smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC1=NN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@](O)(C(F)(F)F)C1 6501129 KKOHKQKYICYIJT-GFCCVEGCSA-N 331.250 2.376 5 50 EEBA CCOc1cc2c(cc1NC(=O)Cn1ccc([N+](=O)[O-])n1)O[C@H](C)C2 131607844 KSAOQHSPXZXPIZ-SNVBAGLBSA-N 346.343 2.152 5 50 EEBA NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 247714535 MNPSFEMZUCGMAY-UDZFHETQSA-N 334.332 2.126 5 50 EEBA CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 121207 YNJQNZHJCLLYOD-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2CC1 100178914 RVKRGQRTAABIGB-CHPZLBCBSA-N 328.324 2.305 5 50 EEBA CC1=NN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@@](O)(C(F)(F)F)C1 6501131 KKOHKQKYICYIJT-LBPRGKRZSA-N 331.250 2.376 5 50 EEBA Cc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 226627708 FAJXRCJOTANMSV-BQGCOEIASA-N 328.324 2.126 5 50 EEBA O=C(c1ccc(NCc2ccco2)c([N+](=O)[O-])c1)N1CCOCC1 4998408 BXEZPUBHBCHENK-UHFFFAOYSA-N 331.328 2.272 5 50 EEBA Cc1ccc([C@@H]2CCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)s1 229349969 RMDHBJIHDZTSGC-KGLIPLIRSA-N 336.417 2.359 5 50 EEBA O=C(c1[nH]nc2c1CCCC2)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188512261 IWAWODUMUXXIQA-UHFFFAOYSA-N 342.355 2.100 5 50 EEBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccco2)CC1 5041814 CTSZONGYVCAJJF-UHFFFAOYSA-N 344.327 2.178 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(NC2CC(N3CCCCC3)C2)n1 343033906 KYEILBNVSAHQSC-UHFFFAOYSA-N 334.376 2.205 5 50 EEBA CN1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CC1 4842867 ZURCFIJRQHMFCW-UHFFFAOYSA-N 330.344 2.192 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1 151409323 BNJHWHBCUUMHPQ-UHFFFAOYSA-N 336.301 2.185 5 50 EEBA O=C1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccsc21 1386543 ULRXYRMMOAEAHL-SECBINFHSA-N 338.366 2.262 5 50 EEBA CCOC(=O)c1ccnc(NC[C@@H]2C[C@H]2c2ccnn2C)c1[N+](=O)[O-] 1775992336 YPGMOJRYHSAAOF-CMPLNLGQSA-N 345.359 2.116 5 50 EEBA O=C(NCC(F)F)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 174388473 HXZIWNWDJGWSFD-UHFFFAOYSA-N 329.303 2.413 5 50 EEBA O=C(NCc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4810626 IEDXREPNRRSIAQ-UHFFFAOYSA-N 341.367 2.361 5 50 EEBA O=C(O)[C@H]1CC=C(Cl)C[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O 4873559 QDVIDIGAHUWGSY-VHSXEESVSA-N 340.719 2.472 5 50 EEBA COC(=O)c1cc(C)nc(N2CC[C@H](c3ccccn3)C2)c1[N+](=O)[O-] 804685455 JZGPKRXMCSLHDS-LBPRGKRZSA-N 342.355 2.474 5 50 EEBA COc1cc2c(cc1OC)[C@H](c1ccc([N+](=O)[O-])cc1)NC(=O)C2 296304 FGIVLKMHBKJUGX-KRWDZBQOSA-N 328.324 2.374 5 50 EEBA CCN1CC[C@H](N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1 222332934 MCKKHZISIGPUOQ-JQWIXIFHSA-N 347.462 2.007 5 50 EEBA CN1CCN(c2ccc([N+](=O)[O-])c(Sc3nccn3C)c2)CC1 4846002 KGHNSHNCTKQPKX-UHFFFAOYSA-N 333.417 2.231 5 50 EEBA O=C1NCCCC[C@@H]1CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 225608206 QSYZMXVCXRMISR-CQSZACIVSA-N 345.399 2.392 5 50 EEBA CC1(C)C[C@]2(CCO1)OC(=O)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1 4872635 VUCQBYFAJRXTHE-GUYCJALGSA-N 348.355 2.424 5 50 EEBA C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 22309398 XFAHFRBDDMOVKQ-SJKOYZFVSA-N 342.351 2.482 5 50 EEBA Cc1noc([C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(C)C)n1 112028288 ILQHQJSEFXPJJV-CQSZACIVSA-N 334.332 2.179 5 50 EEBA O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCCC[C@H]1C1OCCO1 170620432 GOQZVNIFONOFMS-AWEZNQCLSA-N 345.355 2.444 5 50 EEBA CCO[C@@H]1C[C@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)[C@H]1OC 273938166 CWLAHBJLKLZCBP-WOSRLPQWSA-N 336.388 2.442 5 50 EEBA CC(=O)Nc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 6415501 OOGVQSFFHODXCE-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1OCC 619475 BNZDGZAUNSEZNI-AWEZNQCLSA-N 349.343 2.185 5 50 EEBA CCN(CC)C[C@@H](O)COc1cc([N+](=O)[O-])ccc1N1CCCC1 3880413 PSPJQQZDQZYLDC-OAHLLOKOSA-N 337.420 2.277 5 50 EEBA CCc1cc([N+](=O)[O-])c(N2CCCN(C(N)=O)CC2)cc1Cl 225819088 DAOIIJSQFKVEON-UHFFFAOYSA-N 326.784 2.401 5 50 EEBA O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N1CCCNCC1 4013683 LIMYOJCJMVMSQY-UHFFFAOYSA-N 334.254 2.322 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc(-c2ccncc2)n[nH]1 163196476 WVMFSCWAWKAZQH-UHFFFAOYSA-N 345.340 2.181 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@H]2[C@@H]1c1cccc([N+](=O)[O-])c1 19770502 JOSPDSUBUHTOLT-DLBZAZTESA-N 328.372 2.338 5 50 EEBA CC1(C)SC(=O)N(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 283566708 QDXABRQKBCOYOL-UHFFFAOYSA-N 337.357 2.397 5 50 EEBA CCCC(=O)N1CCCC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1 298976098 INNHLGLYOSRAJD-HNNXBMFYSA-N 333.388 2.392 5 50 EEBA C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](C2CCC2)C1 411873029 KUVKCSDRDGODFK-WBMJQRKESA-N 333.388 2.423 5 50 EEBA COc1ccc([C@@H]2SCCN2C(=O)CCC(=O)O)cc1[N+](=O)[O-] 431467 FOSKOJCEAQIESZ-AWEZNQCLSA-N 340.357 2.042 5 50 EEBA CCn1cc(CN(C)C(=O)COc2ccc([N+](=O)[O-])cc2)c(C)n1 1000034 HXGBQUKAHSRAJO-UHFFFAOYSA-N 332.360 2.157 5 50 EEBA C[C@@H]1CN(CC(F)(F)F)CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 456743207 POAIJTUAXVECMI-SECBINFHSA-N 335.282 2.144 5 50 EEBA Cc1nc(NC(=O)c2ccccc2[N+](=O)[O-])sc1C(=O)N(C)C 473374 CCAPEIFTEFWOTO-UHFFFAOYSA-N 334.357 2.314 5 50 EEBA O=[N+]([O-])c1ccc(CSc2nnc(Cn3cncn3)o2)cc1F 170605551 RUCVYRKYTQSZGY-UHFFFAOYSA-N 336.308 2.049 5 50 EEBA COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\NC(=O)NC2=O)o1 13546547 FLANMRDBWBBVOK-XFFZJAGNSA-N 329.268 2.044 5 50 EEBA COC(=O)Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 468498 SHDRUYROKJKCGL-UHFFFAOYSA-N 344.323 2.328 5 50 EEBA CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1 9122258 ZCZDWDNBTFPISA-UHFFFAOYSA-N 348.384 2.361 5 50 EEBA CC(C)C[C@@]1(C)CC(=O)N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O 137066697 BHNKGEJDIWNAMK-PBHICJAKSA-N 334.372 2.440 5 50 EEBA CO[C@@](F)(C(=O)Nc1ccc(C(=O)O)c([N+](=O)[O-])c1)C(F)(F)F 3672548 HMCFSWUZEGGRAW-JTQLQIEISA-N 340.185 2.106 5 50 EEBA CC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@@H]2C(C)=NN=C2C[C@]1(C)O 239331310 KLUFAIXBSGETEP-VQHPVUNQSA-N 329.356 2.485 5 50 EEBA O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCOC2(CCCCC2)C1 408519572 UPSHOMUUESZUOL-OAHLLOKOSA-N 334.372 2.190 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC[C@@H]2C(F)(F)F)cc1 408519067 WTOHPBLTKNLSSE-LLVKDONJSA-N 338.307 2.005 5 50 EEBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc1 5017144 SOSROGHMSDAWKN-UHFFFAOYSA-N 342.355 2.041 5 50 EEBA COc1ccccc1NS(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 4980350 UUKFPUUJDGXFAW-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA COC(=O)c1sccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 18024493 RTCLKJXXVVYWKW-UHFFFAOYSA-N 342.354 2.244 5 50 EEBA CCOC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1ccccc1[N+](=O)[O-] 71165 RINDIYDCUMSBJO-ZDUSSCGKSA-N 335.385 2.293 5 50 EEBA O=c1c2cc3c(=O)n(C4CC4)ccc3nc2ccn1-c1ccccn1 38829376 ZVCWWQMBBLVPON-UHFFFAOYSA-N 330.347 2.431 5 50 EEBA COCCN(C)C(=O)[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 229463453 DLKKNTKHRDYJKH-GOEBONIOSA-N 349.431 2.473 5 50 EEBA O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1O 152154262 YPUKSBKRLZGTRF-GLQYFDAESA-N 332.356 2.378 5 50 EEBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2C)[C@](O)(C(F)(F)F)C1 204566 VTQMLAYFVBKYFC-GFCCVEGCSA-N 331.250 2.376 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cc2ccncc2)cc1 4820878 AECWHQRHNNTGIA-UHFFFAOYSA-N 337.339 2.416 5 50 EEBA Cc1cc(N2C(=O)[C@@H]3[C@H]4C=C[C@@](C)(O4)[C@@H]3C2=O)c([N+](=O)[O-])cc1C 222240786 AIHLFYMHGAYKML-VWPFQQQWSA-N 328.324 2.045 5 50 EEBA