023125 YCSSSULVQXEELH-HNNXBMFYSA-N 345.330 2.530 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)N1CCOCC1 20310882 GTWCDFASHVQCOG-QGZVFWFLSA-N 341.367 2.607 5 50 EFBA NC(=O)c1cccc(CCNc2ccc([N+](=O)[O-])c3cnccc23)c1 253393011 MKIJQLHWSBVYRR-UHFFFAOYSA-N 336.351 2.897 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 4589355 LDPJRTBIDDJKGT-NSHDSACASA-N 343.314 2.726 5 50 EFBA O=c1c([N+](=O)[O-])c(N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@@H]32)nc2ccccn12 252457328 ZCBJXWWIUXMSLT-XHJNMGKDSA-N 340.383 2.839 5 50 EFBA COc1cc2nc(-c3ccc([N+](=O)[O-])s3)[nH]c(=O)c2cc1OC 165057720 NKHBTSRNRNOIGU-UHFFFAOYSA-N 333.325 2.577 5 50 EFBA CCOc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c([N+](=O)[O-])c1 4894102 YXRPEKKZQFSYDN-VXGBXAGGSA-N 334.328 2.599 5 50 EFBA O=C(N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O)OCc1ccccc1 5059663 UORCURAKJUSAHL-OAHLLOKOSA-N 344.323 2.517 5 50 EFBA in-vitro O=[N+]([O-])c1cnc(NC[C@@H]2CCC=CO2)nc1NC[C@H]1CCC=CO1 849478415 SSGOXUVYDUJQSR-OLZOCXBDSA-N 347.375 2.594 5 50 EFBA COC(=O)c1cc(C(=O)Nc2ccc(F)cc2F)cc([N+](=O)[O-])c1 60863 ZQUMHXCPDBKJCN-UHFFFAOYSA-N 336.250 2.912 5 50 EFBA COc1ccc(COc2cc([N+](=O)[O-])c(C(=O)O)cc2OC)cc1 215768562 HIVYTFMZOHFGAN-UHFFFAOYSA-N 333.296 2.889 5 50 EFBA O=[N+]([O-])c1cccc2c1CCN(c1nc3sccn3c1[N+](=O)[O-])C2 225513829 MROGHWCBYHPLOF-UHFFFAOYSA-N 345.340 2.775 5 50 EFBA O=C(c1ccccc1)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4818918 ZEKFGAJUUSTKTF-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-] 4913307 NKQQPQURILVHAS-ZWNOBZJWSA-N 332.356 2.814 5 50 EFBA CCOC[C@@H]1CCN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C1 408522415 IOXIHQMSAIRLQI-SNVBAGLBSA-N 328.315 2.680 5 50 EFBA CN(C)c1cc(C(=O)Nc2cccc3c2CCOC3)ccc1[N+](=O)[O-] 2325783504 BSWYFCLOMGDXJK-UHFFFAOYSA-N 341.367 2.986 5 50 EFBA CC(=O)N1C(=O)NC(c2ccccc2)=C([N+](=O)[O-])[C@@H]1c1ccccc1 2813039 RWXFGGZHHUWHQS-INIZCTEOSA-N 337.335 2.945 5 50 EFBA O=C1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2N1 4838748 QICDZOPAJFGEMJ-UHFFFAOYSA-N 331.715 2.847 5 50 EFBA C[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H]1CO 190239382 PHDNBKBHIUSECT-PRHODGIISA-N 347.293 2.848 5 50 EFBA CCS(=O)(=O)Nc1ccc(NCc2ccccc2[N+](=O)[O-])cc1 119844180 HHHXEPXUVRIZOS-UHFFFAOYSA-N 335.385 2.969 5 50 EFBA Cc1cccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 19235022 NHAVQFNGISNHCF-UHFFFAOYSA-N 339.395 2.861 5 50 EFBA COc1ccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 282946 FIUSSTGULPMUBH-UHFFFAOYSA-N 345.307 2.652 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCc2ccccc2C1 4993717 CEYBNMWRWWSSHA-UHFFFAOYSA-N 332.381 2.650 5 50 EFBA O=C(CCC(=O)c1ccccc1)OCC(=O)c1ccc([N+](=O)[O-])cc1 2078533 JGYDOKPVPQUBAA-UHFFFAOYSA-N 341.319 2.984 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 248662584 HCGQVYVRPQXARF-ZFWWWQNUSA-N 333.436 2.573 5 50 EFBA Cc1nn(CCCC(=O)Nc2ccc3c(c2)OCO3)c(C)c1[N+](=O)[O-] 1429862 ICSIGLOKKVQLTG-UHFFFAOYSA-N 346.343 2.556 5 50 EFBA CCCCOC(=O)c1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 2091463 MRXLJQHAWJCFAS-UHFFFAOYSA-N 346.343 2.538 5 50 EFBA Cc1ccc(OCCCN2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1 2868394 QDFYBPGYOIZGII-UHFFFAOYSA-N 340.335 2.968 5 50 EFBA O=c1c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2sc2nc3ccccc3n12 8737743 HPNVZYODXIGFIO-UHFFFAOYSA-N 342.292 2.879 5 50 EFBA O=c1c([N+](=O)[O-])c(N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@@H]23)nc2ccccn12 252457326 ZCBJXWWIUXMSLT-PEBLQZBPSA-N 340.383 2.839 5 50 EFBA COc1ccc(NC(=O)CCCn2nc([N+](=O)[O-])cc2C)c(OC)c1 2890127 GRLMMKRATMWGGO-UHFFFAOYSA-N 348.359 2.536 5 50 EFBA O=C1c2cccc3c([N+](=O)[O-])ccc(c23)C(=O)N1Cc1cccnc1 4347900 OLWCCEKHQIYEHU-UHFFFAOYSA-N 333.303 2.939 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1O)c1ccc(Br)o1 5065654 VWPYJWLIQWALPA-UHFFFAOYSA-N 327.090 2.908 5 50 EFBA CN(C)C1CCN(c2ccc([N+](=O)[O-])c(Br)c2)CC1 169725349 ZRTZLKTZJHZMOR-UHFFFAOYSA-N 328.210 2.888 5 50 EFBA O=C(c1ccc(SCc2ccoc2)c([N+](=O)[O-])c1)N1CCOCC1 33548 WEWPNKYCKQPVRS-UHFFFAOYSA-N 348.380 2.953 5 50 EFBA CCO[C@H]1C[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C12CCC2 183598815 FNLBUBPYIXMQND-KBPBESRZSA-N 334.376 2.801 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19773584 OZCAUFRCMBUQFV-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA O=C1CCCC[C@H]1[C@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] 170657203 IMHIMCXVBUVGCO-DZGCQCFKSA-N 345.399 2.757 5 50 EFBA O=[N+]([O-])c1cccc(Br)c1I 34413940 BJOZUBWLKNXFFK-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA CC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 2068919 XUWVSYOTORTBCK-UHFFFAOYSA-N 344.283 2.714 5 50 EFBA COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 247826975 JSXIRLUEQBULMC-CFVMTHIKSA-N 332.356 2.541 5 50 EFBA O=[N+]([O-])c1ccc(-c2cc[nH]n2)cc1CS(=O)(=O)c1ccccc1 1388724 INSWQIAJPZTKJK-UHFFFAOYSA-N 343.364 2.959 5 50 EFBA N[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 191369979 FFJRCNVQFJXMOV-CYBMUJFWSA-N 341.367 2.950 5 50 EFBA CN1CCN([C@@]23CCCCC2=Cc2cc([N+](=O)[O-])ccc2O3)CC1 80831 QBUOZFOFFOMNGB-GOSISDBHSA-N 329.400 2.888 5 50 EFBA O=[N+]([O-])c1ccc(C2=Nn3nnc(C(F)(F)F)c3SC2)cc1 5894630 RRIBNTYOFJWELP-UHFFFAOYSA-N 329.263 2.563 5 50 EFBA C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1nncn1C 170606512 CNKJIYBLMKNIFH-QMMMGPOBSA-N 327.291 2.540 5 50 EFBA CC1CCN(C[C@@H](O)CNc2nccc3ccc([N+](=O)[O-])cc23)CC1 413145324 ZQEDBDWCLSFQLD-INIZCTEOSA-N 344.415 2.648 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NC2C3CC4CC(C3)CC2C4)c1 5093513 NBEBFVNYQVTNPR-UHFFFAOYSA-N 336.413 2.698 5 50 EFBA COc1cc2c(cc1O)C[C@H]1c3cc(O)c(OC)cc3CC[N@@+]1(C)C2 238809383 RBBVPNQTBKHOEQ-KKSFZXQISA-O 342.415 2.915 5 50 EFBA biogenic,in-vitro O=C(NCCCn1ccnc1)c1cc2c(ccc3ccccc32)oc1=O 13786003 UZQFEXMSXZTSIS-UHFFFAOYSA-N 347.374 2.963 5 50 EFBA C[C@H]1C(c2ccc(F)cc2)=[N+]([O-])[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1O 2993373 JSTIHOYGIPKDHH-GTNSWQLSSA-N 345.330 3.000 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)c([N+](=O)[O-])cc1C 239339051 LQCHEPDDRNPJCI-LFCXMHMLSA-N 338.363 2.769 5 50 EFBA CCC12CN3CC(CC)(CN(C1)C3c1ccc([N+](=O)[O-])cc1)C2=O 19318796 YKNMTIQUNZJHJK-UHFFFAOYSA-N 329.400 2.600 5 50 EFBA biogenic COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1cc([N+](=O)[O-])ccc1OC 249718191 KIHKOIDFHINCFU-MAZHCROVSA-N 348.399 2.910 5 50 EFBA CN(C)c1ccccc1CN(C)c1ccc([N+](=O)[O-])c2nonc12 808135979 YZKDLNQQCYVYRZ-UHFFFAOYSA-N 327.344 2.833 5 50 EFBA COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC 4814481 LFDOKHFRMCIIAP-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=C(CSc1nc(-c2ccco2)n[nH]1)c1cccc([N+](=O)[O-])c1 6084449 UZECJJMBCVKZRZ-UHFFFAOYSA-N 330.325 2.948 5 50 EFBA CC(C)c1noc([C@@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 229718875 MQWSFTZAAFHTRR-VXGBXAGGSA-N 346.391 2.744 5 50 EFBA COc1ccc(NC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] 296904449 SCXUJMZHMPNDOJ-DOTOQJQBSA-N 347.371 2.779 5 50 EFBA COC[C@@H](C)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 170603115 NFUZWLBWNBYSKM-AWEZNQCLSA-N 344.415 2.548 5 50 EFBA O=[N+]([O-])c1cc2c(cc1CN1CCC(N3CCCCC3)CC1)OCO2 212351 MJHLWSCEZYHYJA-UHFFFAOYSA-N 347.415 2.774 5 50 EFBA CCOC(=O)[C@@H](Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 301452 VSYDVQZDAMATBR-INIZCTEOSA-N 342.351 2.955 5 50 EFBA O=[N+]([O-])c1ccc(NC(=S)NCc2ccc3c(c2)OCO3)cc1 3904847 SOIBHBRVWFIHKC-UHFFFAOYSA-N 331.353 2.810 5 50 EFBA Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2C)cs1 17070711 JIWQKJPOVNYRRE-UHFFFAOYSA-N 336.402 2.707 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19773889 HKTIKOZEGRRAPX-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA Cc1sc(NC(=O)c2cccc([N+](=O)[O-])c2C)c(C(N)=O)c1C 433793 GGYPXIDKDQEXEL-UHFFFAOYSA-N 333.369 2.933 5 50 EFBA