COC(=O)c1ccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1 353905 OMJIOZNUDZYBMJ-UHFFFAOYSA-N 343.291 2.421 5 50 EEBA CNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccc(C)cc1 4949372 URLZNUJNZISNOV-WJDWOHSUSA-N 339.351 2.420 5 50 EEBA O=c1[nH]c(O)nc(/C=C/c2cccc(Br)c2)c1[N+](=O)[O-] 4838098 VJIPHIZKZCBWIF-SNAWJCMRSA-N 338.117 2.317 5 50 EEBA C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(O)c1 182408612 XVUGTLPWFCMIJE-IUODEOHRSA-N 332.356 2.391 5 50 EEBA CC(C)[C@@H]1C(=O)NCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 170623252 OMGQFRBWRXGNPF-CQSZACIVSA-N 347.396 2.406 5 50 EEBA Cc1nc(NC(=O)[C@@H]2CCCN2C(=O)C2CCCC2)ccc1[N+](=O)[O-] 133558756 DYVDJCCUKATWLF-AWEZNQCLSA-N 346.387 2.418 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@H]2[C@H]1c1cccc([N+](=O)[O-])c1 19770504 JOSPDSUBUHTOLT-IAGOWNOFSA-N 328.372 2.338 5 50 EEBA O=[N+]([O-])c1cccnc1NCc1nnc2n1CC[C@@H](C(F)(F)F)C2 952882091 RMUAATQZEOWHHL-MRVPVSSYSA-N 342.281 2.318 5 50 EEBA NCCCN(Cc1ccccc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 261543265 SHHJAJYVRPULCT-UHFFFAOYSA-N 349.412 2.135 5 50 EEBA O=[N+]([O-])c1cccc(NC(=S)NCCn2cc(Cl)cn2)c1 609747 DVTWKLKKNFZEKZ-UHFFFAOYSA-N 325.781 2.431 5 50 EEBA Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCNC(=O)[C@H]1CC(C)C 408521651 BVPDAGHYIQFGPY-CQSZACIVSA-N 337.351 2.029 5 50 EEBA O=C1c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2C(=O)N1CCCO 2939556 CFKSLSCNQRNFDW-UHFFFAOYSA-N 342.307 2.366 5 50 EEBA Cc1noc([C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(C)C)n1 112024291 JYYAHJVCIDXUHX-CQSZACIVSA-N 334.332 2.179 5 50 EEBA CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@H]1CN2CCC1CC2 347941081 GYMCYQWAKIEGJB-KRWDZBQOSA-N 342.399 2.102 5 50 EEBA CNc1ccc(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])cn1 253396532 CAXNJONUFVLZIO-UHFFFAOYSA-N 328.375 2.240 5 50 EEBA CN1[C@H]2CCC[C@H]1CC(NC(=O)CNc1ccccc1[N+](=O)[O-])C2 170000872 URJCHXCGLFBZBO-KBPBESRZSA-N 332.404 2.138 5 50 EEBA O=[N+]([O-])c1ccc2nc(NC[C@@H](O)CN3CCCCC3)ccc2c1 170642758 KKULUCJDWMBIBY-OAHLLOKOSA-N 330.388 2.402 5 50 EEBA Cc1c([N+](=O)[O-])ccnc1CS(=O)(=O)c1nc2ccccc2[nH]1 201609752 PDKDKUSPKCWWKS-UHFFFAOYSA-N 332.341 2.148 5 50 EEBA in-vitro CO[C@H](C)c1nsc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 240744046 HUEKDYWGQSFUQT-LLVKDONJSA-N 349.416 2.480 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 248662277 GQSCVNOYSOGNOA-KKUMJFAQSA-N 333.436 2.430 5 50 EEBA O=[N+]([O-])c1c(N[C@@H]2C[C@@H](O)[C@@H]2n2cccn2)ccc2ncccc12 952993173 DZYKQEYYZOKIBM-IIAWOOMASA-N 325.328 2.126 5 50 EEBA CC(C)(C)SCCNC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4461762 SITRWGOJABTOCX-UHFFFAOYSA-N 343.430 2.165 5 50 EEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC(CN2CCOCC2)C1 408518512 LGXOASZIRBEPNT-UHFFFAOYSA-N 345.321 2.382 5 50 EEBA CCOc1ccc(C)cc1S(=O)(=O)n1c([N+](=O)[O-])cnc1C 2325879097 HRERQZRRMVQBSD-UHFFFAOYSA-N 325.346 2.044 5 50 EEBA CC(C)OC[C@@H]1C[C@@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1 4132656 YMYGJWMPPJSIFG-FZMZJTMJSA-N 336.344 2.280 5 50 EEBA CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN2CCCC[C@@H]12 229726567 MLAUVZFDFBSZRY-ZBFHGGJFSA-N 332.404 2.017 5 50 EEBA Cc1ccc(C(=O)NC(=S)N2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 13153118 ODAFQOSBMYOKRP-PHIMTYICSA-N 337.401 2.027 5 50 EEBA C[C@@H]1CC(=O)N(Cc2ccc([N+](=O)[O-])cc2Br)C1=O 128122905 UPCZYLHWLLZIIO-SSDOTTSWSA-N 327.134 2.252 5 50 EEBA CCO[C@H]1C[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1(CC)CC 408515271 BVOQGKSYSDHYBP-RYUDHWBXSA-N 336.392 2.286 5 50 EEBA O=C(CSc1ccc([N+](=O)[O-])cn1)Nc1ccc2c(c1)OCCO2 38154876 BULYUVRRUHMFDE-UHFFFAOYSA-N 347.352 2.492 5 50 EEBA O=C1c2ccccc2S(=O)(=O)N1Sc1ccccc1[N+](=O)[O-] 120518 XTEABMFZLAEEKX-UHFFFAOYSA-N 336.350 2.447 5 50 EEBA Cn1c(=O)c2cn3c4ccccc4nc(C(F)(F)F)c3c2n(C)c1=O 117566 FIHPHWYLVGOLIR-UHFFFAOYSA-N 348.284 2.057 5 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50 EEBA COc1cccc(C2=CCN(c3ncc([N+](=O)[O-])cc3C(N)=O)C2)c1 241139489 JRJFIPUNLLBBRC-UHFFFAOYSA-N 340.339 2.001 5 50 EEBA COc1cc(C(=O)N=c2ccnc(C(C)(C)C)[nH]2)ccc1[N+](=O)[O-] 2325726469 CGOOCNVIYWAKSA-UHFFFAOYSA-N 330.344 2.365 5 50 EEBA CC(=O)c1ccc(NC[C@H](CO)Cc2cccnc2)c([N+](=O)[O-])c1 408524060 PRANOIVXZPGYDK-CQSZACIVSA-N 329.356 2.456 5 50 EEBA COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 2813034 WZMVJAPUMLXOKT-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ncc([N+](=O)[O-])s1)OC2=O 4820723 AANZMQGEJIZNKQ-OLZOCXBDSA-N 325.346 2.112 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3cc([N+](=O)[O-])ccc3Cl)C(=O)[C@H]12 244774200 PPMVVZMNIQGGOV-FJJYHAOUSA-N 334.715 2.081 5 50 EEBA C[N@+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@H]32)[C@@H]6[C@H]54 252441060 CTCZKABHVPGYMK-APEKOUARSA-N 349.454 2.237 5 50 EEBA Cc1ocnc1CN(C)[C@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 1775990205 WAORBMURERDFKY-ZDUSSCGKSA-N 344.371 2.238 5 50 EEBA 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O=C1NC(=O)[C@]2(CCC[C@@H]2CNc2ccc(Cl)cc2[N+](=O)[O-])N1 276239793 PFJGGOSSDCGRIA-XLKFXECMSA-N 338.751 2.038 5 50 EEBA O=C(O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2496520 VYCMYVCUJXPXID-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA CC[C@@H](C)n1c(=N)c(C(=O)OC)cc2c(=O)n3cccc(C)c3nc21 100662668 PAUZQXRMJQJHEF-LLVKDONJSA-N 340.383 2.195 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](c2ccccn2)C1 798479477 GQCYEUBBELYBAE-CYBMUJFWSA-N 347.396 2.476 5 50 EEBA O=[N+]([O-])c1cnn(C[C@H](O)CN(C2CC2)[C@H]2CCc3ccccc32)c1 240333710 FEWPZFYUOHIHOG-WMZOPIPTSA-N 342.399 2.304 5 50 EEBA CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 464222 XRGRYVGJDVRJPA-HBWSCVEGSA-N 332.356 2.410 5 50 EEBA COc1cc(C=O)ccc1OCC(=O)Nc1ccccc1[N+](=O)[O-] 5064024 OWAFLLRPNQOBMW-UHFFFAOYSA-N 330.296 2.433 5 50 EEBA COc1cccc(-n2c(C)nn(Cc3ccc([N+](=O)[O-])cc3)c2=O)c1 4072900 IYGWRXFMMHFTIE-UHFFFAOYSA-N 340.339 2.308 5 50 EEBA O=C1NCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 131917684 KGQXVZLWTZTYIQ-OAHLLOKOSA-N 340.339 2.300 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Nc2nccs2)CC1 189983021 HWMBNBJEWMCVSV-UHFFFAOYSA-N 347.400 2.350 5 50 EEBA CN1[C@H]2CC[C@H]1CN(c1c(Br)cncc1[N+](=O)[O-])CC2 252512165 NJTQKMYZRCZTIX-UWVGGRQHSA-N 341.209 2.425 5 50 EEBA O=c1[nH]c(/C=C/c2c(Cl)cccc2Cl)c([N+](=O)[O-])c(=O)[nH]1 9234696 ZFJCYZPRAKKZGC-SNAWJCMRSA-N 328.111 2.449 5 50 EEBA O=C(O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1C(=O)O 190183 JORJHHJDLMUUKH-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA COc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c([N+](=O)[O-])c1 101360038 AGGPMPNSBTYTCT-YIKOMLBNSA-N 340.335 2.305 5 50 EEBA Cc1cc([N+](=O)[O-])nn1CCCC(=O)NCc1nc2ccccc2[nH]1 4626189 HPTAVMIROYSVLR-UHFFFAOYSA-N 342.359 2.073 5 50 EEBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1[C@H]2C=C[C@@H]([C@H]3C[C@H]32)[C@H]1C(=O)O 217366778 UNMJLXNHSYJMRJ-CTTWBBHYSA-N 328.324 2.302 5 50 EEBA COCc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)s1 473960 MAOANKPCMYDCHW-UHFFFAOYSA-N 328.737 2.498 5 50 EEBA CC(C)(C)OC(=O)N1CCN(c2ncnc(Cl)c2[N+](=O)[O-])CC1 59268641 SIEVKGIBOLXNCK-UHFFFAOYSA-N 343.771 2.095 5 50 EEBA O=C(c1ccccc1)c1ccc(N[C@@]2(CO)CCOC2)c([N+](=O)[O-])c1 170594632 TVFQELLUCNBGGD-GOSISDBHSA-N 342.351 2.389 5 50 EEBA CCNc1ncc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)s1 190617918 ZPEIVLKEXBPMNV-UHFFFAOYSA-N 348.384 2.387 5 50 EEBA C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)N1CCOC[C@H]1C 239667963 BSIZUZYDXUWOHM-GHMZBOCLSA-N 341.795 2.087 5 50 EEBA O=C(NCCC1(O)CCC1)c1ccc([N+](=O)[O-])cc1Br 253422953 LKZMUUHCBCIXGV-UHFFFAOYSA-N 343.177 2.392 5 50 EEBA Cc1nc(N2CCN(Cc3cccc(F)c3)C(=O)C2)ccc1[N+](=O)[O-] 