COc1cc(C(=O)NCCc2ccc(F)cc2)c([N+](=O)[O-])cc1OC 2989927 GXOYILHSHHQQMD-UHFFFAOYSA-N 348.330 2.724 5 50 EFBA C[C@H](CCc1ccccc1)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 4696269 UHQYOFPFBLMFQV-CYBMUJFWSA-N 334.397 2.894 5 50 EFBA O=c1c2ccccc2c(=O)c2cc3c(=O)c4ccccc4c(=O)c3cc12 401340 YZOGOBWHTVNKGA-UHFFFAOYSA-N 338.318 2.616 5 50 EFBA biogenic,in-vitro CC(=O)c1ccc(Sc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1 337912 PDGFQSQBTILYNQ-UHFFFAOYSA-N 341.352 2.924 5 50 EFBA C[C@@H]1C(c2ccc(F)cc2)=[N+]([O-])[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1O 4819944 JSTIHOYGIPKDHH-DIFFPNOSSA-N 345.330 3.000 5 50 EFBA Cc1c(NC(=O)[C@@H](C)N2CCC[C@@H](CCO)CC2)cccc1[N+](=O)[O-] 421013890 JPIOGORMABHHPH-HUUCEWRRSA-N 349.431 2.715 5 50 EFBA CC1(C)[C@@H](c2ccccc2)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1 421723158 SLPFEEXBBLBQQE-MRXNPFEDSA-N 342.399 2.976 5 50 EFBA C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(C(C)(C)C)cc1 374859 NUUSDAHBZWJPKI-LBPRGKRZSA-N 330.388 2.966 5 50 EFBA Cc1nn(C)c(C)c1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl 2102805 DQCBQAIJIXRGNE-UHFFFAOYSA-N 336.779 2.871 5 50 EFBA CCOP(=O)(OCC)[C@@H](OC(N)=O)c1cccc([N+](=O)[O-])c1 3185552 ROOJJQYMRGMFNE-LLVKDONJSA-N 332.249 2.955 5 50 EFBA Cn1cccc1[C@H]1COCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 131946977 DHRRDNCZBOULSQ-OAHLLOKOSA-N 342.355 2.648 5 50 EFBA COc1cc(C(=O)N2CCc3ccccc3C2)c([N+](=O)[O-])cc1OC 4121072 IVXOTFOUZXTEPL-UHFFFAOYSA-N 342.351 2.811 5 50 EFBA Cc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-] 102046 NTOPHDBXYBJYBL-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA O=[N+]([O-])c1ccc(N[C@H]2C[C@H](Cn3cncn3)C2)cc1OC(F)F 1776005580 KNEFYQMMMSQQBU-HOMQSWHASA-N 339.302 2.678 5 50 EFBA Cc1cc(C(=O)N2Cc3cnnn3Cc3ccccc32)ccc1[N+](=O)[O-] 189301310 PCAJDOXNBCKCBX-UHFFFAOYSA-N 349.350 2.703 5 50 EFBA O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1F)c1cccs1 451147 FIUOKLITHLDSRS-UHFFFAOYSA-N 325.346 2.922 5 50 EFBA CC(C)[N@@+]1(C)[C@H]2CC[C@@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2 250576043 OEXHQOGQTVQTAT-TWHPPBISSA-N 332.464 2.854 5 50 EFBA O=C(NCc1noc(-c2ccccc2F)n1)c1ccc([N+](=O)[O-])s1 225735356 FLLGMRFNUMLXFG-UHFFFAOYSA-N 348.315 2.775 5 50 EFBA COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 5103137 RJUYLOXWGHCTOT-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA CCCCN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 13322655 AKVDESAGIUWGPD-UHFFFAOYSA-N 336.392 2.553 5 50 EFBA O=C(NCc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCO2)CC1 187352358 RHINOMGOCAZPBS-MRXNPFEDSA-N 333.388 2.695 5 50 EFBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2CC=C(Cl)C[C@H]2C1=O 100634210 QMBQBFXCJNMJBG-WDEREUQCSA-N 336.731 2.626 5 50 EFBA O=C(O)c1cc([N+](=O)[O-])c(I)cc1Cl 306827749 DUERERZUFGVEDU-UHFFFAOYSA-N 327.461 2.551 5 50 EFBA Cc1c([N+](=O)[O-])c(C(=O)N(C)C23CC4CC(CC(C4)C2)C3)nn1C 4652469 FFVNPECVPCBBED-UHFFFAOYSA-N 332.404 2.678 5 50 EFBA Cc1ccc(N2CCOCC2)cc1NC(=O)c1cccc([N+](=O)[O-])c1 280748617 BKCGOXVKKXBLSG-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA Cc1ccccc1NC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 60144 DPVQKIKQURLBTJ-CYBMUJFWSA-N 339.351 2.895 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)Cc1ccccc1 4091063 LPFCRXRZOCKWIK-UHFFFAOYSA-N 345.380 2.659 5 50 EFBA CC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C(=O)O)cc1 4955091 JNNLQFCXBDUTIM-UHFFFAOYSA-N 328.280 2.748 5 50 EFBA Cc1cccc(-n2nc([N+](=O)[O-])c(NC3CCCCCC3)[n+]2[O-])c1 4807180 SLVMWCLIFHBNQN-UHFFFAOYSA-N 331.376 2.857 5 50 EFBA CCOc1cc(NC(=O)N[C@@H](C)c2nnc(C)o2)ccc1[N+](=O)[O-] 1466990132 FYOAMMMJUKTFGS-QMMMGPOBSA-N 335.320 2.568 5 50 EFBA CCc1n[nH]c(SCC(=O)Nc2c(C)cc(C)cc2[N+](=O)[O-])n1 4697989 SYPPPUUQFOCOHL-UHFFFAOYSA-N 335.389 2.623 5 50 EFBA O=C(Nc1ccccc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4895926 UZHHJHKPXOARHW-UHFFFAOYSA-N 327.340 2.684 5 50 EFBA CO[C@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(F)cc1 119107151 ZGXGRHIJLQDSOP-OAHLLOKOSA-N 334.303 2.557 5 50 EFBA CCc1[nH]nc(C(=O)N2CCN(C3CC3)c3ccccc32)c1[N+](=O)[O-] 192910187 QEJFNRBAFQXPLR-UHFFFAOYSA-N 341.371 2.510 5 50 EFBA CN(Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCC[C@H]1S(C)(=O)=O 252477555 QRYLBLWWMJQUPP-LSDHHAIUSA-N 344.408 2.522 5 50 EFBA COc1cccc(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)c1[N+](=O)[O-] 194543710 BMBJKUFVBLYGAM-KBPBESRZSA-N 344.371 2.714 5 50 EFBA O=[N+]([O-])c1cnc(NC[C@@H]2CCC=CO2)nc1NC[C@@H]1CCC=CO1 849478420 SSGOXUVYDUJQSR-STQMWFEESA-N 347.375 2.594 5 50 EFBA Cc1nc(N2[C@H]3CC[C@H]2[C@@H](C(=O)OC(C)(C)C)C3)ccc1[N+](=O)[O-] 408523969 WPFGNSZOVMDWMQ-OBJOEFQTSA-N 333.388 2.997 5 50 EFBA CCc1cccc2c(/C=C/c3nc(O)[nH]c(=O)c3[N+](=O)[O-])c[nH]c12 4501611 HQSRLFVKJNTBJF-VOTSOKGWSA-N 326.312 2.598 5 50 EFBA CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCCN2CC)c1 253392777 GHAOYIKVSHIVMY-ZDUSSCGKSA-N 335.404 2.598 5 50 EFBA CCc1[nH]nc(C(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)c1[N+](=O)[O-] 172377469 SNMQQFOVVIMGDM-GFCCVEGCSA-N 346.362 2.724 5 50 EFBA CC(C)c1noc([C@H](C)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 229718887 MQWSFTZAAFHTRR-NWDGAFQWSA-N 346.391 2.744 5 50 EFBA CC(=O)Nc1ccc(NC(=O)C(Cl)(Cl)Cl)cc1[N+](=O)[O-] 5226641 DFGLJSJXZSNGQY-UHFFFAOYSA-N 340.550 2.862 5 50 EFBA CN(C)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 453450 YUCIPHFORZGFSZ-UHFFFAOYSA-N 344.396 2.788 5 50 EFBA O=C1CS[C@@H](c2cccc([N+](=O)[O-])c2)N1CCN1CCCCC1 208069 PTTQZFIDRHTRRS-INIZCTEOSA-N 335.429 2.655 5 50 EFBA COC(=O)[C@H](CC(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 318305 QXISUMISAREUBS-LBPRGKRZSA-N 328.752 2.566 5 50 EFBA O=[N+]([O-])c1ccc(NCCCN2CCCOCC2)cc1OC(F)F 1776005471 JHVMJCVLPSTPIK-UHFFFAOYSA-N 345.346 2.721 5 50 EFBA O=C(O)c1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)cc1O 1775970985 BSLJVUBILBCLEP-UHFFFAOYSA-N 336.687 2.904 5 50 EFBA NC(=O)c1c(NC(=O)c2ccccc2[N+](=O)[O-])sc2c1CCCC2 38742 YVFSXNWSBGMSSC-UHFFFAOYSA-N 345.380 2.886 5 50 EFBA Cc1c(C(=O)Nc2ccccc2N2CCOCC2)cccc1[N+](=O)[O-] 473977 ZTNUFMOKDZCBMT-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA C[C@@H]1CCC[C@@H](Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])[C@@H]1C 4813539 PPJJRKILMNEUBW-YRGRVCCFSA-N 331.376 2.651 5 50 EFBA O=[N+]([O-])c1cccc(-c2nc(-c3cn([C@@H]4CC[C@H]4O)nn3)cs2)c1 1875280772 RNUUYOOLTSRBCX-ZIAGYGMSSA-N 343.368 2.673 5 50 EFBA COC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 860089 KYKGTQIIJZQMRD-NSHDSACASA-N 328.752 2.566 5 50 EFBA C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 162746904 YHTDEVPYVZYELN-NOZJJQNGSA-N 336.369 2.604 5 50 EFBA O=C(O)c1cc([N+](=O)[O-])ccc1-c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 95832041 CXLUUVAWZDNHRL-UHFFFAOYSA-N 333.212 2.776 5 50 EFBA CNC(=O)c1ccc(CN(C)c2c([N+](=O)[O-])ccc3c2CCN3)cc1 170601975 WCCSTDAUPXZFEN-UHFFFAOYSA-N 340.383 2.559 5 50 EFBA O=C1C[C@H](c2ccccc2[N+](=O)[O-])c2cc3c(cc2N1)OCCO3 427586 NOYDAFUULYHBIU-LLVKDONJSA-N 326.308 2.840 5 50 EFBA CN1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)nc3ccccc23)CC1 318493 ATMSDVKAEIDKQO-UHFFFAOYSA-N 349.394 2.957 5 50 EFBA CN1CC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 252477186 JUMDISCTDFHLDB-NVXWUHKLSA-N 343.358 2.909 5 50 EFBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCS[C@H]2CCCC[C@H]21 176235543 QNBIZEJMWPGFRW-KGLIPLIRSA-N 346.412 2.971 5 50 EFBA Cc1nn(CC(=O)NCC23CC4CC(CC(C4)C2)C3)c(C)c1[N+](=O)[O-] 4127023 NYKVLEODDYTYNZ-UHFFFAOYSA-N 346.431 2.741 5 50 EFBA O=C(CSCC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 5060189 WKWSBFODQQIPRQ-UHFFFAOYSA-N 345.380 2.905 5 50 EFBA Cc1ccc(NC(=O)c2c(Br)cnn2C)c([N+](=O)[O-])c1 4646362 DRARFXBBCFCVPZ-UHFFFAOYSA-N 339.149 2.652 5 50 EFBA O=C(Nc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)N1CCOCC1 20310924 FYESXUXYWYVZPM-QGZVFWFLSA-N 341.367 2.607 5 50 EFBA Cc1nn(C)c(Sc2nnc(C(F)(F)F)s2)c1[N+](=O)[O-] 275494046 KRSOBGABLVGERC-UHFFFAOYSA-N 325.297 2.658 5 50 EFBA O=C1c2ccccc2C(=O)N1CNc1ccc(Cl)cc1[N+](=O)[O-] 4566499 LQPHQGHPVQYLEK-UHFFFAOYSA-N 331.715 2.914 5 50 EFBA biogenic O=C(c1ccccc1[N+](=O)[O-])N1CCN(Cc2ccccc2)CC1 19878852 PQVHVXSWOVGJFL-UHFFFAOYSA-N 325.368 2.553 5 50 EFBA CCOC(=O)C(C[C@@H]1CCC[N@@+]2(C)CCCC[C@H]12)C(=O)OCC 252441297 NONZADLMFDYBRU-ZSZQSSIHSA-N 326.457 2.528 5 50 EFBA biogenic CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC12CCCCC2 270780998 JMYYAKRJIQHKDZ-UHFFFAOYSA-N 332.404 2.670 5 50 EFBA Cn1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C(F)(F)F)c1 170088103 NZFVGFRBVFQSNR-LBPRGKRZSA-N 342.277 2.549 5 50 EFBA COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 36543 KDOHTODTTGVPNS-UHFFFAOYSA-N 330.340 2.585 5 50 EFBA O=[N+]([O-])c1ccc(CN2CCN(C[C@@H]3C[C@H]4C=C[C@H]3C4)CC2)cc1 100709513 XGWPXXNQWMMZDI-BZSNNMDCSA-N 327.428 2.925 5 50 EFBA O=[N+]([O-])c1cccc(C2=C[C@@H](c3ccccc3F)n3nnnc3N2)c1 100851429 RBKNCSKCRKYQDS-HNNXBMFYSA-N 338.302 2.776 5 50 EFBA CC(=O)Oc1cc(O)cc(O)c1C(=O)CCc1ccc([N+](=O)[O-])cc1 3122440 PUAVLYKEJPNJQE-UHFFFAOYSA-N 345.307 2.747 5 50 EFBA O=C(c1cccc([N+](=O)[O-])c1)N1CCN(Cc2ccccc2)CC1 19314242 ASFGNNUHCFDVOM-UHFFFAOYSA-N 325.368 2.553 5 50 EFBA Cc1ccc(-n2c(CCn3ccc([N+](=O)[O-])n3)n[nH]c2=S)c(C)c1 6626959 RFBFRGWAMHCGAO-UHFFFAOYSA-N 344.400 2.894 5 50 EFBA C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ncc([N+](=O)[O-])s1 240471601 GDAKYCAPBVNTTP-WCQYABFASA-N 333.417 2.769 5 50 EFBA CC1=NN(C(=O)c2ccccc2[N+](=O)[O-])[C@@](O)(c2ccccc2)C1 283762 TZHJTSJNUSGKKA-KRWDZBQOSA-N 325.324 2.662 5 50 EFBA C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCOC1 247147650 UCNIGMZVYJKQCS-NWDGAFQWSA-N 332.360 2.674 5 50 EFBA CC1(C)[C@H]([N+](=O)[O-])[C@H](c2ccco2)N[C@H](c2ccco2)[C@@H]1[N+](=O)[O-] 36038150 WKSGTJWBIMDLLN-LVEBTZEWSA-N 335.316 2.575 5 50 EFBA COc1ccc2c(c1)C[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1)CO2 123951846 DAGIPZKLKADIMU-CQSZACIVSA-N 343.335 2.898 5 50 EFBA COc1ccc(NC(=O)CNC2[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])c1 182953280 RURJHTQSFLLRPA-RYUDHWBXSA-N 335.404 2.956 5 50 EFBA Nc1ccc([N+](=O)[O-])c(N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)c1 193527099 RYTPJXRGNLZBPD-AWEZNQCLSA-N 344.346 2.529 5 50 EFBA O=c1oc2ccccc2c2ccnc(NCCNc3ncccn3)c12 1776111843 SKJCBAVANXCJFR-UHFFFAOYSA-N 333.351 2.655 5 50 EFBA Cc1ccc(N2C[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)cc1 4402362 WTALWZCRMRDCSK-ZDUSSCGKSA-N 339.351 2.895 5 50 EFBA COCCOC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 1891372 GSVPIJFRBHOZIW-UHFFFAOYSA-N 344.323 2.650 5 50 EFBA COc1ccc(NC(=O)c2ccc(NCCCN)c([N+](=O)[O-])c2)cc1 5050537 YWYZRJVUKFEQCT-UHFFFAOYSA-N 344.371 2.616 5 50 EFBA COc1ccccc1C(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1F 309491 PEFGUOQTUCEOQW-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA COC(=O)c1cc(C)sc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 1055326 AFXPVRCOPUWLDV-UHFFFAOYSA-N 334.353 2.933 5 50 EFBA COc1c(NC(=O)Cc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 4776853 NEABEZVYKBOICW-UHFFFAOYSA-N 331.284 2.693 5 50 EFBA CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 8729816 YOLVWCABLVHASL-UHFFFAOYSA-N 325.340 2.791 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc2c(c1)OCO2 5041663 LFWJDXOPGSFUEJ-UHFFFAOYSA-N 345.311 2.654 5 50 EFBA O=C(Cn1cc([N+](=O)[O-])cn1)NCCC12CC3CC(CC(C3)C1)C2 4784710 ZXLQRASZQKAKEE-UHFFFAOYSA-N 332.404 2.514 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 101237966 FAPKDRKTVSYZEC-QRTARXTBSA-N 329.400 2.541 5 50 EFBA Cc1nn(Cc2ccc(C(=O)NCc3ccco3)o2)c(C)c1[N+](=O)[O-] 2782397 LNQYKUQYBGHZQA-UHFFFAOYSA-N 344.327 2.572 5 50 EFBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2F)C1 164497567 YRRLBEPZYWCOKJ-MRXNPFEDSA-N 346.314 2.653 5 50 EFBA O=[N+]([O-])c1ccc(CCN2CCC(CNC3CCOCC3)CC2)cc1 952992892 DKLMIGABPQWLOY-UHFFFAOYSA-N 347.459 2.618 5 50 EFBA O=C1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2N1 289494 ALAKZKZUSKGPRO-UHFFFAOYSA-N 331.715 2.847 5 50 EFBA COc1cc([N+](=O)[O-])c(OC)cc1CCNCc1ccccc1OC 96032841 TXCKTIBHURMASQ-UHFFFAOYSA-N 346.383 2.953 5 50 EFBA in-vitro C[C@@H](OC[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 185453468 WPWFAQRLSSKAQX-VXGBXAGGSA-N 345.355 2.666 5 50 EFBA CCc1c(C)sc(NC(=O)c2ccccc2[N+](=O)[O-])c1C(N)=O 433769 KTPYJHGRGUTOKZ-UHFFFAOYSA-N 333.369 2.878 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c([N+](=O)[O-])cc1C 101376678 ZNHRNLLNDSREKT-BHTHQVBYSA-N 338.363 2.913 5 50 EFBA CC[C@@](C)(NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)O 262461454 QUTOJCAVWNAVPT-OAHLLOKOSA-N 349.368 2.701 5 50 EFBA C[S@@](=O)(=NC(=O)c1ccc(N)cc1[N+](=O)[O-])c1ccc(F)cc1 2325874572 RXEZVMWVUKTKHM-QHCPKHFHSA-N 337.332 2.613 5 50 EFBA Cc1cc(C(=O)Nc2sc(C)c(C)c2C(N)=O)ccc1[N+](=O)[O-] 375563 ZATYRWZSGVMAIN-UHFFFAOYSA-N 333.369 2.933 5 50 EFBA COc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1F 188571355 LFKKICDIILBWLC-UHFFFAOYSA-N 326.305 2.543 5 50 EFBA COc1cccc(C(=O)NC(=S)Nc2cccc([N+](=O)[O-])c2)c1 454929 NDDCIKHUBMDUTA-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 1180180 XAQFWUKALHQJBC-LLVKDONJSA-N 328.324 2.857 5 50 EFBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 54771843 DNDFSKCFBSQJKN-UHFFFAOYSA-N 341.367 2.646 5 50 EFBA CN1CCc2ccc(NS(=O)(=O)Cc3cccc([N+](=O)[O-])c3)cc21 194673914 OJJQRCBFSAJVHV-UHFFFAOYSA-N 347.396 2.529 5 50 EFBA COc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 83628 BTSWBJKSKBKROS-UHFFFAOYSA-N 341.367 2.566 5 50 EFBA COc1cc(C(=O)N(C)Cc2ccc(C(=O)O)cc2)ccc1[N+](=O)[O-] 328350622 YAHLZKJGSYXAAW-UHFFFAOYSA-N 344.323 2.574 5 50 EFBA O=[N+]([O-])c1ccc2oc(CN3CC[C@@]4(O)CCCC[C@@H]4C3)nc2c1 160719639 AGBPJQPSEHASLP-PXAZEXFGSA-N 331.372 2.863 5 50 EFBA CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 1403357 MATFYDNPOIZRQL-SNVBAGLBSA-N 338.747 2.689 5 50 EFBA CCCC1=C(C(=O)OCC)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 36240 PMCGKMXYGYODTJ-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA COC(=O)c1cc(C(=O)Nc2cc(C)ccc2OC)cc([N+](=O)[O-])c1 303886 URTDOAAVXSYQJV-UHFFFAOYSA-N 344.323 2.951 5 50 EFBA Cc1c(C(=O)Nc2ccc(N3CCOCC3)cc2)cccc1[N+](=O)[O-] 172715 UMZKXPQNUGEURQ-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA O=C(Cn1cnc2ccc(Cl)cc2c1=O)c1cccc([N+](=O)[O-])c1 3121737 QGBJSHMEAPGTQG-UHFFFAOYSA-N 343.726 2.841 5 50 EFBA Cc1ccc(C(=O)N2CCC(c3cnccn3)CC2)cc1[N+](=O)[O-] 170605884 KDYLFEYJLLDZCU-UHFFFAOYSA-N 326.356 2.713 5 50 EFBA O=C(O)[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccccc2[N+](=O)[O-])N1 33181 ZKQJJSPFSANANO-ZBFHGGJFSA-N 337.335 2.764 5 50 EFBA biogenic Cc1cccc2sc(NC(=O)[C@H](C)Cn3cc([N+](=O)[O-])cn3)nc12 2794319 OWBZSJJGTBUEGF-SNVBAGLBSA-N 345.384 2.984 5 50 EFBA O=C(OC[C@H]1O[C@H]1COCc1ccccc1)c1ccc([N+](=O)[O-])cc1 4521209 XBAOYRZETQXAAE-DLBZAZTESA-N 343.335 2.736 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N[C@@H]1C=C[C@H](CO)C1 160250052 MKTLSYIXTAUHDT-DTWKUNHWSA-N 345.277 2.672 5 50 EFBA O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCOCCN1 809339553 YYODSXCYULDYRR-UHFFFAOYSA-N 325.674 2.608 5 50 EFBA CC(=O)Nc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 183523 ULBIXIKPJPBQLO-UHFFFAOYSA-N 349.368 2.662 5 50 EFBA O=[N+]([O-])c1ccc(N2CCC(c3nn[nH]n3)CC2)cc1C(F)(F)F 864234393 UPTQVWLTBVJWJF-UHFFFAOYSA-N 342.281 2.511 5 50 EFBA O=C(COC(=O)c1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 233173 HJKNBIXPLHRGJD-UHFFFAOYSA-N 335.699 2.994 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(F)cc1 3878217 AOBNVMGREXGLPU-UHFFFAOYSA-N 326.305 2.543 5 50 EFBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccn[nH]2)C1 249375899 KGNNVVHYVFLQJW-QWHCGFSZSA-N 343.387 2.525 5 50 EFBA O=C(Cc1cccc([N+](=O)[O-])c1)Nc1sccc1C(=O)NC1CC1 172891791 