150908339 XGTIFHGQRGHYAW-UHFFFAOYSA-N 344.346 2.286 5 50 EEBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1 5090908 UYEPKSLAVILDDS-UHFFFAOYSA-N 336.325 2.167 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](c3ccccn3)C2)n1 804685901 NTJQLMNFIMAZBO-LLVKDONJSA-N 328.328 2.165 5 50 EEBA COC(=O)c1cccc([N+](=O)[O-])c1CS(=O)(=O)c1ccccc1 1385128 CWGQFYWENLTPMS-UHFFFAOYSA-N 335.337 2.355 5 50 EEBA Nn1ccc2nc3ccn(CCC4=CCCCC4)c(=O)c3cc2c1=O 40398680 BFHIPEUJFUEDTR-UHFFFAOYSA-N 336.395 2.316 5 50 EEBA COC(=O)c1ccc(N2CCN(c3ccccn3)CC2)c([N+](=O)[O-])c1 4054076 VLDAWEZMAKPDLA-UHFFFAOYSA-N 342.355 2.103 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@@H]2[C@H]1c1cccc([N+](=O)[O-])c1 19770503 JOSPDSUBUHTOLT-SJORKVTESA-N 328.372 2.338 5 50 EEBA CCn1cc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2C)cn1 2784306 FFEIOLSRKUJNEE-UHFFFAOYSA-N 333.373 2.246 5 50 EEBA O=C(O)c1cc(S(=O)(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c[nH]1 253393901 VJYWPTQOOCPLJS-UHFFFAOYSA-N 345.720 2.075 5 50 EEBA Cc1cc(N[C@H]2CCCN(c3cccnc3)C2=O)ncc1[N+](=O)[O-] 253426897 SKEASRNKULXXSC-ZDUSSCGKSA-N 327.344 2.301 5 50 EEBA Cc1ccc2c(c1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C(C)(C)C2 358872138 HKGLZJSETWZORY-UHFFFAOYSA-N 328.372 2.463 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nnc(C(F)(F)F)s1 337991584 XZYRUYUYYFHZEY-UHFFFAOYSA-N 332.263 3.026 5 50 EEBA Cc1nn(Cc2nc3c4c(C)c(C)sc4ncn3n2)cc1[N+](=O)[O-] 2808532 FSHZVFDPWIWXPL-UHFFFAOYSA-N 343.372 2.417 5 50 EEBA O=C(NCCc1cccc([N+](=O)[O-])c1)c1nn[nH]c1-c1ccccc1 241923315 UEYBGAOBJZHLJP-UHFFFAOYSA-N 337.339 2.352 5 50 EEBA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 226627693 FAJXRCJOTANMSV-WRFANHODSA-N 328.324 2.126 5 50 EEBA O=[N+]([O-])c1ccc2c(c1)[C@H](O)n1nc(-c3ccncc3)nc1S2 610851 YCIAUNOMFAQXEH-ZDUSSCGKSA-N 327.325 2.252 5 50 EEBA CCO[C@H]1C[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1(CC)CC 408515269 BVOQGKSYSDHYBP-NEPJUHHUSA-N 336.392 2.286 5 50 EEBA O=C(O)c1ccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])cc1 190200 OTYIAKCHJDTLEP-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA O=C1CCCCN1CC1CCN(c2cc(CO)ccc2[N+](=O)[O-])CC1 225595887 SNSKWKJKFJXJOJ-UHFFFAOYSA-N 347.415 2.316 5 50 EEBA COc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c([N+](=O)[O-])c1 101360035 AGGPMPNSBTYTCT-FKGLVLAHSA-N 340.335 2.305 5 50 EEBA CC[C@@H](C)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 5909277 GQYKDMFXDPLCNZ-SNVBAGLBSA-N 328.800 2.164 5 50 EEBA O=C(O)COc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 4480157 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O=[N+]([O-])c1ccc(N2CCNCC2)cc1NCCOc1ccccc1 4687393 CMOZNIKQPGDONT-UHFFFAOYSA-N 342.399 2.495 5 50 EEBA CCOC(=O)c1ccc(S(=O)(=O)Cc2ccc([N+](=O)[O-])o2)cc1 6350498 REJSZHHPUBTLGK-UHFFFAOYSA-N 339.325 2.338 5 50 EEBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CCO)CC1 421025301 YJHSHZXMXRFSTP-KGLIPLIRSA-N 335.404 2.406 5 50 EEBA CC(=O)c1ccc(N2CCC[C@@H](N3CCOCC3)C2)c([N+](=O)[O-])c1 382626620 IJIYSWVIHIUDHC-OAHLLOKOSA-N 333.388 2.098 5 50 EEBA CCOc1ccc(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c([N+](=O)[O-])c1 239403082 RMFAUPVCEYYWTE-NBLIUIFLSA-N 346.339 2.455 5 50 EEBA COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@H](C)c1nncn1C 225823744 NYXFUDMOQLCDFJ-JTQLQIEISA-N 333.348 2.034 5 50 EEBA O=[N+]([O-])c1cnc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)s1 249219102 FTIBDLUIVBILNA-STQMWFEESA-N 334.401 2.099 5 50 EEBA CN(CC(=O)N(C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1ccccc1[N+](=O)[O-] 252675510 UFUPENVUFDEGIC-CSMYWGQOSA-N 347.415 2.303 5 50 EEBA Cc1c(CC(=O)N2CCNC(=O)c3ccccc32)cccc1[N+](=O)[O-] 408514304 AVWRKZAXJDBYBE-UHFFFAOYSA-N 339.351 2.222 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)N2CCCC2)CC1 463850 OZJFOWIOHUPEBV-UHFFFAOYSA-N 331.372 2.069 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H](OCC3CC3)C2)cc1 328588366 OICLCEHJUBZXCA-AWEZNQCLSA-N 340.401 2.175 5 50 EEBA CS(=O)(=O)NC[C@H]1CCCN(c2cc(Cl)ccc2[N+](=O)[O-])C1 253415409 IIJYFOVCVSXHJO-SNVBAGLBSA-N 347.824 2.014 5 50 EEBA CCN1C=C(C(=O)OC)C(c2cccc([N+](=O)[O-])c2)C(C(=O)OC)=C1 469543 KEAMQFAAHACPJC-UHFFFAOYSA-N 346.339 2.128 5 50 EEBA C[C@H](Cc1ccccc1)NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4417007 JPCSCMDJYJDNET-LLVKDONJSA-N 345.380 2.265 5 50 EEBA CCCC[C@H]1NC(=O)N(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 225703407 XKOFWYCWZMVROQ-GFCCVEGCSA-N 348.359 2.034 5 50 EEBA CCC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](O)(c2ccncc2)C1 302272 OCEOMEMVDNGYEZ-QGZVFWFLSA-N 340.339 2.447 5 50 EEBA C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](C)N2CCc3ncc([N+](=O)[O-])cc3C2)C1 408149613 RFORAPMMUOHZAO-HZSPNIEDSA-N 346.431 2.241 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(NCC2(Br)CC2)n1 952964679 VQNSTNGVDFHRRI-UHFFFAOYSA-N 330.138 2.116 5 50 EEBA CC(C)(CNc1ccc([N+](=O)[O-])cc1Cl)CNS(C)(=O)=O 4558022 NGAQVSJGAFWSDS-UHFFFAOYSA-N 335.813 2.236 5 50 EEBA COC(=O)c1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 434784 AWUIAYXGWVAWJC-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA COc1cc(F)c(S(=O)(=O)Nc2c(C)noc2C)cc1[N+](=O)[O-] 253424622 INDGCBMASGEYME-UHFFFAOYSA-N 345.308 2.148 5 50 EEBA Nc1ccnc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 135108954 VBWPUCXOUURRQQ-UHFFFAOYSA-N 329.360 2.010 5 50 EEBA O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@H](O)c2ccccc2)c1 843086988 HPRRYPZLAKEKCR-AEFFLSMTSA-N 346.383 2.048 5 50 EEBA CCCc1[nH]nc(C(=O)N[C@H](C)c2n[nH]c([C@H](C)CC)n2)c1[N+](=O)[O-] 277967660 UTDSNWRCGKXBAU-RKDXNWHRSA-N 349.395 2.393 5 50 EEBA O=C1NC(=O)/C(=C\c2ccccc2OCc2cccc([N+](=O)[O-])c2)N1 72933 DECIZEFEOPAYHN-NTEUORMPSA-N 339.307 2.354 5 50 EEBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccn(Cc3ccccc3)n2)n1 374713 YEVIBJWQJLICSC-UHFFFAOYSA-N 340.343 2.308 5 50 EEBA Nc1ccc([N+](=O)[O-])c(NCc2cnc(N3CCOCC3)c(F)c2)c1 193500179 KUZYNQIEGIJWTO-UHFFFAOYSA-N 347.350 2.160 5 50 EEBA CC(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4188703 PXGQGLQGYKIEBC-UHFFFAOYSA-N 332.404 2.474 5 50 EEBA O=C(O)[C@@H]1CS[C@@H](c2cc([N+](=O)[O-])ccc2N2CCCCC2)N1 4623414 BMCJYTDGYNXUSC-JSGCOSHPSA-N 337.401 2.373 5 50 EEBA Cc1ccc(OCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 2893156 VKBASKIDMZTOMU-UHFFFAOYSA-N 336.369 2.261 5 50 EEBA O=C1NC(=O)[C@]2(CCC[C@H]2CNc2ccc(Cl)cc2[N+](=O)[O-])N1 276239787 PFJGGOSSDCGRIA-RMLUDKJBSA-N 338.751 2.038 5 50 EEBA Cc1ccc(C(=O)O)cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 180268 MMPWHQCZSMCNOT-UHFFFAOYSA-N 336.325 2.402 5 50 EEBA COc1ccc(NC(=O)CCC(=O)NCc2ccco2)c([N+](=O)[O-])c1 6690940 WXAKOXAGCJLQMA-UHFFFAOYSA-N 347.327 2.232 5 50 EEBA C[C@]12CCN(C[C@H](O)COc3cccc([N+](=O)[O-])c3)C[C@@H]1C2(F)F 428721065 SKUANFXGCPKYGJ-QEJZJMRPSA-N 342.342 2.312 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN(Cc2nc(C)c(C)o2)CC1 192563396 HEVHVYTZUIIDKG-UHFFFAOYSA-N 348.407 2.047 5 50 EEBA CCO[P@](=O)(O)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 3122146 JAUGLYAOKLBEGF-UHFFFAOYSA-N 344.138 2.369 5 50 EEBA O=C(O)CCCN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O 4558913 DZRBYGUTBDJMPG-UHFFFAOYSA-N 328.280 2.209 5 50 EEBA O=c1[nH]c(O)nc(/C=C/c2ccccc2Br)c1[N+](=O)[O-] 5050748 PYMMJVYURCHCQZ-AATRIKPKSA-N 338.117 2.317 5 50 EEBA C[C@@]12CC[C@@]3(C)OC[C@](COC(=O)c4ccc([N+](=O)[O-])cc4)(CO1)N23 245241541 INUNALBSOMANMB-BJWYYQGGSA-N 348.355 2.079 5 50 EEBA C[C@@H]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@@H](C)O1 412655518 OPNOSAYRQNNJNM-BZPMIXESSA-N 344.371 2.324 5 50 EEBA CN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 245444051 XSPOKHFBLGGCSL-HUUCEWRRSA-N 326.418 2.382 5 50 