LXHFGIFVBRPTCC-UHFFFAOYSA-N 345.380 2.730 5 50 EFBA Nc1ccc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] 158527655 BNVCJUDCMGXASV-PBHICJAKSA-N 341.367 2.827 5 50 EFBA O=C(CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Br 4991295 RLYLNZJHVCZURH-UHFFFAOYSA-N 342.193 2.782 5 50 EFBA O=C(N[C@H]1CC[C@H](c2nccc(O)n2)CC1)c1cccc([N+](=O)[O-])c1 1456936576 NUSXPIQYGMOONY-AULYBMBSSA-N 342.355 2.547 5 50 EFBA Cc1ccc(C(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1 4754552 BCIQMVUVOUJOAB-UHFFFAOYSA-N 339.395 2.886 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1cccc(Cl)c1 4105265 VTRMSXVBJYHDKL-UHFFFAOYSA-N 326.761 2.727 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1CC(Cl)(Cl)C1 1464678604 AVXGLUCKUBEMAR-UHFFFAOYSA-N 339.200 2.518 5 50 EFBA CCCCOc1ccc(S(=O)(=O)n2c([N+](=O)[O-])cnc2C)cc1 5690403 YFBNTAGPEJAGDY-UHFFFAOYSA-N 339.373 2.516 5 50 EFBA COC(=O)c1c(C)nc(C)c(C(=O)OC)c1-c1cccc([N+](=O)[O-])c1 1063836 WLSSRGYMMSQMGL-UHFFFAOYSA-N 344.323 2.847 5 50 EFBA COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1cc([N+](=O)[O-])ccc1OC 249718192 KIHKOIDFHINCFU-WQVCFCJDSA-N 348.399 2.910 5 50 EFBA Cc1cccc([C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)n1 188422767 OZSVKEUOXYYMDM-MRXNPFEDSA-N 326.356 2.858 5 50 EFBA COc1cccc2cc(C(=O)Nc3cccc([N+](=O)[O-])c3)c(=O)oc12 105712 DMUZUAWYSRIRSZ-UHFFFAOYSA-N 340.291 2.962 5 50 EFBA CC(=O)Nc1ccccc1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 62314 JSDXUUZVWUFPGP-UHFFFAOYSA-N 342.307 2.593 5 50 EFBA O=C(O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)c1ccc(Cl)cc1 4619260 POZJUSGJNFFZFM-UHFFFAOYSA-N 341.728 2.779 5 50 EFBA NCCNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(Cl)c1 4755232 VOABIJZPBBJWSU-UHFFFAOYSA-N 334.763 2.871 5 50 EFBA C[C@H](CNc1ccc([N+](=O)[O-])c2ncccc12)CN1CCOCC1 413153770 LXSRPVQLASJZJA-CYBMUJFWSA-N 330.388 2.523 5 50 EFBA COC(=O)c1cc(C)sc1NC(=O)Cc1ccccc1[N+](=O)[O-] 1009094 MRYIKSWEXKXSLZ-UHFFFAOYSA-N 334.353 2.933 5 50 EFBA Cc1cccc2sc(NC(=O)[C@@H](C)Cn3cc([N+](=O)[O-])cn3)nc12 2794318 OWBZSJJGTBUEGF-JTQLQIEISA-N 345.384 2.984 5 50 EFBA Cc1ccc(C)c(S(=O)(=O)N(C)c2ccc(O)cc2)c1[N+](=O)[O-] 194207419 FHEOUNFYZNOGME-UHFFFAOYSA-N 336.369 2.742 5 50 EFBA CCc1c(C)sc(NC(=O)c2cccc([N+](=O)[O-])c2)c1C(N)=O 311645 OYEAZBBEDJMGQN-UHFFFAOYSA-N 333.369 2.878 5 50 EFBA Cc1c([N+](=O)[O-])cc(NC(=O)c2ccn(C(F)F)n2)cc1[N+](=O)[O-] 2795545 WDZXBPSUALCIQA-UHFFFAOYSA-N 341.230 2.655 5 50 EFBA CNc1nc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cs1 176734589 ZDPXLBMDSPNUJU-UHFFFAOYSA-N 333.373 2.590 5 50 EFBA CCCCNC(=O)NC(=O)c1c(Cl)nc(Cl)c([N+](=O)[O-])c1C 2054176 BHWTWGCCIOJFIV-UHFFFAOYSA-N 349.174 2.845 5 50 EFBA COc1ccc(CC(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 4676538 UMNJAOAQKCBZDM-UHFFFAOYSA-N 345.380 2.659 5 50 EFBA CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cnn(C)c1 151480607 BKGXFRUXXANDQP-UHFFFAOYSA-N 328.250 2.624 5 50 EFBA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 239433625 YEPKVCZGNVXKKG-AJABAVSMSA-N 344.754 2.806 5 50 EFBA O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3ncc(Cl)cc3F)C2)nc1 170686943 YVTYURKZQLRHRY-SNVBAGLBSA-N 337.742 2.868 5 50 EFBA O=C(Nc1cnccc1CO)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 305831149 OOTKCQHPGQAASS-UHFFFAOYSA-N 341.245 2.753 5 50 EFBA O=[N+]([O-])c1cn(CCOc2cc(F)cc(Br)c2)cn1 188176437 AVOBZCRIHXLGFV-UHFFFAOYSA-N 330.113 2.772 5 50 EFBA O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2Nc1ccccc1Cl 4414335 VKWASNISQCZKDC-UHFFFAOYSA-N 337.744 2.809 5 50 EFBA CCOC(=O)[C@H]1[C@H]2C=C[C@@H](c3cccc([N+](=O)[O-])c32)[C@H]1C(=O)OCC 216290320 MTKCNYRBENZGCV-RKLWJJNISA-N 345.351 2.704 5 50 EFBA CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)Oc2ncccc21 279888365 CUENJQIPEFFSKE-LLVKDONJSA-N 343.339 2.816 5 50 EFBA COc1ccccc1CC1(O)CCN(c2ncc([N+](=O)[O-])s2)CC1 239527580 ATFFSMDPTWDYAE-UHFFFAOYSA-N 349.412 2.634 5 50 EFBA COC1(CNc2ccc3cc(F)cc([N+](=O)[O-])c3n2)CCOCC1 170606605 QOIVYEDLOJGMGX-UHFFFAOYSA-N 335.335 2.890 5 50 EFBA O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccccc2[N+](=O)[O-])N1 33182 ZKQJJSPFSANANO-HOCLYGCPSA-N 337.335 2.764 5 50 EFBA biogenic O=C(O)c1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 3880051 ONSSEHIFCFLFOL-UHFFFAOYSA-N 341.367 2.615 5 50 EFBA O=[N+]([O-])c1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4774761 VCZGAOMAWKGNEF-UHFFFAOYSA-N 328.328 2.830 5 50 EFBA CS(=O)(=O)Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 120069527 QASVOXHWBDGCAA-UHFFFAOYSA-N 349.368 2.783 5 50 EFBA CS(=O)(=O)C[C@H]1CCCCN1c1ccc(Cl)cc1[N+](=O)[O-] 408519609 DXPMCFSUIPTLPD-LLVKDONJSA-N 332.809 2.652 5 50 EFBA COc1cc(C(=O)N2CCC(n3ccnc3)CC2)cc([N+](=O)[O-])c1C 190792883 VFAKXVPDYMOGCI-UHFFFAOYSA-N 344.371 2.586 5 50 EFBA O=C(Nc1ccccc1F)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 291471 AMYZPNZMZKFVBN-NSHDSACASA-N 343.314 2.726 5 50 EFBA CN(C)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 4682335 JYKWDYWRIFUCQQ-UHFFFAOYSA-N 344.396 2.788 5 50 EFBA CC1(C)[C@H](c2ccccc2)CCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 420638106 JBYUXDPLMVUGER-AWEZNQCLSA-N 340.383 2.861 5 50 EFBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2sccc2C(=O)C(C)(C)C)n1 253425550 FUAUGPKQYQAVHE-UHFFFAOYSA-N 336.373 2.871 5 50 EFBA CC(=O)Nc1ccc(NC(=O)c2ccccc2CC[N+](=O)[O-])cc1 1398087 PZZCJRJJXSTZGV-UHFFFAOYSA-N 327.340 2.717 5 50 EFBA COc1ccccc1[C@@H](CNc1cc(N)ccc1[N+](=O)[O-])N(C)C 328589469 NZCHTMXSPFYWJK-MRXNPFEDSA-N 330.388 2.900 5 50 EFBA COc1ccc(C(=O)Nc2cccc(C(=O)O)c2C)cc1[N+](=O)[O-] 621047 NZYHPZQEKKLQIP-UHFFFAOYSA-N 330.296 2.862 5 50 EFBA COc1cc([N+](=O)[O-])ccc1NC(=O)/C=C/c1ccc2c(c1)OCO2 4673189 NFHDAZYLAOMKKL-XVNBXDOJSA-N 342.307 2.984 5 50 EFBA Cc1sc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C 437393 VDUYCGYCFGOFJD-UHFFFAOYSA-N 333.369 2.553 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4912868 SJCURNALOTVZLY-ZDUSSCGKSA-N 332.356 2.672 5 50 EFBA COC(=O)c1ccc(C)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 370821 XXUBXQKEHOSGKA-UHFFFAOYSA-N 328.324 2.871 5 50 EFBA CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 196581 XCJXNOYRXJZLLS-OAHLLOKOSA-N 347.371 2.764 5 50 EFBA Cc1ncc([N+](=O)[O-])n1S(=O)(=O)c1cc(Cl)ccc1Cl 263878 BXOUIRJZACBAEI-UHFFFAOYSA-N 336.156 2.644 5 50 EFBA COc1cc(C(=O)NCc2ccc(C)cc2)c([N+](=O)[O-])cc1OC 445154 LIFBLLGUIDFGMX-UHFFFAOYSA-N 330.340 2.850 5 50 EFBA CN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCC[C@H]1S(C)(=O)=O 252477554 QRYLBLWWMJQUPP-HUUCEWRRSA-N 344.408 2.522 5 50 EFBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(c2c[nH]c3ccccc23)CC1 159430291 NJCQVMZQISFGGM-UHFFFAOYSA-N 339.355 2.819 5 50 EFBA CC(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4187811 SRWWKSLXCLKQKE-UHFFFAOYSA-N 325.796 2.943 5 50 EFBA Cc1nc2cc([N+](=O)[O-])cc(NCCc3ccccc3)c2c(=O)n1C 6659199 DYKGQOLOVLVEIL-UHFFFAOYSA-N 338.367 2.805 5 50 EFBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cccc2cccnc12 175212 YCXUFEOBLVZNAP-UHFFFAOYSA-N 329.337 2.944 5 50 EFBA in-vivo CO[C@@](F)(C(=O)Oc1cc([N+](=O)[O-])cc2cccnc12)C(F)(F)F 3672577 LTJWGAITRHDDBQ-LBPRGKRZSA-N 348.208 2.923 5 50 EFBA O=C(c1cc([N+](=O)[O-])ccc1NC1CCCCC1)N1CCOCC1 4998548 GMOPRHRDYKUQOG-UHFFFAOYSA-N 333.388 2.812 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@H]2C[C@H]3C=C[C@H]2C3)CC1 100609673 CGJACONVLRMRBF-BHYGNILZSA-N 341.411 2.565 5 50 EFBA CO[C@@H](C)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc(Br)c1C 240333649 FEPISPZYBOAJJS-IUCAKERBSA-N 345.193 2.819 5 50 EFBA COc1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 108709 MXEYTEXGHTXORX-UHFFFAOYSA-N 330.296 2.627 5 50 EFBA CCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 2070856 HUSRMKWJGJPJPK-CQSZACIVSA-N 333.344 2.518 5 50 EFBA CN(Cc1cn(C)nc1C(F)(F)F)C(=O)c1ccc([N+](=O)[O-])s1 126006904 WPQDWRZPJHLADV-UHFFFAOYSA-N 348.306 2.681 5 50 EFBA CN(C)[C@H]1CCC[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 170020457 KKGFELSARQRILM-STQMWFEESA-N 332.404 2.764 5 50 EFBA COc1cc2c(cc1O)C[C@@H]1c3cc(O)c(OC)cc3CC[N@+]1(C)C2 247962295 RBBVPNQTBKHOEQ-IIBYNOLFSA-O 342.415 2.915 5 50 EFBA biogenic Cc1cc(C(=O)Nc2ccccc2N2CCOCC2)ccc1[N+](=O)[O-] 473656 XZCOVWSOROREQE-UHFFFAOYSA-N 341.367 2.992 5 50 EFBA O=[N+]([O-])c1ccccc1/C=C/CN[C@H]1CCCN(c2ccncn2)C1 370768180 RLCQNDNQPWFFLE-GIZXNFQBSA-N 339.399 2.657 5 50 EFBA CC(=O)c1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 4873203 KYXICCPTAIQTCI-UHFFFAOYSA-N 334.353 2.907 5 50 EFBA O=C1CS[C@@H](c2ccccc2)N1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 191470 MGXILCXZIMQAAN-WBVHZDCISA-N 344.392 2.902 5 50 EFBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2ccncc2)s1 4801889 OUBGMGAVZHHHBR-UHFFFAOYSA-N 341.352 2.690 5 50 EFBA CC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5900673 DIDDAHXGZVQQMR-UHFFFAOYSA-N 329.268 2.958 5 50 EFBA Cc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c(O)c1 456087 XEKDZPZZNBARRY-UHFFFAOYSA-N 331.353 2.736 5 50 EFBA O=c1oc2ccccc2c(N(CCO)Cc2ccccc2)c1[N+](=O)[O-] 4011836 CYDBXRRKVKFCPM-UHFFFAOYSA-N 340.335 2.700 5 50 EFBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@](O)(c2ccc(F)cc2)C1 376474229 WEJIWGOIXGRAHF-GOSISDBHSA-N 344.342 2.776 5 50 EFBA CC(C)[N@@+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@H](CO)c1ccccc1)C2 253476028 OEXHQOGQTVQTAT-WVXKDWSHSA-N 332.464 2.854 5 50 EFBA world C[C@@H](NCCn1cccn1)c1ccc([N+](=O)[O-])cc1Br 888098253 DRQCSMJVMPTGHK-SNVBAGLBSA-N 339.193 2.905 5 50 EFBA O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]2C[C@H]1[C@H]1CCC[C@H]12 247362523 ZZUHCLYKPZDJLG-CAEXGNQWSA-N 330.384 2.915 5 50 EFBA O=C1c2cc(Cl)ccc2S(=O)(=O)[C@H]1c1cccc([N+](=O)[O-])c1 71769460 PEQWMIJAHFGDRB-AWEZNQCLSA-N 337.740 2.960 5 50 EFBA Cc1cc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c([N+](=O)[O-])cc1C 239339052 LQCHEPDDRNPJCI-XTPYWUFDSA-N 338.363 2.769 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C[C@H]2CC=CCC2)CC1 4700128 SMAFGORBZUCLDY-HNNXBMFYSA-N 329.400 2.709 5 50 EFBA Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)n1 119248769 MTWHAZNPBJYCNL-AWEZNQCLSA-N 327.340 2.981 5 50 EFBA C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ncc([N+](=O)[O-])s1 240471600 GDAKYCAPBVNTTP-DGCLKSJQSA-N 333.417 2.769 5 50 EFBA Cc1ccc([N+](=O)[O-])c(NC2CCN(C(=O)c3ccco3)CC2)n1 178161385 GVTQQGHICCVUIV-UHFFFAOYSA-N 330.344 2.608 5 50 EFBA CC[C@H](C)n1ncc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1C 408515778 HZODIRVXRBGIFR-JTQLQIEISA-N 338.389 2.872 5 50 EFBA O=[N+]([O-])c1ccc(CN2CCCN(c3ccccn3)CC2)cc1F 328586452 ZDEZZYLYTAIGHA-UHFFFAOYSA-N 330.363 2.841 5 50 EFBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1C=C[C@H]2C12CC2 239309362 HKVODJLKOYCOLK-JYILRKAJSA-N 344.754 2.950 5 50 EFBA CN(C(=O)CCc1cccc2c1OCO2)c1ccc([N+](=O)[O-])cc1 184902006 IOTKJVDIRRFQMF-UHFFFAOYSA-N 328.324 2.919 5 50 EFBA CCSc1nnc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1 3897786 ZEGCQFFMVMSIJF-UHFFFAOYSA-N 340.386 2.819 5 50 EFBA NC(=O)c1ccccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4771276 SPBMBBIDVCYQJV-UHFFFAOYSA-N 334.719 2.991 5 50 EFBA Cc1ccc(S(=O)(=O)NCCSC(C)(C)C)cc1[N+](=O)[O-] 4819450 TYGSPFQZFZMODE-UHFFFAOYSA-N 332.447 2.713 5 50 EFBA CCN(CC)CCCN1C(=O)CS[C@H]1c1cccc([N+](=O)[O-])c1 4905981 JMZHNKUOKISIHP-INIZCTEOSA-N 337.445 2.901 5 50 EFBA CCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])s2)C1 6661991 DJGCGKWXQLJPRQ-GFCCVEGCSA-N 325.434 2.737 5 50 EFBA CN(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 252515342 IVZBDBRXCGOBJQ-BFHYXJOUSA-N 344.371 2.895 5 50 EFBA CC1([N+](=O)[O-])CN(Cc2ccccc2)CN(Cc2ccccc2)C1 19327460 SVDFJLBPZLOQLS-UHFFFAOYSA-N 325.412 2.997 5 50 EFBA O=C1CS[C@H](c2ccccc2)N1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 191472 MGXILCXZIMQAAN-NVXWUHKLSA-N 344.392 2.902 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CCC[C@@H](C(=O)OC(C)(C)C)C1 281589498 XEOZTDWRIJDGRE-GFCCVEGCSA-N 338.408 2.678 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2cncc(Cl)c2)s1 240551696 GVLMCQVLKYLSSA-UHFFFAOYSA-N 334.762 2.901 5 50 EFBA C[C@@]1(O)CCN(C(=O)c2c3ccccc3cc3ccccc23)C[C@@H]1O 96153023 BXCIQVXTIBTDAT-GHTZIAJQSA-N 335.403 2.951 5 50 EFBA CCO[C@@H]1C[C@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])[C@@]12CCCO2 273521198 SAHYZSKYYWUHMV-BBWFWOEESA-N 334.372 2.936 5 50 EFBA COc1ccccc1C(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1 4090405 RUVYHSBOWHKEDU-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA O=C(/C=C/c1ccco1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4688539 KDYNSJNGWHTAAG-BQYQJAHWSA-N 327.340 2.550 5 50 EFBA CN1CCN(c2ccc([N+](=O)[O-])c(NCc3ccccc3)c2)CC1 4561325 LPOIGVZLNWEGJG-UHFFFAOYSA-N 326.400 2.959 5 50 EFBA O=C(NCc1nccn1C(F)F)c1ccc([N+](=O)[O-])c(Cl)c1 155067217 AYYRNERCIDPFNE-UHFFFAOYSA-N 330.678 2.770 5 50 EFBA CCc1ccc(NC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] 252511601 IONWCFWAQFLRBK-DOMZBBRYSA-N 334.420 2.961 5 50 EFBA C[C@H]1[C@H]2C=C[C@H]([C@@H]1C(=O)N(C=O)c1cccc([N+](=O)[O-])c1)C21CC1 101857260 IABITEUDZCOMLK-AEAUEXCSSA-N 326.352 2.933 5 50 EFBA Cc1nc(N[C@H](CO)Cc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] 301648421 ISOLTIUFXAMVOY-ZDUSSCGKSA-N 326.356 2.795 5 50 EFBA Cc1ccc(/C=C/C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1 5394481 BEHMDTLLLHXZSR-CMDGGOBGSA-N 341.367 2.858 5 50 EFBA COc1cc(C=O)cc(OC)c1OC(=O)c1ccccc1[N+](=O)[O-] 312962 VVRVFXDMEGJFGK-UHFFFAOYSA-N 331.280 2.644 5 50 EFBA Cc1ccc(OCC(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 860134 ATEABHJDXABPJB-UHFFFAOYSA-N 329.308 2.708 5 50 EFBA Cc1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)c([N+](=O)[O-])c1 4031821 QSSSCZVAFGVIHA-AWEZNQCLSA-N 340.339 2.665 5 50 EFBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCc1noc2ccccc12 225390628 ZISLOVCGLUNDTB-UHFFFAOYSA-N 347.352 2.523 5 50 EFBA O=[N+]([O-])c1cnc2ccc(NC[C@@H]3COC4(CCCCCC4)O3)nn12 302065871 UJYQLDZYLMLYQO-GFCCVEGCSA-N 347.375 2.515 5 50 EFBA O=c1[nH]c(O)nc(/C=C/c2ccc(-c3ccc(F)cc3)o2)c1[N+](=O)[O-] 4501599 NHOBTJZBVMSXED-FNORWQNLSA-N 343.270 2.953 5 50 EFBA CN(C)c1ccc2c(c1)CN(C(=O)c1ccccc1[N+](=O)[O-])CC2 225427763 VJDLCCMOSQCMGI-UHFFFAOYSA-N 325.368 2.859 5 50 EFBA COc1ccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1[N+](=O)[O-] 4905523 SRQOUUCLXPNEHD-UHFFFAOYSA-N 335.404 2.642 5 50 EFBA CCOC(=O)CCCCOC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 740953041 UGZGWAJICHFEQR-UHFFFAOYSA-N 334.328 2.966 5 50 EFBA NC1(CNc2ncc([N+](=O)[O-])cc2Br)CCCCC1 261624090 UYRJQWOMJVLWTA-UHFFFAOYSA-N 329.198 2.826 5 50 EFBA CC(C)(C)CC(C)(C)NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 5074035 BYWPHXXCRLWLSX-UHFFFAOYSA-N 339.417 2.848 5 50 EFBA O=C1C[C@@H](c2ccc([N+](=O)[O-])cc2)c2cc3c(cc2N1)OCCO3 423369 MJTBXMWHTRZIOX-LBPRGKRZSA-N 326.308 2.840 5 50 EFBA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 100063701 FCYQQISDGGSKJH-LBLXLQPISA-N 332.743 2.950 5 50 EFBA COc1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 103349 GXWKCKJQWFEDDL-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA Cc1ccc(OCCn2cnc3ccccc3c2=O)c([N+](=O)[O-])c1 311187 SPIGUUIXVQNJCG-UHFFFAOYSA-N 325.324 2.692 5 50 EFBA CC(C)(C)C(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4188593 NTLXSNMQSBAMLP-UHFFFAOYSA-N 325.796 2.943 5 50 EFBA O=[N+]([O-])c1ccc(-c2noc(CN3CCO[C@H]4CCCC[C@H]43)n2)cc1 230127018 PIFZXIRJQRRKHS-CABCVRRESA-N 344.371 2.788 5 50 EFBA Cc1cc(C(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)cc([N+](=O)[O-])c1 173436280 NJJXZHGEIWGQIY-NSHDSACASA-N 330.388 2.615 5 50 EFBA CCOC(=O)[C@H]1[C@H]2C=C[C@@H](c3c2cccc3[N+](=O)[O-])[C@H]1C(=O)OCC 253611278 MTKCNYRBENZGCV-GVAFMPQTSA-N 345.351 2.704 5 50 EFBA COc1cccc(C(=O)Nc2n[nH]c3cc(F)ccc23)c1[N+](=O)[O-] 225526262 ZXKVKKZUBIZOKP-UHFFFAOYSA-N 330.275 