EEBA CCn1cc(CN2CCCN(c3cc(N)ccc3[N+](=O)[O-])CC2)cn1 193413457 QDWTZLQRIJQAEC-UHFFFAOYSA-N 344.419 2.106 5 50 EEBA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 226627702 FAJXRCJOTANMSV-DLTLXFJOSA-N 328.324 2.126 5 50 EEBA CCN(C[C@H](C)OC)c1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] 360237169 GKRQNRLEUORNGN-LBPRGKRZSA-N 346.387 2.421 5 50 EEBA O=c1c2cc3c(=O)n(C4CCCCC4)ccc3nc2ccn1CCO 38829242 HHEPTGMTAUXSDV-UHFFFAOYSA-N 339.395 2.209 5 50 EEBA COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 466803 RHHDLHUBRWASJA-GFCCVEGCSA-N 339.735 2.391 5 50 EEBA O=C(NCc1ccc([N+](=O)[O-])cc1)C1CCN(CC(F)(F)F)CC1 339260631 DHGSMEFDDDSZTA-UHFFFAOYSA-N 345.321 2.485 5 50 EEBA O=[N+]([O-])c1cc(S(=O)(=O)N2CCc3ccc(F)cc32)ccc1O 170600127 YEEXTQNJSYUHAL-UHFFFAOYSA-N 338.316 2.191 5 50 EEBA COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)c1 2752076 VMQOEJROHHTBSW-QWRGUYRKSA-N 348.359 2.247 5 50 EEBA Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-] 305631937 FZQZTDBXJVNAIK-BFHYXJOUSA-N 335.404 2.323 5 50 EEBA O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCCSCC1 253427358 MDPCKLRBXBKKRU-UHFFFAOYSA-N 335.389 2.120 5 50 EEBA CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C=O)CC1 14007318 PYEZKRCRVDWREL-UHFFFAOYSA-N 335.360 2.464 5 50 EEBA in-vitro Cc1cc(CNc2ccc([N+](=O)[O-])cc2F)ccc1S(N)(=O)=O 253426992 KGOGXCXKDXESSS-UHFFFAOYSA-N 339.348 2.302 5 50 EEBA O=C(Nc1ccc2c(c1)OCCO2)c1cc([N+](=O)[O-])cc2cn[nH]c12 1422062 ASXLRXIWYQEQKV-UHFFFAOYSA-N 340.295 2.495 5 50 EEBA CCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccccc1[N+](=O)[O-] 71171 RINDIYDCUMSBJO-CYBMUJFWSA-N 335.385 2.293 5 50 EEBA CCOC(=O)c1cc(-n2cccn2)c(-n2cccn2)cc1[N+](=O)[O-] 90470632 VGSVCOTZKCUFSO-UHFFFAOYSA-N 327.300 2.143 5 50 EEBA in-vitro O=[N+]([O-])c1ccc(S(=O)(=O)N2CCOCc3ccccc32)cc1 239722503 CCZLADSUGWBTFT-UHFFFAOYSA-N 334.353 2.320 5 50 EEBA Cc1cnc(N[C@@H](Cc2ccccc2)C(=O)N(C)C)c([N+](=O)[O-])c1 270192104 IAGUGFYVFOBZBN-AWEZNQCLSA-N 328.372 2.410 5 50 EEBA CCC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](O)(C(F)(F)F)C1 81429 HTKICTPSGNSXBV-LBPRGKRZSA-N 331.250 2.458 5 50 EEBA CC(C)NC(=O)/C(=C\c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1 4954711 LYRKYIMACQNZCD-GXDHUFHOSA-N 343.339 2.483 5 50 EEBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CCO)CC1 421025304 YJHSHZXMXRFSTP-UONOGXRCSA-N 335.404 2.406 5 50 EEBA CCN(CC)CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 2865595 XDGLZILHZRXYDU-UHFFFAOYSA-N 347.371 2.163 5 50 EEBA COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 1748787 CELJVGCWUGEGOT-UHFFFAOYSA-N 345.311 2.484 5 50 EEBA COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(F)c(C)c1 183830761 PPZMGDWHDSCHMW-ZDUSSCGKSA-N 336.275 2.279 5 50 EEBA CCC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@](O)(C(F)(F)F)C1 108266 MLMYUQKPABAGRO-CYBMUJFWSA-N 345.277 2.387 5 50 EEBA O=[N+]([O-])c1ccc(N2CCOC[C@@H]2C[C@H](O)c2ccccc2)nc1 153950196 SYBZUXYBSYSFPO-HOTGVXAUSA-N 329.356 2.319 5 50 EEBA O=C(O)[C@@H]1CC=C(Cl)C[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O 4873562 QDVIDIGAHUWGSY-NXEZZACHSA-N 340.719 2.472 5 50 EEBA CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1csc(CN)n1 237258063 VXXWVLRIYJRSMH-UHFFFAOYSA-N 340.792 2.436 5 50 EEBA C[N@+]12CC[C@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@@H](C[C@H]32)[C@@H]6[C@H]54 245225995 CTCZKABHVPGYMK-KWKFQVOUSA-N 349.454 2.237 5 50 EEBA CC(=O)Nc1ccc(CCNC(=O)c2cccc([N+](=O)[O-])c2O)cc1 132772380 WSDYIHAWVYZDMO-UHFFFAOYSA-N 343.339 2.231 5 50 EEBA Cc1cc(O)nc(N2CCC[C@H](Nc3nccc(C)c3[N+](=O)[O-])C2)n1 1333203770 NQLZXHBXWGIYDK-LBPRGKRZSA-N 344.375 2.183 5 50 EEBA CCCc1[nH]nc(C(=O)N[C@@H](C)c2n[nH]c([C@@H](C)CC)n2)c1[N+](=O)[O-] 277967657 UTDSNWRCGKXBAU-IUCAKERBSA-N 349.395 2.393 5 50 EEBA CC(=O)Nc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 183364 QYRPCOMMVNUBTD-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA CC(=O)[C@@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@@H]2C(C)=NN=C2C[C@]1(C)O 239432786 WLADKGWPKZATAW-VQHPVUNQSA-N 329.356 2.485 5 50 EEBA O=C(Cn1c(NCCO)nc2ccccc21)c1ccc([N+](=O)[O-])cc1 1822355 SDSZHYWMQMNLID-UHFFFAOYSA-N 340.339 2.232 5 50 EEBA O=C1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccsc21 1386542 ULRXYRMMOAEAHL-VIFPVBQESA-N 338.366 2.262 5 50 EEBA O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccc(Cl)cc1C(F)(F)F 2852396 BXDAKWCDOJFPEM-UHFFFAOYSA-N 349.656 2.497 5 50 EEBA Cc1nc(N2CCOCC2)nc(Nc2ccc(F)cc2)c1[N+](=O)[O-] 4143199 OLWFTPVIMUNDOB-UHFFFAOYSA-N 333.323 2.413 5 50 EEBA CN(C)CC[C@@H]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1455637997 YOVOZHAYLWDQQQ-GFCCVEGCSA-N 330.388 2.490 5 50 EEBA COc1cccc(NC2CCC(S(C)(=O)=O)CC2)c1[N+](=O)[O-] 185474964 FVDRHXUHJNUFSN-UHFFFAOYSA-N 328.390 2.371 5 50 EEBA Cc1nc(C2CCN(c3nc4ccccn4c3[N+](=O)[O-])CC2)n[nH]1 225537621 QKYRMDCOAPAGDA-UHFFFAOYSA-N 327.348 2.053 5 50 EEBA C[C@H](NC(=O)c1ccc2ncc(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 1875321294 CBLAHYSDGMGMEN-JTQLQIEISA-N 338.323 2.322 5 50 EEBA O=C(Nc1ccc([N+](=O)[O-])c(Br)c1)C1=COCCO1 182286920 FLIMKXAGZYNEKX-UHFFFAOYSA-N 329.106 2.184 5 50 EEBA Cn1c(SCCCN2CCCC2)nc2cc([N+](=O)[O-])ccc2c1=O 195038604 KZVORYALTNCUFZ-UHFFFAOYSA-N 348.428 2.420 5 50 EEBA CCOc1cc([N+](=O)[O-])c(OCC)cc1NC(=O)CSCCO 4952561 PQAAAMLGEBKOCH-UHFFFAOYSA-N 344.389 2.056 5 50 EEBA CC1(C)[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H]2CCO[C@H]21 230137528 JAOAPBAFICRHIK-RBSFLKMASA-N 333.388 2.250 5 50 EEBA CC[C@@H](CO)N1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 190222485 MSZLJTKUEKIGSI-HNNXBMFYSA-N 349.431 2.247 5 50 EEBA O=C(CCN1C(=O)c2ccccc2C1=O)Nc1ccc([N+](=O)[O-])cc1 3958754 MQYKIDQNFWQMLJ-UHFFFAOYSA-N 339.307 2.220 5 50 EEBA O=C(N[C@H]1CCN2CCCC[C@@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 229868272 YVOQNENHXLNBCJ-JSGCOSHPSA-N 328.372 2.433 5 50 EEBA C[C@@H](C(=O)O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 237508438 KVOQCMOUOJAZEO-VIFPVBQESA-N 347.293 2.209 5 50 EEBA COc1ccccc1CC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 170617948 JFZJKOFYTUCYMZ-UHFFFAOYSA-N 344.371 2.421 5 50 EEBA O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1CCOCC1 60555 ILDOPLATXMGJFH-UHFFFAOYSA-N 339.398 2.155 5 50 EEBA Cc1ccc([N+](=O)[O-])c(Sc2nnc(C3CCNCC3)n2C)n1 126630080 FJHIVJLKLUBTPN-UHFFFAOYSA-N 334.405 2.045 5 50 EEBA C[N@+]12CC[C@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@@H](C[C@H]32)[C@@H]6[C@@H]54 245225994 CTCZKABHVPGYMK-JKDAMYQDSA-N 349.454 2.237 5 50 EEBA COC(=O)C1(N(C)C(=O)c2cc([N+](=O)[O-])ccc2O)CCCCC1 272449982 VYUYLOUPTRIUCD-UHFFFAOYSA-N 336.344 2.248 5 50 EEBA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 466804 RHHDLHUBRWASJA-LBPRGKRZSA-N 339.735 2.391 5 50 EEBA COc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)cc1[N+](=O)[O-] 467085 QDBCXCKLEZLHTK-UHFFFAOYSA-N 330.296 2.483 5 50 EEBA C[C@H](c1ccccc1)[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(N)=O 794717241 KMFXNRCIMKLMJJ-BDJLRTHQSA-N 331.347 2.481 5 50 EEBA C[C@]12CCN(C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C[C@H]1C2(F)F 428721073 SKUANFXGCPKYGJ-YUELXQCFSA-N 342.342 2.312 5 50 EEBA COc1ccc(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-])c1 239309176 HFYNOSFWMNJZHB-MZUWNQQASA-N 340.335 2.161 5 50 EEBA O=C1[C@H](Nc2ncc([N+](=O)[O-])cn2)CCN1c1cccc(Cl)c1 302157720 NLVCPCQRWNFNOQ-GFCCVEGCSA-N 333.735 2.256 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)CCN(CCCO)C(C)C 1875280265 KWDBOCYXQYKWPF-UHFFFAOYSA-N 339.392 2.025 5 50 EEBA COc1ccc(C(=O)NC[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 118774 AYLLIWSLUCCHAV-GFCCVEGCSA-N 344.323 2.173 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2 101357941 JBCAMKLHDOHEPK-FKGLVLAHSA-N 340.335 2.305 5 50 EEBA O=C(O)[C@@H]1[C@H]2C=C[C@@H]([C@@H]3C[C@H]23)[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 245226383 UNMJLXNHSYJMRJ-PKCACUDHSA-N 328.324 2.302 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN=C1c1ccccc1 1875302989 QDFWUDVPESBWIC-UHFFFAOYSA-N 331.353 2.046 5 50 EEBA COC(=O)Cc1occ(C)c1C(=O)NCCc1ccccc1[N+](=O)[O-] 290905625 RYGBMJZYBHRKEG-UHFFFAOYSA-N 346.339 2.184 5 50 EEBA COc1cccc(C(=O)NCc2nc3ccccc3[nH]2)c1[N+](=O)[O-] 195325906 XXLCURJBMHQVPU-UHFFFAOYSA-N 326.312 2.410 5 50 EEBA CC(C)C[C@]1(C)CC(=O)N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O 137066655 BHNKGEJDIWNAMK-RHSMWYFYSA-N 334.372 2.440 5 50 EEBA CSc1cnc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1 253415449 UYTXZEVVXCNZIJ-UHFFFAOYSA-N 331.401 2.433 5 50 EEBA COC(=O)c1ccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])cc1 285200 NSXQCFGYPROXQU-UHFFFAOYSA-N 344.279 2.332 5 50 EEBA CCN1C(=O)N[C@H](c2ccc(OC)c([N+](=O)[O-])c2)C(C(=O)OC)=C1C 1074989 JKGMBVKWGOMWIM-CQSZACIVSA-N 349.343 2.137 5 50 EEBA O=C(Oc1cccc(N2C(=O)CCC2=O)c1)c1ccc([N+](=O)[O-])cc1 2912179 FEQQEZOAQUEGIQ-UHFFFAOYSA-N 340.291 2.467 5 50 EEBA Cc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)[nH]c(=O)c1C 14947942 CGYVDJOFAZUVFX-UHFFFAOYSA-N 334.357 2.026 5 50 EEBA CC(=O)c1cc(N2CCC[C@@H](c3nncn3C)C2)ccc1[N+](=O)[O-] 253415465 XIZTYQFLBLSTGX-GFCCVEGCSA-N 329.360 2.310 5 50 EEBA O=[N+]([O-])c1cccc(S(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)c1 1769043 NOILFIOPNUSERX-UHFFFAOYSA-N 326.261 2.475 5 50 EEBA CCOc1ccc(Nc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])cc1 5316875 VNBLMPPORJRWNG-UHFFFAOYSA-N 337.357 2.385 5 50 EEBA O=C(O)c1ccc(Sc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1 2484093 NBOVYESWDPHPIV-UHFFFAOYSA-N 343.324 2.420 5 50 EEBA O=[N+]([O-])c1cc(S(=O)(=O)NCc2cccnc2)ccc1Cl 4132063 OLACWFMJCBBUSM-UHFFFAOYSA-N 327.749 2.122 5 50 EEBA C[C@H](N)c1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 170684861 RDEFNOMANGBUCD-NSHDSACASA-N 335.385 2.093 5 50 EEBA Cc1c(CC(=O)NCc2cccc3c2OCO3)cccc1[N+](=O)[O-] 162488854 JHHBRTMGIHVDSG-UHFFFAOYSA-N 328.324 2.491 5 50 EEBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@](F)(c2cc(F)cc(F)c2)C1 328586930 ZGFBVMRSXVOWII-AWEZNQCLSA-N 340.261 2.307 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])c(C2CC2)n1)N1CCc2sccc2C1 185160731 IOWRLCRGOVBMTB-UHFFFAOYSA-N 332.385 2.315 5 50 EEBA CC(C)c1[nH]ncc1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 194313441 FYCWGESWILBLPI-UHFFFAOYSA-N 330.344 2.345 5 50 EEBA Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(Cc2nnn[nH]2)cc1 194843443 JHKPHXTYXHHHLA-UHFFFAOYSA-N 338.327 2.259 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@H](C)[C@H]1CCCO1 5041744 FYXQGRHDFNMIGI-BXKDBHETSA-N 325.390 2.457 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)C2CCCCC2)CC1 162851 YRTAKZRBMAHQOQ-UHFFFAOYSA-N 345.399 2.460 5 50 EEBA Cc1ccccc1Cn1ccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1 355148 VDBYEQMIEUMDEY-UHFFFAOYSA-N 340.343 2.134 5 50 EEBA C[C@@H]1O[C@H](C)C[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 412655519 OPNOSAYRQNNJNM-DYEKYZERSA-N 344.371 2.324 5 50 EEBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2C)[C@@](O)(C(F)(F)F)C1 204565 VTQMLAYFVBKYFC-LBPRGKRZSA-N 331.250 2.376 5 50 EEBA NC(=O)Cn1cc(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 160796398 BPQXSMDGQITAKQ-UHFFFAOYSA-N 329.238 2.039 5 50 EEBA COc1ccc(CONS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 81991257 MTVNGWUZKIOSEX-UHFFFAOYSA-N 338.341 2.014 5 50 EEBA in-vitro CN(CCn1cnnc1)c1cccc(Br)c1[N+](=O)[O-] 952994747 KFRZHBFOHGUBPB-UHFFFAOYSA-N 326.154 2.085 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCC[C@H]1c1nc[nH]n1 123015015 VEEBJVLJCKDLCO-LBPRGKRZSA-N 346.347 2.481 5 50 EEBA O=C(O)/C=C/c1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 243985 WSLSBRUFDZPPHF-RUDMXATFSA-N 348.336 2.493 5 50 EEBA O=C(NCc1cnc2n1CCC2)c1cc2cccc([N+](=O)[O-])c2[nH]1 1154931249 NGRLVPYTALKNHG-UHFFFAOYSA-N 325.328 2.149 5 50 EEBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 1466561 AZQXQDRWECMYFY-SNVBAGLBSA-N 339.307 2.218 5 50 EEBA Cc1cc(C(=O)Nc2ccc3c(c2)C(=O)NC3=O)ccc1[N+](=O)[O-] 2873771 BJIBAOFWIPHGOK-UHFFFAOYSA-N 325.280 2.039 5 50 EEBA Cc1cc(=O)n(C)c(=O)n1CCCCCOc1cccc([N+](=O)[O-])c1 2381333 HQJWXRQCQJFKLK-UHFFFAOYSA-N 347.371 2.013 5 50 EEBA CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])cc1 3898509 XZHRZLSZEGVTJG-UHFFFAOYSA-N 349.368 2.097 5 50 EEBA O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)NCc2ccccn2)c1 4851784 ROXCYWYUFODARU-UHFFFAOYSA-N 327.749 2.122 5 50 EEBA O=[N+]([O-])c1ccc([C@@H](O)CN2CCN(c3ccccc3)CC2)cc1 19782384 GTXQPKMVXFQXLR-SFHVURJKSA-N 327.384 2.450 5 50 EEBA CCN(C[C@@H]1CCCO1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 315019866 UATOTEMEFUTOGK-NSHDSACASA-N 348.808 2.438 5 50 EEBA CN(CCc1ccccc1[N+](=O)[O-])Cc1cc(=O)n2ccsc2n1 253417338 VKRAIVJSRPDKLD-UHFFFAOYSA-N 344.396 2.339 5 50 EEBA CN1CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 180647869 VFDJEPYWCJWZPN-UHFFFAOYSA-N 344.318 2.366 5 50 EEBA O=[N+]([O-])c1cc(F)c(F)cc1S(=O)(=O)NC[C@@H]1CCCS1 1775993589 GWQGUNFCYPYTBB-ZETCQYMHSA-N 338.357 2.047 5 50 EEBA COc1ccc([N+](=O)[O-])c(S(=O)(=O)c2ccc(Cl)cc2)n1 1046979 PRKWNRUVAZZHPH-UHFFFAOYSA-N 328.733 2.485 5 50 EEBA O=[N+]([O-])c1ccc(CCN2CCC(CN3CC[C@H](CO)C3)CC2)cc1 952993408 GWJIZOUWTRBGDN-SFHVURJKSA-N 347.459 2.164 5 50 EEBA O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CC(Cl)=CC[C@H]1C(=O)O 4480185 QDVIDIGAHUWGSY-ZJUUUORDSA-N 340.719 2.472 5 50 EEBA O=C(c1cc([N+](=O)[O-])cnc1O)N1CCO[C@H](c2cccc(F)c2)C1 171208247 MPQDTYRFSXRIOW-AWEZNQCLSA-N 347.302 2.048 5 50 EEBA COC(=O)c1c(C)nc(C)c2c(=O)[nH]c3cc(OC)c(OC)cc3c12 19134746 HCBYVASAEKFPRB-UHFFFAOYSA-N 342.351 2.497 5 50 EEBA biogenic,in-vitro O=C(CN1CCCCC1)NCCNc1ccc([N+](=O)[O-])cc1Cl 4834021 YZKSOIAQDZYRLM-UHFFFAOYSA-N 340.811 2.262 5 50 EEBA COC(=O)CN1C(=O)S/C(=C/C=C/c2ccccc2[N+](=O)[O-])C1=O 13546686 VCUIGJQHTOYFFB-RZYXTZOYSA-N 348.336 2.360 5 50 EEBA CC(=O)Nc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 262367 JVDDNXYZQMRGEL-UHFFFAOYSA-N 325.280 2.354 5 50 EEBA CC[C@@](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])(C(N)=O)C(C)C 180293915 AHINBWPUVRALNV-AWEZNQCLSA-N 327.768 2.268 5 50 EEBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O 245226939 TTWDOFDLWQILPA-GMKMDLSASA-N 340.335 2.161 5 50 EEBA C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nc2ccccc2s1 754704118 LGIOSHYQAKTZPH-CMPLNLGQSA-N 347.400 2.113 5 50 EEBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccn2)CC1 4845295 OTCQUPAXBIOTAP-UHFFFAOYSA-N 327.344 2.344 5 50 EEBA CCOC(=O)C(CCCOc1ccccc1[N+](=O)[O-])C(=O)OCC 4949218 XAHWCVAAUXRDSO-UHFFFAOYSA-N 339.344 2.496 5 50 EEBA Cc1ccc(Cc2nnc(NC(=O)c3n[nH]cc3[N+](=O)[O-])s2)cc1 154117113 UPSRVRPDQQKSQN-UHFFFAOYSA-N 344.356 2.321 5 50 EEBA CC(=O)c1ccc(N2CCC(CO)(NCC3CC3)CC2)c([N+](=O)[O-])c1 408523756 MZFVSHULOBBHGS-UHFFFAOYSA-N 347.415 2.128 5 50 EEBA COC(=O)c1cc(C(=O)NCCc2ccc(F)cc2)cc([N+](=O)[O-])c1 859852 DNJJNFHETNJFIY-UHFFFAOYSA-N 346.314 2.493 5 50 EEBA C[C@H](O)CNC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 126725934 ZNMYAWZWTJSITN-XQQFMLRXSA-N 335.404 2.188 5 50 EEBA CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)c1c(C)nn(C)c1C 170605090 PHRMIYYVLXQEFU-AWEZNQCLSA-N 331.376 2.408 5 50 EEBA Cn1cccc1[C@H]1COCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 221918138 SKCVWCDOOAYPHF-IAGOWNOFSA-N 331.372 2.040 5 50 EEBA O=C(N[C@H]1CCN(c2ccccn2)C1)c1cc(F)ccc1[N+](=O)[O-] 161408736 YUDUTTABRPHAKG-LBPRGKRZSA-N 330.319 2.138 5 50 EEBA O=C(Cn1cc(Br)c([N+](=O)[O-])n1)OCc1ccccc1 4821229 