2.871 5 50 EFBA Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1Nc2ccccc2NC1=O 91359 GEMWUBKVDFUHNE-OAHLLOKOSA-N 340.339 2.665 5 50 EFBA O=C(Nc1cc([N+](=O)[O-])ccc1F)N(CCO)C1CCCCC1 1755644 CPKBQDCHKQBIIT-UHFFFAOYSA-N 325.340 2.893 5 50 EFBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(C(F)(F)F)ccc1F 2743495 RILADCOGBJOTLM-UHFFFAOYSA-N 332.213 2.588 5 50 EFBA Cc1nn(C)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1[N+](=O)[O-] 6525996 JHYDFXGWSYRTSI-UHFFFAOYSA-N 332.404 2.583 5 50 EFBA Cc1cc(N2CCC(OC[C@@H]3CCCCO3)CC2)ncc1[N+](=O)[O-] 267402312 PVXOPWCCPGXXOF-HNNXBMFYSA-N 335.404 2.853 5 50 EFBA CCc1nc(CN2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cs1 192783515 JNZSCTSSQOEBSQ-UHFFFAOYSA-N 347.444 2.518 5 50 EFBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCSc2ccccc2)c1 5050203 XULYLEINIBDULO-UHFFFAOYSA-N 338.410 2.665 5 50 EFBA Cc1cc(CN=c2cc(C)c([N+](=O)[O-])c(C)[nH]2)cc(N2CCCC2)n1 1875310359 NHQMAOUBDUGKCC-UHFFFAOYSA-N 341.415 2.944 5 50 EFBA O=C(Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1)Nc1ccccc1F 170596268 GCJIFSXZEWZMEW-UHFFFAOYSA-N 332.213 2.588 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1NC1CCC(Oc2cnccn2)CC1 192847905 BUVNDQHNRQSEII-UHFFFAOYSA-N 346.391 2.712 5 50 EFBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2cccc(OCc3ccccc3)c2)N1 122565 OZIYDKVKDFPAQG-FUHWJXTLSA-N 326.352 2.862 5 50 EFBA Cc1cc([N+](=O)[O-])ccc1CN1CCC(Nc2cccnn2)CC1 183331999 ZWENZAOXURMSDL-UHFFFAOYSA-N 327.388 2.770 5 50 EFBA O=C(O)[C@@H]1[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]2C=C[C@H]1C2 102315396 WIVIBAYEYWRCMI-XMUKKISLSA-N 336.731 2.710 5 50 EFBA Cc1c(CN2CCn3c(nnc3C(F)(F)F)C2)cccc1[N+](=O)[O-] 150980272 UDCLGDDQZWKCRQ-UHFFFAOYSA-N 341.293 2.529 5 50 EFBA CNc1cc(N2CC[C@H](OC)C2)cc(Br)c1[N+](=O)[O-] 1775999866 ZDFAGSIMUBLMGL-VIFPVBQESA-N 330.182 2.624 5 50 EFBA CC[C@@H](C)OC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-] 4913314 NKQQPQURILVHAS-MFKMUULPSA-N 332.356 2.814 5 50 EFBA COC(=O)c1c(C)nc(C)c(C(=O)OC)c1-c1ccc([N+](=O)[O-])cc1 4615024 DMKXWKHBAXUABP-UHFFFAOYSA-N 344.323 2.847 5 50 EFBA CCOc1ccc(Nc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])cc1 4758297 LCMAUQJJLHRQGV-UHFFFAOYSA-N 341.327 2.556 5 50 EFBA CC(=O)c1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1 78575629 HPBTYPOTYIAKEE-UHFFFAOYSA-N 349.387 2.855 5 50 EFBA Cc1n[nH]c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1[N+](=O)[O-] 4629572 RTFVKBKBGCPWSN-UHFFFAOYSA-N 330.222 2.777 5 50 EFBA CCN1Cc2cccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)c2C1 119736875 HMSZRLNICIROKC-UHFFFAOYSA-N 327.340 2.888 5 50 EFBA COc1cccc(C(=O)N[C@@H](c2nccs2)C2CC2)c1[N+](=O)[O-] 194471058 HIDXZWTUIXXKNV-GFCCVEGCSA-N 333.369 2.941 5 50 EFBA CN1CCN(c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 4983754 JNZYNIBGVVFRPS-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA Cn1cnc([N+](=O)[O-])c1-c1noc(C2(c3ccccc3)CCC2)n1 225553281 DBDFAEPHRNJFHT-UHFFFAOYSA-N 325.328 2.848 5 50 EFBA O=C(c1ccccc1Oc1ccc([N+](=O)[O-])cc1)N1CCOCC1 1061895 AWWUTIFRJPXQJR-UHFFFAOYSA-N 328.324 2.860 5 50 EFBA Cc1cccc(N2CCC(Nc3cc(N)ccc3[N+](=O)[O-])CC2)n1 193442286 ZQIRWMPRZHUKFL-UHFFFAOYSA-N 327.388 2.961 5 50 EFBA CC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 3893877 OQTNPWPOSIRTET-UHFFFAOYSA-N 334.353 2.907 5 50 EFBA COc1cccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)c1 4662621 VIANBECWOSXFAZ-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA O=[N+]([O-])c1ccccc1CN1CCN(C[C@@H]2C[C@H]3C=C[C@H]2C3)CC1 100709430 WRESZNUCZXPYJA-BQFCYCMXSA-N 327.428 2.925 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccccc2)C1 193279757 MAXCTLITQSSQIA-INIZCTEOSA-N 327.340 2.512 5 50 EFBA COc1cc(C(=O)N(Cc2cccnc2)C2CC2)ccc1[N+](=O)[O-] 195465283 OVJRPBCHUFJWAH-UHFFFAOYSA-N 327.340 2.803 5 50 EFBA CNc1cc(N2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] 4703731 SOGNBKZRWLCKOS-UHFFFAOYSA-N 340.383 2.599 5 50 EFBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1ccc(O)cc1C(=O)O 4855643 NNNLMUIBLCXPQN-QPJJXVBHSA-N 328.280 2.651 5 50 EFBA O=C1CCCCN1CC1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 253392330 CXAPRFKFXTVFMB-UHFFFAOYSA-N 349.406 2.958 5 50 EFBA COC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)cc1[N+](=O)[O-] 215771723 LVUGDOXIXJYTGZ-UHFFFAOYSA-N 347.323 2.978 5 50 EFBA O=C(NC1(c2nnc[nH]2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 170619320 ILSFEUJVDDELGH-UHFFFAOYSA-N 343.368 2.737 5 50 EFBA Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)Cc1ccc2c(c1)OCO2 225712788 IOPASVBQZIZISJ-UHFFFAOYSA-N 332.287 2.952 5 50 EFBA COc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c(C)n1 268335798 AFUYCFDYTWRENI-UHFFFAOYSA-N 347.327 2.576 5 50 EFBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCc3sccc3[C@@H]2C)n1 286159250 OQFGEXKOABPZMX-VIFPVBQESA-N 333.369 2.962 5 50 EFBA Cc1ccc(S(=O)(=O)CC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 566937 MWINDUBGWMFCLA-UHFFFAOYSA-N 333.365 2.868 5 50 EFBA Cc1nn(C[C@@H](C)C(=O)Nc2ccc(F)cc2F)c(C)c1[N+](=O)[O-] 2794560 FJDCCRPLXKXVRL-MRVPVSSYSA-N 338.314 2.961 5 50 EFBA CCn1nc(C)c([N+](=O)[O-])c1N1CC(c2cnc3ccccc3n2)C1 952992612 PZYSVKKJOUKWCH-UHFFFAOYSA-N 338.371 2.667 5 50 EFBA CC(C)CC(=O)NC(NC(=O)CC(C)C)c1cccc([N+](=O)[O-])c1 2952021 DQGDCCQXWQIEMO-UHFFFAOYSA-N 335.404 2.918 5 50 EFBA O=C1N=C(O)N=C(O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 18045325 UPERXOCGCBEBOY-UHFFFAOYSA-N 327.252 2.649 5 50 EFBA biogenic O=C(NC[C@H]1CCCC[C@H]1O)Nc1cc([N+](=O)[O-])ccc1Cl 170594006 BRWNKCZHIBBQOR-NOZJJQNGSA-N 327.768 2.921 5 50 EFBA O=C(COc1ccccc1[N+](=O)[O-])NC1C2CC3CC(C2)CC1C3 470356 KGYRMSXRCBZASM-UHFFFAOYSA-N 330.384 2.915 5 50 EFBA O=C(NC[C@H]1CSCCS1)c1ccc([N+](=O)[O-])c(Cl)c1 139474317 LANZFWBCNBSHKN-VIFPVBQESA-N 332.834 2.827 5 50 EFBA COc1cc(CN(CCO)Cc2ccccc2)c([N+](=O)[O-])cc1OC 55292262 WLHLEZGUJCCYIY-UHFFFAOYSA-N 346.383 2.607 5 50 EFBA O=C1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@H](c2cccnc2)N1C1CC1 344085992 ACUWJKZPNIEOAI-AEFFLSMTSA-N 338.367 2.906 5 50 EFBA Cc1c(NC(=O)[C@H](C)N2CCC[C@H](CCO)CC2)cccc1[N+](=O)[O-] 421013889 JPIOGORMABHHPH-GJZGRUSLSA-N 349.431 2.715 5 50 EFBA COC(=O)c1cnc(N2CCSc3ccccc3C2)c([N+](=O)[O-])c1 2325741462 WDAQMOMPBISIDZ-UHFFFAOYSA-N 345.380 2.889 5 50 EFBA COc1cc(C=O)cc(OC)c1OC(=O)c1cccc([N+](=O)[O-])c1 313718 XUAHFEGURDSZOJ-UHFFFAOYSA-N 331.280 2.644 5 50 EFBA Cc1ccc([C@@H]2CCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C 229339135 QTGDPSDIACEXHL-MSOLQXFVSA-N 344.415 2.606 5 50 EFBA Cc1nn(CCCC(=O)N2CCc3ccccc32)c(C)c1[N+](=O)[O-] 1429864 NBXCZYGOTYWRQY-UHFFFAOYSA-N 328.372 2.778 5 50 EFBA COc1ccc(NC(=O)c2c(OC)cccc2OC)cc1[N+](=O)[O-] 2847122 FPZQKGFVYWEYJA-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=[N+]([O-])c1ccccc1N1CCN(c2ccccc2[N+](=O)[O-])CC1 3878379 OJCCSOXIDWVLHG-UHFFFAOYSA-N 328.328 2.830 5 50 EFBA Cc1nc(N[C@@H](CO)Cc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] 301648419 ISOLTIUFXAMVOY-CYBMUJFWSA-N 326.356 2.795 5 50 EFBA COc1c([N+](=O)[O-])cc2c(C)c(Br)c(=O)oc2c1OC 300861 DJINJBITQRZDOC-UHFFFAOYSA-N 344.117 2.789 5 50 EFBA O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(c2ccccn2)CC1 4700907 DOVXQXSUFAGXAY-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA O=c1oc2ccc([N+](=O)[O-])cc2cc1-c1nc2ccccc2c(=O)[nH]1 5028302 WWUDIXKZGGLNRJ-UHFFFAOYSA-N 335.275 2.605 5 50 EFBA O=C(c1sc2cc([N+](=O)[O-])ccc2c1Cl)N1CCOCC1 62272 FIOWPYNKYKJRQV-UHFFFAOYSA-N 326.761 2.935 5 50 EFBA C[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 472073 SVKLHSXCUXYCSI-LLVKDONJSA-N 328.324 2.743 5 50 EFBA O=[N+]([O-])c1ccc2c(c1NC1CCCCC1)=NC1(CCCCC1)[N+]=2[O-] 4674709 XZTKZSDVEQGNRB-UHFFFAOYSA-N 344.415 2.622 5 50 EFBA O=C(Nc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)N1CCOCC1 20310880 GTWCDFASHVQCOG-KRWDZBQOSA-N 341.367 2.607 5 50 EFBA CC(=O)c1ccc(N2CC[C@@H](Oc3cccnc3)C2)c([N+](=O)[O-])c1 