AEPPLHVFWBNOAY-UHFFFAOYSA-N 340.133 2.297 5 50 EEBA CC(=O)c1cc(N2CCN(C(=O)c3ccco3)CC2)ccc1[N+](=O)[O-] 253398756 XQTYABKTLLFDGG-UHFFFAOYSA-N 343.339 2.353 5 50 EEBA CNc1snc(C)c1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188544525 HYGNUKKYRYCLBE-UHFFFAOYSA-N 348.384 2.305 5 50 EEBA O=C(O)CN1C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2C1=O 435168 SLLXOHKJSZEKBU-UHFFFAOYSA-N 342.263 2.068 5 50 EEBA O=C(OCN1C(=O)c2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1 473124 GTMFSHSPLUQZGP-UHFFFAOYSA-N 326.264 2.005 5 50 EEBA O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1 4710393 LWMVTSYZEHUUAM-UHFFFAOYSA-N 347.396 2.106 5 50 EEBA Cc1c([N+](=O)[O-])cnn1CCC(=O)NC1C2CC3CC(C2)CC1C3 2793785 YMYGQDUXGXKMNI-UHFFFAOYSA-N 332.404 2.431 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1Cn1ccnc1 131894441 NAUCRHJPWKMZDF-MRXNPFEDSA-N 328.372 2.415 5 50 EEBA CNC(=O)N[C@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 952994295 OPTPGCLBSSLYME-NSHDSACASA-N 329.360 2.041 5 50 EEBA COC(=O)C1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 456483 QXHICYOLZNMNMZ-UHFFFAOYSA-N 326.736 2.273 5 50 EEBA COc1ccc(NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)cc1 3880401 PNXDIDRJVPEDOO-UHFFFAOYSA-N 333.325 2.164 5 50 EEBA O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@H](n2cccn2)C1 253392868 HRJSGYZDSUMFKZ-AWEZNQCLSA-N 343.387 2.457 5 50 EEBA O=C(COc1ccc(Cl)c(Cl)c1)Nn1cc([N+](=O)[O-])cn1 17067939 GQUMLAADJVSETH-UHFFFAOYSA-N 331.115 2.247 5 50 EEBA CC(=O)c1ccc(N2CCC[C@H](N3CCOCC3)C2)c([N+](=O)[O-])c1 382626619 IJIYSWVIHIUDHC-HNNXBMFYSA-N 333.388 2.098 5 50 EEBA CCN1CCN(C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1 4744488 MPLNMBPECGBKNB-UHFFFAOYSA-N 332.448 2.197 5 50 EEBA NC(=O)c1cccc(NC[C@H]2COC3(CCCCC3)O2)c1[N+](=O)[O-] 252509462 YOFYLZFOKNSYLV-NSHDSACASA-N 335.360 2.181 5 50 EEBA Cc1conc1CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] 1119616400 OFCXIDBDWPLHNE-UHFFFAOYSA-N 347.299 2.500 5 50 EEBA O=C(c1cc([N+](=O)[O-])cnc1O)N1CCO[C@@H](c2cccc(F)c2)C1 171208251 MPQDTYRFSXRIOW-CQSZACIVSA-N 347.302 2.048 5 50 EEBA CC[C@H]1CN(c2ccc([N+](=O)[O-])cn2)[C@H](CC)CN1CC(C)(C)O 252539887 OQAMNCASRFQGEC-UONOGXRCSA-N 336.436 2.440 5 50 EEBA Cc1ccc(Br)cc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 191087328 ZWPVEHURIHXFPN-UHFFFAOYSA-N 339.149 2.319 5 50 EEBA COc1ccc(S(=O)(=O)n2cnc3ccccc32)cc1[N+](=O)[O-] 448867 JGMFITXFGFCFAO-UHFFFAOYSA-N 333.325 2.190 5 50 EEBA CC(=O)NN1C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2C1=O 138754 JQIQVHLRWRTMQT-UHFFFAOYSA-N 341.279 2.034 5 50 EEBA COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 458095 AVOVJSBLLBKBRO-NSHDSACASA-N 325.708 2.049 5 50 EEBA COC(=O)c1cccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)c1 2864640 NYAFZSINZSIRGC-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA CCN(CC)C[C@H](O)COc1cc([N+](=O)[O-])ccc1N1CCCC1 3880412 PSPJQQZDQZYLDC-HNNXBMFYSA-N 337.420 2.277 5 50 EEBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1nccn1C(F)F 225534813 ZKXXVDBCCKKIJQ-UHFFFAOYSA-N 346.315 2.202 5 50 EEBA O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCN2CCCC[C@@H]12 229605195 DWEPEBQBGSTRRR-CABCVRRESA-N 332.404 2.140 5 50 EEBA Cc1nnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1C 7235104 LTYBDNCRJSINHX-UHFFFAOYSA-N 341.780 2.416 5 50 EEBA O=C(Cn1ccc([N+](=O)[O-])n1)N(Cc1ccsc1)c1cccnc1 171352644 LSEVVUNDAHVJFP-UHFFFAOYSA-N 343.368 2.481 5 50 EEBA CCCCOC(=O)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 2762591 GMEIUHZHNQBKLS-UHFFFAOYSA-N 346.343 2.387 5 50 EEBA CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1nccn1C1CC1 952890799 YUNCDHZZSGRATJ-NSHDSACASA-N 330.348 2.073 5 50 EEBA COc1cccc2c(NC(=O)Cn3cc([N+](=O)[O-])cn3)c(C)cnc12 408515015 HMMPPCPGOYRDHN-UHFFFAOYSA-N 341.327 2.295 5 50 EEBA CN(C)c1noc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 170601823 KKWPVQCRJKRHDT-QMMMGPOBSA-N 337.361 2.083 5 50 EEBA Cc1nn(CN2CC[C@H](c3nccn3C)C2)c2ccc([N+](=O)[O-])cc12 755791765 SFVSLARTPJNJRT-ZDUSSCGKSA-N 340.387 2.433 5 50 EEBA COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)c1 2752077 VMQOEJROHHTBSW-MNOVXSKESA-N 348.359 2.247 5 50 EEBA CCN1C(=O)[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 73293 IHLDSIVMYQDARA-GOSISDBHSA-N 340.335 2.422 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccc(Cl)cc3[N+](=O)[O-])C(=O)[C@@H]12 226627390 YSONTOHIUUJOAN-ZAZJYDDPSA-N 334.715 2.081 5 50 EEBA Cc1cc(=O)[nH]c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 4922815 BQWHEQWBSCOWOD-UHFFFAOYSA-N 334.357 2.026 5 50 EEBA C[C@H](NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)c1cncs1 170619746 HPFRBSBQJMTZAL-JTQLQIEISA-N 341.414 2.274 5 50 EEBA COCCn1ccnc1[C@@H]1N(c2ncc([N+](=O)[O-])c(C)n2)CC1(C)C 952895237 SJKUPSMXZFTEGT-ZDUSSCGKSA-N 346.391 2.124 5 50 EEBA O=[N+]([O-])c1c(N[C@H](CO)C[C@@H](O)c2ccccc2)nc2sccn12 269905260 GUKCTJWYDWZDKF-NWDGAFQWSA-N 348.384 2.201 5 50 EEBA CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 465554 JCKBOVJENNCERS-RNVIBTMRSA-N 332.356 2.410 5 50 EEBA O=C(CN1CCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] 5064172 SCBLYPSCLSZHPO-UHFFFAOYSA-N 328.166 2.392 5 50 EEBA C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nncn1C 194250589 QAYMXOJFHMJNCB-VIFPVBQESA-N 345.384 2.472 5 50 EEBA Cn1c(=O)c(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(O)c2ccccc21 100461616 JFMMOVIORVVWCQ-UHFFFAOYSA-N 339.307 2.405 5 50 EEBA CN1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccccc1 242047897 VQYMHDXOOQUUNH-SUMWQHHRSA-N 338.371 2.495 5 50 EEBA O=C(Cn1nccc1[N+](=O)[O-])N1CCC(Cc2ccccc2)CC1 299076118 XDPLTFQTKOEUEC-UHFFFAOYSA-N 328.372 2.273 5 50 EEBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccnn2-c2cccc(F)c2)n1 191714043 JWZJKOCNGGVIPP-UHFFFAOYSA-N 344.306 2.388 5 50 EEBA Cc1ccc(S(=O)(=O)Nc2ccnc3ccnn23)c(C)c1[N+](=O)[O-] 2325852611 MMXNTQGQHUFUEO-UHFFFAOYSA-N 347.356 2.055 5 50 EEBA O=C1C(=O)N(Cc2ccccc2[N+](=O)[O-])C(=O)N1Cc1ccccc1 4042261 NAMHXXWQFHBCFI-UHFFFAOYSA-N 339.307 2.086 5 50 EEBA O=[N+]([O-])c1c(N[C@@H]2C[C@H](O)[C@@H]2n2cccn2)ccc2ncccc12 952993175 DZYKQEYYZOKIBM-IJEWVQPXSA-N 325.328 2.126 5 50 EEBA CC(=O)Nc1cccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 267055 FQTGOHLUXCHMMS-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA CCN(CC)CCCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 4676238 HBIGFEIWSOFKCL-UHFFFAOYSA-N 339.392 2.074 5 50 EEBA O=C(CNC(=O)c1ccco1)OCc1ccc([N+](=O)[O-])cc1Cl 4832710 RBBHNHBESNYEAD-UHFFFAOYSA-N 338.703 2.314 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C12CC2 101357937 JBCAMKLHDOHEPK-FIXIBIHLSA-N 340.335 2.305 5 50 EEBA CC(C)C(=O)N[C@@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 225531646 XHVKPICSPUDXCV-SNVBAGLBSA-N 337.405 2.045 5 50 EEBA Cc1cc(N2CCC[C@@H](Nc3cc(N)ccc3[N+](=O)[O-])C2)n(C)n1 253396640 GMISKABCZJYYCL-CYBMUJFWSA-N 330.392 2.300 5 50 EEBA Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1Br 191727592 MLZOBCOOZMALBN-UHFFFAOYSA-N 339.149 2.319 5 50 EEBA Cc1n[nH]c(O)c1[C@H](c1ccc([N+](=O)[O-])s1)c1c(O)n[nH]c1C 19974124 SGGUFQYEMHJHMX-UHFFFAOYSA-N 335.345 2.311 5 50 EEBA Cc1nn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1ccc(F)cc1 1395232 FJIOVUPZJUAMNC-UHFFFAOYSA-N 328.303 2.438 5 50 EEBA CC(C)c1nc([C@H]2CCCCCN2c2ncc([N+](=O)[O-])c(N)n2)no1 374822684 SXHJXZRYVHRDFH-SNVBAGLBSA-N 347.379 2.595 5 50 EEBA Cn1cc(N2CC[C@@H](NCc3ccc(Cl)cc3[N+](=O)[O-])C2)cn1 1333684456 KEXORHTZFJJVSB-CYBMUJFWSA-N 335.795 2.350 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)OCc1ccccc12 189824873 RVHSMQYYXJEKAW-SFHVURJKSA-N 339.351 2.449 5 50 EEBA O=[N+]([O-])c1ccc(NCCCNS(=O)(=O)c2ccccc2)cc1 4561421 YSVVNZDXGKELPV-UHFFFAOYSA-N 335.385 2.375 5 50 EEBA CS(=O)(=O)c1cccnc1CNc1ccc([N+](=O)[O-])cc1F 362838230 DKOWFILLCMXXHR-UHFFFAOYSA-N 325.321 2.145 5 50 EEBA CCOc1ccc2nc(NC(=O)Cn3cc([N+](=O)[O-])cn3)sc2c1 371777 XTTACLUYHJECBN-UHFFFAOYSA-N 347.356 2.438 5 50 EEBA O=[N+]([O-])c1cnc(Br)c(I)c1 35270273 MWNBICGZLNMEBT-UHFFFAOYSA-N 328.891 2.357 5 50 EEBA in-vitro CC(C)C(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@]1(O)C(F)(F)F 108429 SFURRAREFXBMRG-ZDUSSCGKSA-N 345.277 2.438 5 50 EEBA Cc1cc([N+](=O)[O-])nn1CCCC(=O)Nc1ccc2c(c1)OCO2 3896246 ADBCVYAPBJDIAI-UHFFFAOYSA-N 332.316 2.247 5 50 EEBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(O)(C(F)(F)F)CC1 225562696 DOCGMHXXNCDNQG-UHFFFAOYSA-N 332.278 2.433 5 50 EEBA Cc1c(NC(=O)[C@H](C)N2CCC[C@H]([C@H](C)O)C2)cccc1[N+](=O)[O-] 305631939 FZQZTDBXJVNAIK-IHRRRGAJSA-N 335.404 2.323 5 50 EEBA C[N@+]12CC[C@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@@H](C[C@H]32)[C@H]6[C@@H]54 245225996 CTCZKABHVPGYMK-LSLAXJBGSA-N 349.454 2.237 5 50 EEBA COC(=O)c1ccccc1Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 241401089 NBCITOIXYBCSOC-UHFFFAOYSA-N 328.280 2.338 5 50 EEBA CCNc1nc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cs1 253421474 WGWVSHMGKHOABB-UHFFFAOYSA-N 348.384 2.387 5 50 EEBA CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCCCCC1 4844526 MCHBCECZCAMTQK-UHFFFAOYSA-N 327.406 2.226 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3cc([N+](=O)[O-])ccc3Cl)C(=O)[C@@H]12 222257237 PPMVVZMNIQGGOV-ZAZJYDDPSA-N 334.715 2.081 5 50 EEBA O=C(NC1CCCCC1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 5064899 YBPUXGDJQRCOMF-UHFFFAOYSA-N 333.388 2.494 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)NCCN1CCCCC1 4749075 ZHOAGHVCAJPDJV-UHFFFAOYSA-N 338.433 2.376 5 50 EEBA CO[C@](F)(C(=O)Nc1cc(C(=O)O)cc([N+](=O)[O-])c1)C(F)(F)F 3672556 FDKIODRYNDNSCK-SNVBAGLBSA-N 340.185 2.106 5 50 EEBA Cc1nn(C)c(Nc2ccc(CCN3CCOCC3)cc2)c1[N+](=O)[O-] 265110710 HNMMJUYUIVRAQY-UHFFFAOYSA-N 345.403 2.255 5 50 EEBA CCC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](O)(c2ccncc2)C1 302265 OCEOMEMVDNGYEZ-KRWDZBQOSA-N 340.339 2.447 5 50 EEBA O=C(NCc1ccncc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 4757775 OJCDVGMVRNQJCF-UHFFFAOYSA-N 325.280 2.026 5 50 EEBA C[C@H](O)CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 126726146 ZNMYAWZWTJSITN-AVGNSLFASA-N 335.404 2.188 5 50 EEBA COc1ccc(S(=O)(=O)n2cnc3cc([N+](=O)[O-])ccc32)cc1 4156105 YJSSLFUJPHKCCC-UHFFFAOYSA-N 333.325 2.190 5 50 EEBA O=[N+]([O-])c1c(Cl)ccc2sc(N3C[C@@H]4OCCO[C@@H]4C3)nc12 1875320420 CHOSKBNDOFMBBN-DTORHVGOSA-N 341.776 2.462 5 50 EEBA CN(C)CC(=O)NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4706714 YXDZVZYXXDUSMY-UHFFFAOYSA-N 348.325 2.093 5 50 EEBA COc1ccccc1CNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4946171 WFPHNNCPIFAADD-UHFFFAOYSA-N 336.369 2.390 5 50 EEBA Cc1nn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1ccccc1F 4088834 RCQDSUXAXLIJSS-UHFFFAOYSA-N 328.303 2.438 5 50 EEBA O=C(NCCCN1CCCC1=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 17071313 JLBNGHMBDVWTJG-UHFFFAOYSA-N 340.767 2.382 5 50 EEBA O=C1NC(=O)[C@@]2(CCC[C@@H]2CNc2ccc(Cl)cc2[N+](=O)[O-])N1 276239783 PFJGGOSSDCGRIA-CLAHSXSESA-N 338.751 2.038 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCN2CCOc3cccc1c32 253420832 MPLJWDVTIYMFOI-UHFFFAOYSA-N 340.339 2.036 5 50 EEBA COC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(O)c([N+](=O)[O-])c1 1772572594 PAPITQINKKNTDB-LLVKDONJSA-N 326.305 2.039 5 50 EEBA Cc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] 85346 FDGRTGMXKWYHQA-QGZVFWFLSA-N 326.308 2.316 5 50 EEBA COc1ccc(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-])c1 195373210 HFYNOSFWMNJZHB-XOSVDHCLSA-N 340.335 2.161 5 50 EEBA Cc1nc(N2CCOCC2)nc(NCc2ccccc2)c1[N+](=O)[O-] 4170760 AQDBQEAYEZASET-UHFFFAOYSA-N 329.360 2.142 5 50 EEBA COc1ccccc1OC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4743332 NOYAEGUGWRTKSL-UHFFFAOYSA-N 334.309 2.131 5 50 EEBA COc1ccc(N[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 100815263 LMCFSCLXZHFKSH-OAHLLOKOSA-N 341.323 2.347 5 50 EEBA Cc1nn(C)c(N2CCC[C@H](c3noc(C4CC4)n3)C2)c1[N+](=O)[O-] 253429555 SWJVRMNUKRSZEB-NSHDSACASA-N 332.364 2.281 5 50 EEBA COc1ccc(CN[C@H]2COc3ccccc3[C@@H]2O)cc1[N+](=O)[O-] 288540057 KURSSSPCADETKR-GUYCJALGSA-N 330.340 2.188 5 50 EEBA Cc1c(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cnn1-c1ccccn1 183918279 HLMAITQPJKMEJC-UHFFFAOYSA-N 339.311 2.442 5 50 EEBA COc1ccc(N[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 2873805 LMCFSCLXZHFKSH-HNNXBMFYSA-N 341.323 2.347 5 50 EEBA COc1cc(C(=O)Nc2cnns2)c([N+](=O)[O-])cc1OC(F)F 170603843 KKCXWSVDNXBFBU-UHFFFAOYSA-N 346.271 2.309 5 50 EEBA CCOC(=O)c1cnc(SCc2cccc([N+](=O)[O-])c2)nc1N 538794 SIVSCHNCYOFLLS-UHFFFAOYSA-N 334.357 2.436 5 50 EEBA Cc1sc2ncn3nc(CCn4cc([N+](=O)[O-])cn4)nc3c2c1C 2808472 LGESKVOHSGAURB-UHFFFAOYSA-N 343.372 2.303 5 50 EEBA Cc1cc([C@H]2CCCN2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)on1 339007298 GDHMDWFJFYIYAO-GDBMZVCRSA-N 347.371 2.468 5 50 EEBA Cn1ccnc1N1CCC(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 170613077 VAGZLMRJLGTEDW-UHFFFAOYSA-N 346.347 2.317 5 50 EEBA C[C@@H]1CC[C@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C(=O)O)C(=O)[C@H]2C1 239025599 BWIBNESTAZDYGU-UISBYWKRSA-N 332.312 2.219 5 50 EEBA C[C@H](C(=O)NCCc1c[nH]c2ccccc12)n1cc([N+](=O)[O-])cn1 1432076 BWDNPELAPIXUAY-LLVKDONJSA-N 327.344 2.193 5 50 EEBA Cc1ccccc1C1(CNc2ncc([N+](=O)[O-])c(N)n2)CCOCC1 170592788 KCBGMRMSSIOYOV-UHFFFAOYSA-N 343.387 2.436 5 50 EEBA Cc1cccc(N2CCN(C(=O)c3ccncc3)CC2)c1[N+](=O)[O-] 170602848 NSXJSEDOFZNJPE-UHFFFAOYSA-N 326.356 2.261 5 50 EEBA O=[N+]([O-])c1ccc(N2CCOC[C@H]2C[C@@H](O)c2ccccc2)nc1 153949900 SYBZUXYBSYSFPO-HZPDHXFCSA-N 329.356 2.319 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccccc1-c1nc[nH]n1 372323342 DPTROMHALWTDLT-UHFFFAOYSA-N 345.340 2.181 5 50 EEBA C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(O)c1 182408575 XVUGTLPWFCMIJE-DOMZBBRYSA-N 332.356 2.391 5 50 EEBA NCC[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 170621025 DWGVOGLUVBTXTI-LBPRGKRZSA-N 347.396 2.236 5 50 EEBA O=c1[nH]c(O)nc(/C=C/c2ccc(Br)cc2)c1[N+](=O)[O-] 4257614 FLYDOPKYLNIQNZ-ZZXKWVIFSA-N 338.117 2.317 5 50 EEBA COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)cc(C(=O)OC)c1 183139 BQLKSUUIGAYUOB-UHFFFAOYSA-N 348.267 2.013 5 50 EEBA O=Cc1ccccc1OC(=O)C[S@@](=O)c1ccccc1[N+](=O)[O-] 5014259 FKQHKNVXTRHPCA-QHCPKHFHSA-N 333.321 2.121 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 454305 FNHJISBGJCAHMH-KRWDZBQOSA-N 326.308 2.032 5 50 EEBA O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1O 152154441 YPUKSBKRLZGTRF-DFBGVHRSSA-N 332.356 2.378 5 50 EEBA CCCCn1ccc2nc3ccn(-c4ccn[nH]4)c(=O)c3cc2c1=O 40399037 RIZWUBBHBFLRII-UHFFFAOYSA-N 335.367 2.224 5 50 EEBA COc1ccccc1N1CC[C@@H](n2nc(C)c([N+](=O)[O-])c2C)C1=O 150992234 CMEUGYTXOBOEGC-CYBMUJFWSA-N 330.344 2.395 5 50 EEBA CC(=O)c1cc([N+](=O)[O-])ccc1NCCNC(=O)c1cccnc1 241231273 KTLXIESXACORRT-UHFFFAOYSA-N 328.328 2.034 5 50 EEBA Cc1cc(C(=O)N2CCC(c3cnn(C)c3)CC2)c(N)c([N+](=O)[O-])c1 131860485 CNYXYIJFUUZKPX-UHFFFAOYSA-N 343.387 2.239 5 50 EEBA Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 2788086 FGUMZOZCGWQGCL-SNVBAGLBSA-N 346.343 2.146 5 50 EEBA CCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccccc1[N+](=O)[O-] 132722 YTJOKCARKQSHOJ-CYBMUJFWSA-N 329.316 2.038 5 50 EEBA O=C(CSc1ccc([N+](=O)[O-])cn1)Nc1ccc2c(c1)OCO2 807540 BEMLFJDBYHRMFS-UHFFFAOYSA-N 333.325 2.449 5 50 EEBA COC(=O)c1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 2678785 CITSVVNYXWOPFL-UHFFFAOYSA-N 337.309 2.149 5 50 EEBA O=C(C[C@H](NC1CCCCC1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280088 