301671256 OIQKPHHYENUVQD-OAHLLOKOSA-N 327.340 2.850 5 50 EFBA COc1ccc([N+](=O)[O-])cc1NC(=S)NC(=O)c1ccccc1 586844 OKCJYCJPCMBJRL-UHFFFAOYSA-N 331.353 2.730 5 50 EFBA C[C@H](NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1)c1ccccc1 371600 VFIALPUYBASCKA-LBPRGKRZSA-N 340.339 2.924 5 50 EFBA Cn1nccc1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 160227366 MZGCNNQMBQEWGS-UHFFFAOYSA-N 343.265 2.669 5 50 EFBA COC(=O)c1ccc(-c2nc(Cn3c([N+](=O)[O-])cnc3C)co2)cc1 170593862 BUDZHVGAQMRCBK-UHFFFAOYSA-N 342.311 2.590 5 50 EFBA C[C@H](c1ccccc1[N+](=O)[O-])N(C)[C@H]1CCN(CC(F)(F)F)C1=O 241465971 NTOQFQOHKYASIZ-MFKMUULPSA-N 345.321 2.751 5 50 EFBA COc1ccccc1N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 55543047 UJGZZEUCLNQJRT-UHFFFAOYSA-N 327.384 2.926 5 50 EFBA COc1cc(N2CCN(c3cc(C4CC4)n[nH]3)CC2)ccc1[N+](=O)[O-] 302410892 LKEAIIQKVOSLFB-UHFFFAOYSA-N 343.387 2.531 5 50 EFBA O=[N+]([O-])c1cnc(N2CCN(c3nc4ccccc4s3)CC2)s1 195508484 NKWPDWCHGIIJNX-UHFFFAOYSA-N 347.425 2.988 5 50 EFBA CN(C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCOC1 160188305 IEPHNLWJEICIAD-VIFPVBQESA-N 333.266 2.866 5 50 EFBA O=C(c1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3880004 GUIBVPPOKNFZER-UHFFFAOYSA-N 329.331 2.696 5 50 EFBA O=C(Cn1c(=O)sc2ccccc21)Oc1ccccc1[N+](=O)[O-] 5740004 FMKSHYOCMLIVFL-UHFFFAOYSA-N 330.321 2.577 5 50 EFBA O=C(Nc1cccc(Cl)c1)c1cc([N+](=O)[O-])ccc1NCCO 4755331 WJRWOFAIXWWDCL-UHFFFAOYSA-N 335.747 2.905 5 50 EFBA CN1C(=O)c2oc3ccccc3c(=O)c2[C@@H]1c1ccc([N+](=O)[O-])cc1 4851261 DBPXOCHTHNFXGC-HNNXBMFYSA-N 336.303 2.876 5 50 EFBA Cc1ccccc1[C@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CCO1 119057645 RGUXEERZBFRSMI-QGZVFWFLSA-N 342.351 2.823 5 50 EFBA Cc1ccc(NC(=O)CCCCCN2C(=O)CCC2=O)c([N+](=O)[O-])c1 4834505 RTQVLZGEKWZPDL-UHFFFAOYSA-N 347.371 2.551 5 50 EFBA O=C1c2ccccc2C(=O)N1Cc1cc(Cl)c(O)c([N+](=O)[O-])c1 106804 YLGRPJXMEIXCFZ-UHFFFAOYSA-N 332.699 2.750 5 50 EFBA O=C(Nc1nnc(-c2ccncc2)s1)c1ccccc1[N+](=O)[O-] 1053563 GWZAUWSOUUEZBI-UHFFFAOYSA-N 327.325 2.761 5 50 EFBA O=C(NCc1cccs1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 1056265 SNQLRZIEKYHPQM-UHFFFAOYSA-N 330.321 2.693 5 50 EFBA O=C(CC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)OCO2 3185714 NYBGDRGKGPDNGH-UHFFFAOYSA-N 328.280 2.535 5 50 EFBA O=C(CSc1nnc(-c2ccco2)o1)Nc1cccc([N+](=O)[O-])c1 63937 XXSUKJUPYOJIEB-UHFFFAOYSA-N 346.324 2.969 5 50 EFBA O=C(Cn1cnc2cc(Cl)ccc2c1=O)c1cccc([N+](=O)[O-])c1 3124316 BIELHIJENDYLOQ-UHFFFAOYSA-N 343.726 2.841 5 50 EFBA Cc1cc(NC(=O)N[C@H]2c3ccccc3C[C@@H]2O)ccc1[N+](=O)[O-] 121299731 DYTIVTGKXZVGNW-HOTGVXAUSA-N 327.340 2.683 5 50 EFBA CC(=O)c1ccc(N[C@@H](C(N)=O)c2ccc(F)cc2)c([N+](=O)[O-])c1 129640180 XRMVGACXBWSRMD-OAHLLOKOSA-N 331.303 2.575 5 50 EFBA C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 158429148 KNXGGYVVZCRNEQ-BONVTDFDSA-N 348.330 2.682 5 50 EFBA O=[N+]([O-])c1c(Br)cccc1I 95642979 CMXDVNRQFNSTCY-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA in-vitro Cc1nc(N2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N 170605144 DCKAAFIJCFZESB-UHFFFAOYSA-N 341.371 2.733 5 50 EFBA COC(=O)c1cc(C(=O)N2CCCc3ccccc32)cc([N+](=O)[O-])c1 60847 KNBONNIXFAAKLE-UHFFFAOYSA-N 340.335 2.974 5 50 EFBA O=C(Oc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4846121 HMBXUZUXSMQVCF-UHFFFAOYSA-N 328.324 2.651 5 50 EFBA CCO[C@H]1C[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C12CCC2 183598853 FNLBUBPYIXMQND-KGLIPLIRSA-N 334.376 2.801 5 50 EFBA CO[C@H]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 190817230 YPMDITQNUNQUJA-IUCAKERBSA-N 343.177 2.655 5 50 EFBA Nc1cc(Br)c(I)cc1[N+](=O)[O-] 575721122 XQACKQKCARJQST-UHFFFAOYSA-N 342.918 2.544 5 50 EFBA O=C(CCSc1c(Cl)cccc1[N+](=O)[O-])N1CCOCC1 621210 AIGBQXQFXKKZMC-UHFFFAOYSA-N 330.793 2.589 5 50 EFBA CCCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 2058311 NWMYPGTWVAMIPB-HNNXBMFYSA-N 347.371 2.908 5 50 EFBA Cc1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)c([N+](=O)[O-])c1 4031820 QSSSCZVAFGVIHA-CQSZACIVSA-N 340.339 2.665 5 50 EFBA NC1=N[C@@H](c2cc([N+](=O)[O-])ccc2Cl)n2c(nc3ccccc32)N1 4741643 PKNLRTKXEJBUNZ-CYBMUJFWSA-N 342.746 2.885 5 50 EFBA O=C(O)c1ccccc1Nc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] 104233707 WGTKBFIDYWKWJS-UHFFFAOYSA-N 348.227 2.853 5 50 EFBA COc1cc(N[C@@H]2CCN(C[C@@H]3CCCO3)C[C@H]2C)ccc1[N+](=O)[O-] 252477370 MQMACDRHCXUVHG-VNQPRFMTSA-N 349.431 2.905 5 50 EFBA CCN1CCN(c2ccc([N+](=O)[O-])c(-n3nc(C)cc3C)c2)CC1 4676984 MJVRNCYBJGLSNW-UHFFFAOYSA-N 329.404 2.539 5 50 EFBA COc1cc(C(=O)N2CCCC[C@@H]2c2ncon2)cc([N+](=O)[O-])c1C 187859177 MNGSHJXIDUMNND-GFCCVEGCSA-N 346.343 2.662 5 50 EFBA CCOc1ccc(NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1OC 195348102 PRTCYNOYTBXYJR-UHFFFAOYSA-N 348.359 2.536 5 50 EFBA O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1F)c1ccc(F)cc1 452546 OTQCQNSYEBHPCI-UHFFFAOYSA-N 337.307 3.000 5 50 EFBA COc1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 4576908 FIRDJSBNTYOPMW-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA O=C(NC1CCCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4881695 BPEWVJKJZHYRTH-UHFFFAOYSA-N 332.404 2.759 5 50 EFBA COc1ccccc1N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C1 156805249 UWTOUTDSVZDQIA-CQSZACIVSA-N 341.367 2.612 5 50 EFBA CCCC1=C(C(=O)OCC)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 122578 ASBMZOOAHJSDTH-OAHLLOKOSA-N 347.371 2.908 5 50 EFBA Cc1nc2cc([N+](=O)[O-])ccc2c(=O)n1-c1cccc([N+](=O)[O-])c1 2895986 YWNPXBMGNJJQQV-UHFFFAOYSA-N 326.268 2.511 5 50 EFBA COc1ccc(C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 4819030 AJGUNSPGEMSDLA-UHFFFAOYSA-N 342.351 2.671 5 50 EFBA CN(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 170652859 IVZBDBRXCGOBJQ-MCIONIFRSA-N 344.371 2.895 5 50 EFBA O=C(Nc1nnc(-c2cccnc2)s1)c1ccccc1[N+](=O)[O-] 1869323 IGJHPMOFVIYGTH-UHFFFAOYSA-N 327.325 2.761 5 50 EFBA O=C1c2ccccc2C(=O)N1CCCOc1cccc([N+](=O)[O-])c1 5049828 PEIWNCRCLWKTDI-UHFFFAOYSA-N 326.308 2.660 5 50 EFBA C[C@@H]1Cc2n[nH]cc2CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1651748157 UTJSRZGQEVWAJX-SNVBAGLBSA-N 339.355 2.634 5 50 EFBA Cc1nc(-c2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2)n[nH]1 172846175 KPSFDNNRVUTHRL-UHFFFAOYSA-N 337.339 2.870 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccccc2)C1 193279773 MAXCTLITQSSQIA-MRXNPFEDSA-N 327.340 2.512 5 50 EFBA Cc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 3879886 HOQQANQXRSWELA-UHFFFAOYSA-N 325.368 2.866 5 50 EFBA O=[N+]([O-])c1ccc(N[C@@H](CO)Cc2nccs2)cc1OC(F)F 1775994461 PKFWPWBRPKJGSW-SECBINFHSA-N 345.327 2.668 5 50 EFBA Cc1ccc(N2CCCN(c3cccc(F)c3[N+](=O)[O-])CC2)nn1 276946498 BOYOKFJQPKLFJH-UHFFFAOYSA-N 331.351 2.549 5 50 EFBA O=C(OC1[C@@H]2C[C@@H]2[C@@H]2C[C@H]2[C@H]2C[C@@H]12)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 104293184 PPUCZTNHHBDGPM-BXLXJSPXSA-N 344.323 2.950 5 50 EFBA O=C(c1cc([N+](=O)[O-])[nH]n1)N1CC2(CCCC2)c2c(F)cccc21 242389225 ZVIILXKJKRHOSK-UHFFFAOYSA-N 330.319 2.929 5 50 EFBA COc1ccc(CCNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC 87379 UNBBJINVMGRWRI-UHFFFAOYSA-N 330.340 2.585 5 50 EFBA CC1(C)[C@H]([N+](=O)[O-])[C@H](c2ccco2)N[C@@H](c2ccco2)[C@H]1[N+](=O)[O-] 239235644 WKSGTJWBIMDLLN-IGQOVBAYSA-N 335.316 2.575 5 50 EFBA Cc1cccc(N2CCC(NC(=O)c3cccc([N+](=O)[O-])c3)CC2)n1 116668218 KWHHTARKDKASFD-UHFFFAOYSA-N 340.383 2.697 5 50 EFBA C[C@@H](C(=O)NCC12CC3CC(CC(C3)C1)C2)n1cc([N+](=O)[O-])cn1 6520799 KTJMVBRDZOUBQJ-GVMDUPDNSA-N 332.404 2.685 5 50 EFBA C[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H]1CO 190239417 PHDNBKBHIUSECT-PELKAZGASA-N 347.293 2.848 5 50 EFBA COc1cccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1 445304 AMNDXSQFAGZUHP-UHFFFAOYSA-N 332.312 2.873 5 50 EFBA Cc1cc(C(=O)Nc2ccc(OCC(=O)O)cc2)ccc1[N+](=O)[O-] 2868779 BHCIGMMCGICBAR-UHFFFAOYSA-N 330.296 2.619 5 50 EFBA Cc1c([N+](=O)[O-])c(C(=O)Nc2ccccc2Br)nn1C 1000081 RMBQBRICYCKDRE-UHFFFAOYSA-N 339.149 2.652 5 50 EFBA C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)N1CCCCC1=O 170606529 APZIJOAFQKVXQE-LBPRGKRZSA-N 328.372 2.956 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 225536308 JVDIDQUKWIFDCW-RRQGHBQHSA-N 344.392 2.749 5 50 EFBA O=[N+]([O-])c1ccc(S(=O)(=O)NC2C3CC4CC(C3)CC2C4)cc1 318683 CGVAXWZVKYZWIQ-UHFFFAOYSA-N 336.413 2.698 5 50 EFBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 170780818 DQJDZBFISXWMHF-MRXNPFEDSA-N 345.330 2.651 5 50 EFBA O=c1c2ccccc2ncn1CCCOc1ccc([N+](=O)[O-])cc1 16382020 BSVWGQYASJJTNY-UHFFFAOYSA-N 325.324 2.774 5 50 EFBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccc(F)c2)CC1 19293858 VZXXIWRGSIIAES-UHFFFAOYSA-N 343.358 2.692 5 50 EFBA O=C(NCc1cccnc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 4865926 JGTKTAWOJLWVPA-UHFFFAOYSA-N 326.356 2.520 5 50 EFBA O=[N+]([O-])c1cccc(I)c1Br 197196122 NKFATHXREYJOQX-UHFFFAOYSA-N 327.903 2.962 5 50 EFBA COc1ccc(F)cc1[C@H](O)Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1 1875291409 XVRDQEBFYAUANT-SNVBAGLBSA-N 349.240 2.691 5 50 EFBA Cc1nc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c(C)s1 170604944 IUQQZZKELBWIEI-UHFFFAOYSA-N 341.414 2.684 5 50 EFBA COc1ccc2c(c1)CCCN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)C2 170621120 JPVWPMNDVBRIJT-UHFFFAOYSA-N 342.351 2.898 5 50 EFBA COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@H](C)Cn1ccnc1 225387892 MZAATBWUFPTFLW-NSHDSACASA-N 332.360 2.635 5 50 EFBA Cc1nn(C)c(C(=O)Nc2cccc([N+](=O)[O-])c2)c1Br 2759964 NJPYFBPMLVQSIP-UHFFFAOYSA-N 339.149 2.652 5 50 EFBA CO[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1O)c1ccc(F)cc1 155675636 MUJFHBUINMOFFJ-AWEZNQCLSA-N 334.303 2.557 5 50 EFBA C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 450949 AFOZTEKAECGBDC-LLVKDONJSA-N 328.324 2.857 5 50 EFBA O=C(CCC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccccc1 611081 DQVBNJFGLMKODK-UHFFFAOYSA-N 327.340 2.630 5 50 EFBA O=[N+]([O-])c1cc(Br)c(F)cc1OC[C@@H](O)C(F)(F)F 190702749 NCTPPOIUIWRBIG-MRVPVSSYSA-N 348.046 2.798 5 50 EFBA O=[N+]([O-])c1cc(F)c(NC2CCN(c3cccnn3)CC2)c(F)c1 277256199 WGJUZZUNSVJGGW-UHFFFAOYSA-N 335.314 2.744 5 50 EFBA NC(=O)c1ccccc1NC(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 513622 BTNLABUVKSQUSV-SOFGYWHQSA-N 345.742 2.999 5 50 EFBA CN(C)C(=O)COc1cccc(CNc2cc(F)ccc2[N+](=O)[O-])c1 192534956 XCNORIZLDOJWPO-UHFFFAOYSA-N 347.346 2.813 5 50 EFBA Cc1ccc2nsnc2c1NC(=O)COc1ccccc1[N+](=O)[O-] 97721 OXBGCCSJCIAHRY-UHFFFAOYSA-N 344.352 2.925 5 50 EFBA COc1ccccc1CN1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 169381 WBJWTJWXMVOPHQ-UHFFFAOYSA-N 341.411 2.921 5 50 EFBA COC(=O)c1c(C)nc(C)c(C(=O)OC)c1-c1ccccc1[N+](=O)[O-] 2530703 UMQHJQGNGLQJPF-UHFFFAOYSA-N 344.323 2.847 5 50 EFBA world O=C(O)c1cc([N+](=O)[O-])c(NC(=O)C(F)(F)F)cc1C(F)(F)F 72265925 HQAMJNRQVPUNEE-UHFFFAOYSA-N 346.139 2.813 5 50 EFBA in-vitro CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H]1CCSC1 282034770 UBQQJEWTYSQPKN-LLVKDONJSA-N 325.390 2.963 5 50 EFBA CC(=O)[C@@H]1[C@@H](c2cccc([N+](=O)[O-])c2)c2c(noc2C)C[C@]1(C)O 245297208 QFIOBYZYLDTUAR-BBWFWOEESA-N 330.340 2.535 5 50 EFBA CCOC(=O)Cc1csc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 175240 HFNYZPJJTMPAEA-UHFFFAOYSA-N 349.368 2.718 5 50 EFBA CN(CC1CC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 416366813 DGKCAADCASBNKU-UHFFFAOYSA-N 338.307 2.644 5 50 EFBA O=C(Nc1ccc(NC(=O)C(F)(F)F)c([N+](=O)[O-])c1)C(F)(F)F 4380139 PMTCMJAHCFZOIR-UHFFFAOYSA-N 345.155 2.596 5 50 EFBA CCOc1ccc(C(=O)NC(=S)NC2CCCC2)cc1[N+](=O)[O-] 304758 YSQNAGIVDNCZDW-UHFFFAOYSA-N 337.401 2.540 5 50 EFBA O=c1c2ccccc2ncn1CCCOc1cccc([N+](=O)[O-])c1 4841770 AMWVMDHDQOARKC-UHFFFAOYSA-N 325.324 2.774 5 50 EFBA O=C(CSc1nc(-c2ccncc2)n[nH]1)c1cccc([N+](=O)[O-])c1 6084453 LUCLEYCHVOTYQY-UHFFFAOYSA-N 341.352 2.750 5 50 EFBA O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC3C[C@H]4CC2C[C@@H](C3)C4)c1 252511017 CZGZXOMKEWZJET-FSSNUXCQSA-N 346.427 2.845 5 50 EFBA O=C(Nc1ccccc1)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 448539 YXMZGYPLPFNODI-GFCCVEGCSA-N 325.324 2.586 5 50 EFBA COc1ccc(C(=O)NC(=S)Nc2ccc(F)cc2)cc1[N+](=O)[O-] 4313499 UCBCETKFANAZOG-UHFFFAOYSA-N 349.343 2.869 5 50 EFBA O=C(O)[C@@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4517263 HJQHTLAEPSKXQJ-CYBMUJFWSA-N 331.284 2.611 5 50 EFBA CCOc1ccc(S(=O)(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 241383345 MUONMGPLCBYYNH-UHFFFAOYSA-N 348.380 2.745 5 50 EFBA O=[N+]([O-])c1ncccc1OCc1cn2cc(Br)ccc2n1 131689151 NUHNQUIMAMZNQZ-UHFFFAOYSA-N 349.144 2.979 5 50 EFBA CNC(=O)c1cc(Cl)ccc1NC(=O)c1cccc([N+](=O)[O-])c1 472035 WIMPEFSORCIBBR-UHFFFAOYSA-N 333.731 2.860 5 50 EFBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccccc2F)C1 620557 NOPFOAFXNSGHKX-NSHDSACASA-N 343.314 2.726 5 50 EFBA Cc1nn([C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 6527473 WNFZWSKNQXUDJC-SFCYXTAJSA-N 332.404 2.746 5 50 EFBA Cc1ccc(C(=O)Nc2sc(C)c(C)c2C(N)=O)cc1[N+](=O)[O-] 460547 DBJGWPWESPUALU-UHFFFAOYSA-N 333.369 2.933 5 50 EFBA COc1ccc([C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c(O)c3)C2)cc1 156118318 GRIQNRCJBNONMJ-CQSZACIVSA-N 342.351 2.939 5 50 EFBA O=C(N[C@H](Cc1ccccc1)C(=O)O)OCc1ccc([N+](=O)[O-])cc1 3841507 RUKBCUZWCLRSJT-OAHLLOKOSA-N 344.323 2.517 5 50 EFBA O=[N+]([O-])c1ccccc1OCCN1CCN(C2CCCCC2)CC1 163010514 GORSALADZIBBEP-UHFFFAOYSA-N 333.432 2.924 5 50 EFBA CCOC(=O)[C@H](c1nc2ccccc2o1)c1ncccc1[N+](=O)[O-] 5326012 QZUDAUWSNMZZHB-ZDUSSCGKSA-N 327.296 2.826 5 50 EFBA COC(=O)c1c(N)sc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1C 2880897 BSKMIMMIUZSPKF-UHFFFAOYSA-N 335.341 2.586 5 50 EFBA CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCc3sccc3C2)s1 129107452 MZPCNHUSVDUALG-UHFFFAOYSA-N 344.439 2.684 5 50 EFBA CCOC(=O)CN(C(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 2029405 SNONAYCDZYLASS-UHFFFAOYSA-N 328.324 2.805 5 50 EFBA Cc1ccc(S(=O)(=O)NCCCNc2ccccc2[N+](=O)[O-])cc1 4703345 KRHBSWZDGMNRAV-UHFFFAOYSA-N 349.412 2.684 5 50 EFBA C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 176730951 AQRTXXBZISOOED-PIGZYNQJSA-N 346.362 2.760 5 50 EFBA O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCO2)CC1 170603455 LUDNXBICKHAVMS-KRWDZBQOSA-N 332.400 2.945 5 50 EFBA O=C(c1cccnc1)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 5104764 UOAVZUAUPCCDTN-UHFFFAOYSA-N 346.774 2.606 5 50 EFBA O=[N+]([O-])c1ccccc1N1CCN(C(=S)c2ccccc2O)CC1 4819315 DPHCDYHCYOAKNJ-UHFFFAOYSA-N 343.408 2.798 5 50 EFBA O=C(NC[C@H]1CCN(CC(F)F)C1)c1ccc(Cl)cc1[N+](=O)[O-] 1471488062 YVSWVEKAKLBIML-SECBINFHSA-N 347.749 2.565 5 50 EFBA CN1CCOc2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc21 150725789 VFGRHUTVFZBNCC-UHFFFAOYSA-N 331.303 2.815 5 50 EFBA NC(=O)c1cccc(CCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 192981244 DJNLHMSZFXHTPF-SFHVURJKSA-N 339.395 2.903 5 50 EFBA CC(C)[N+]1(C)[C@H]2CC[C@H]1CC(OC(=O)[C@@H](CO)c1ccccc1)C2 100089454 OEXHQOGQTVQTAT-YORIJRMUSA-N 332.464 2.854 5 50 EFBA investigational CC(C)CCO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 170618724 CMZJANBSGSNFJD-LLVKDONJSA-N 339.367 2.593 5 50 EFBA CCOc1ccc(-n2c(S)nnc2-c2ccncc2)c([N+](=O)[O-])c1 5511763 LUGUEJZTECNFNW-UHFFFAOYSA-N 343.368 2.925 5 50 EFBA Cc1nn([C@@H](C)c2nc3c4ccccc4ncn3n2)c(C)c1[N+](=O)[O-] 2806311 VKGGIIDFIQGXLD-NSHDSACASA-N 337.343 2.608 5 50 EFBA COc1cc(C(=O)n2cnc3ccccc32)c([N+](=O)[O-])cc1OC 102321 GCMYFZCGWWGXJW-UHFFFAOYSA-N 327.296 2.650 5 50 EFBA Cn1cc(C(=N)O)c([C@@H]2CCCN(c3ccccc3[N+](=O)[O-])C2)n1 328606508 RVZMXXFAQJVZAX-LLVKDONJSA-N 329.360 2.596 5 50 EFBA CC1=C(C(=O)OC2CCCC2)[C@@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4913549 JOCJVSAELAYKKM-CQSZACIVSA-N 344.367 2.958 5 50 EFBA COc1ccsc1S(=O)(=O)Nc1c(F)ccc([N+](=O)[O-])c1C 225708057 MWFWYYBITZMUTK-UHFFFAOYSA-N 346.361 2.913 5 50 EFBA