PSGQMESPGAZUFV-AWEZNQCLSA-N 335.360 2.299 5 50 EEBA Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1C1CC1 7235585 FDZWYWNMIGPPER-UHFFFAOYSA-N 333.373 2.332 5 50 EEBA CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1 190107652 CHWXWRVGMBSIGM-GJZGRUSLSA-N 344.371 2.461 5 50 EEBA COc1cccc(NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c1 4360457 DFCRBYSNWULNPV-UHFFFAOYSA-N 333.325 2.164 5 50 EEBA O=C1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])cnc3O)ccc2N1 365663635 WSAPUYCLGBXZTG-UHFFFAOYSA-N 342.311 2.223 5 50 EEBA O=C(CC(=O)Nc1ccccc1[N+](=O)[O-])Nc1ccccc1[N+](=O)[O-] 3885946 AESMHZVRTXLXHT-UHFFFAOYSA-N 344.283 2.470 5 50 EEBA N[C@H](Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1)C(=O)O 4543604 OHFDOVYRFJQGIR-GFCCVEGCSA-N 347.283 2.250 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1N=C(C(F)F)C[C@]1(O)C(F)F 8378773 HGUYJQBRCXGIBZ-LBPRGKRZSA-N 335.213 2.016 5 50 EEBA CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cnc(C(=O)O)cn1 263256618 IPVIECIKMASFOB-UHFFFAOYSA-N 344.327 2.134 5 50 EEBA O=C1[C@@H](Nc2ncc([N+](=O)[O-])cn2)CCN1c1cccc(Cl)c1 302157722 NLVCPCQRWNFNOQ-LBPRGKRZSA-N 333.735 2.256 5 50 EEBA CN(C)c1cc(C(=O)Nc2c([N+](=O)[O-])cnn2C)c2ccccc2n1 191675971 IVFZTLIMCYGOFR-UHFFFAOYSA-N 340.343 2.195 5 50 EEBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cc(C(=O)O)cc(C(=O)O)c1 5061473 HFIBIZVVYJMFLL-UHFFFAOYSA-N 344.279 2.172 5 50 EEBA CC(C)[C@H]1C(=O)NCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 170623253 OMGQFRBWRXGNPF-AWEZNQCLSA-N 347.396 2.406 5 50 EEBA Cc1nn(CN2CC[C@@H](c3nccn3C)C2)c2ccc([N+](=O)[O-])cc12 755791764 SFVSLARTPJNJRT-CYBMUJFWSA-N 340.387 2.433 5 50 EEBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H](c2ccon2)C1 1775986749 YBDQDGOWKKKCPS-SECBINFHSA-N 327.300 2.089 5 50 EEBA O=C(c1nsnc1-c1cc([N+](=O)[O-])ccc1O)N1CCCCC1 22780192 KUZJKDNCIFKPJZ-UHFFFAOYSA-N 334.357 2.445 5 50 EEBA Cn1cc([C@@H]2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cn1 116320328 MHYMCPIFCODIKO-GFCCVEGCSA-N 344.371 2.184 5 50 EEBA O=C(O)[C@H]1CS[C@@H](c2cc([N+](=O)[O-])ccc2N2CCCCC2)N1 4623417 BMCJYTDGYNXUSC-OCCSQVGLSA-N 337.401 2.373 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1N=C(C(F)F)C[C@@]1(O)C(F)F 8378772 HGUYJQBRCXGIBZ-GFCCVEGCSA-N 335.213 2.016 5 50 EEBA COC(=O)C1=C(C)NC(C)=C(C(=O)O)[C@@H]1c1cccc([N+](=O)[O-])c1 19314834 JPXPPUOCSLMCHK-AWEZNQCLSA-N 332.312 2.087 5 50 EEBA in-vitro COc1cc2c(cc1OC)[C@@H](c1ccc([N+](=O)[O-])cc1)NC(=O)C2 296301 FGIVLKMHBKJUGX-QGZVFWFLSA-N 328.324 2.374 5 50 EEBA Cc1cc(C)nc(SCC(=O)Nc2ncc([N+](=O)[O-])s2)n1 4535316 LCRBXYLVNUCIFC-UHFFFAOYSA-N 325.375 2.189 5 50 EEBA COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] 73298 GNPNGWZQAZSCDK-QGZVFWFLSA-N 342.307 2.016 5 50 EEBA CC(C)OC(=O)CSc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 318328 YMHKTIZOQRTPBT-UHFFFAOYSA-N 333.387 2.042 5 50 EEBA Cc1n[nH]c(O)c1[C@H](c1cccc([N+](=O)[O-])c1)c1c(O)n[nH]c1C 18208032 SYLHPKOWECLFTH-UHFFFAOYSA-N 329.316 2.249 5 50 EEBA Cn1cc(C[C@@H](CO)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 408524016 PKFXIDOHAULSCQ-NSHDSACASA-N 344.293 2.363 5 50 EEBA COC(=O)c1cc(C)nc(N2CCC[C@H](c3cn[nH]c3)C2)c1[N+](=O)[O-] 1775984720 GUKJECORWARFIF-NSHDSACASA-N 345.359 2.192 5 50 EEBA Cc1cc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1[N+](=O)[O-] 614982 KBIJSKNKOCJDIE-UHFFFAOYSA-N 343.339 2.094 5 50 EEBA O=C(NN1CCOCC1)c1sc2cc([N+](=O)[O-])ccc2c1Cl 1054969 HFBOKIAATPEZFQ-UHFFFAOYSA-N 341.776 2.440 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCc3ncsc3C2)n1 952876853 GPYTUDUIGBVOSC-QMMMGPOBSA-N 334.357 2.202 5 50 EEBA COC(=O)[C@]1(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCSC1 270744595 HYJKRANQJGGVQS-ZDUSSCGKSA-N 344.776 2.027 5 50 EEBA COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)c1 2752074 VMQOEJROHHTBSW-WDEREUQCSA-N 348.359 2.247 5 50 EEBA Cc1cc(NCc2ccc(S(N)(=O)=O)c(C)c2)ccc1[N+](=O)[O-] 408514768 BKIYDJLQDFXXMZ-UHFFFAOYSA-N 335.385 2.471 5 50 EEBA Cc1cc([C@@H]2CCCN2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)on1 339007299 GDHMDWFJFYIYAO-ZBFHGGJFSA-N 347.371 2.468 5 50 EEBA O=C(c1cccc([N+](=O)[O-])c1)N1N=C(C2CC2)C[C@@]1(O)C(F)(F)F 1012085 OBNZAMPCRCFFGN-CYBMUJFWSA-N 343.261 2.458 5 50 EEBA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)cc1[N+](=O)[O-] 230318427 MAVQGQJZTWZOMB-WRFANHODSA-N 328.324 2.126 5 50 EEBA O=C(COc1ccccc1)NC(=S)Nc1ccccc1[N+](=O)[O-] 3880678 BETZECOXTPTEJW-UHFFFAOYSA-N 331.353 2.487 5 50 EEBA Cc1c(NC(=O)[C@H](C)N2CC[C@H](n3cccn3)C2)cccc1[N+](=O)[O-] 291756866 KXVWGLGYSCXOCE-KBPBESRZSA-N 343.387 2.374 5 50 EEBA O=c1cccc2n1C[C@H]1C[C@H]2CN(Cc2cc(O)ccc2[N+](=O)[O-])C1 100572800 URCLCEZHBLLIDA-STQMWFEESA-N 341.367 2.081 5 50 EEBA Cc1cc(N2CCC[C@H](Nc3cc(N)ccc3[N+](=O)[O-])C2)n(C)n1 253396647 GMISKABCZJYYCL-ZDUSSCGKSA-N 330.392 2.300 5 50 EEBA COC(=O)c1cnccc1NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 241707114 QMSRNJUGJMHSRI-UHFFFAOYSA-N 331.284 2.037 5 50 EEBA C[C@H](Cn1ncc2ccccc2c1=O)Nc1ncc([N+](=O)[O-])s1 192516178 IWFHETGCHNEUOV-SECBINFHSA-N 331.357 2.262 5 50 EEBA COc1ccc(S(=O)(=O)Nc2cc(OC)cc([N+](=O)[O-])c2)cc1 371386 HNLCXBCBRQRILA-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA NC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc([N+](=O)[O-])c(F)c1 253420770 LOKCVSVTNYGGRH-INIZCTEOSA-N 329.331 2.146 5 50 EEBA CCO[C@@H]1C[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1(CC)CC 408515272 BVOQGKSYSDHYBP-VXGBXAGGSA-N 336.392 2.286 5 50 EEBA Cc1nn(C)c(N2CCC[C@@H](Oc3ncccc3F)C2)c1[N+](=O)[O-] 278747491 MHKZMCQZBREQPT-LLVKDONJSA-N 335.339 2.219 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 5013531 JYBAVVMAJUBJSJ-KRWDZBQOSA-N 344.298 2.171 5 50 EEBA O=C(CCCn1cc([N+](=O)[O-])cn1)NCCc1c[nH]c2ccccc12 1432171 VQTGBCBBIVCZJA-UHFFFAOYSA-N 341.371 2.412 5 50 EEBA O=C(N1C[C@H]2C[C@@H](C1)c1cc([N+](=O)[O-])c([N+](=O)[O-])cc12)C(F)(F)F 34433610 BDTXJBWOCIFUMR-KNVOCYPGSA-N 345.233 2.478 5 50 EEBA in-vitro Cc1nscc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 170072903 DJQHMJXGDWJIRO-UHFFFAOYSA-N 330.329 2.397 5 50 EEBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C[C@@H](C)OC)C(C)C 354571103 DOSSUYIVAKJMQQ-LLVKDONJSA-N 346.405 2.037 5 50 EEBA C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nc2ccccc2s1 754704119 LGIOSHYQAKTZPH-JQWIXIFHSA-N 347.400 2.113 5 50 EEBA O=C(NC1CCCCC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4895897 IYOKKTVCHJCDDB-UHFFFAOYSA-N 333.388 2.494 5 50 EEBA Cc1cnc(OCC(=O)N2CCc3sccc3C2)c([N+](=O)[O-])c1 176708589 ZCFVIFQWSRHMRJ-UHFFFAOYSA-N 333.369 2.323 5 50 EEBA COc1cc(C(=O)N2CCOc3ccncc32)c([N+](=O)[O-])cc1OC 267520183 LSEAYSBCWJVOMG-UHFFFAOYSA-N 345.311 2.046 5 50 EEBA COC(=O)c1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1O 408513699 IFPHORRHYSLOSK-UHFFFAOYSA-N 334.259 2.478 5 50 EEBA Cc1cnc(C2(NC(=O)c3cccc([N+](=O)[O-])c3)CCOCC2)[nH]1 1304118933 PMRSSLBMQWIENR-UHFFFAOYSA-N 330.344 2.062 5 50 EEBA Cc1ccc(C(=O)NC(C)(C)c2noc(CN(C)C)n2)cc1[N+](=O)[O-] 129041514 FJSNRVKWZXWNRZ-UHFFFAOYSA-N 347.375 2.013 5 50 EEBA CN(c1ccccc1C(=O)Nc1cccc([N+](=O)[O-])c1)S(C)(=O)=O 610712 ZVVSDDGPPQKNAK-UHFFFAOYSA-N 349.368 2.243 5 50 EEBA COC(=O)Cc1ccc(N2C[C@@H](C)O[C@H](C3CC3)C2)c([N+](=O)[O-])c1 296837679 SNKJWOHGBWXSFK-BZNIZROVSA-N 334.372 2.314 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@@H](C)[C@H]1CCCO1 5041743 FYXQGRHDFNMIGI-JOYOIKCWSA-N 325.390 2.457 5 50 EEBA C[C@@H](NC(=O)c1ccc2ncc(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 1875321295 CBLAHYSDGMGMEN-SNVBAGLBSA-N 338.323 2.322 5 50 EEBA CN1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccccc1 242047896 VQYMHDXOOQUUNH-CXAGYDPISA-N 338.371 2.495 5 50 EEBA O=C1NC(=O)[C@@]2(CCC[C@H]2CNc2ccc(Cl)cc2[N+](=O)[O-])N1 276239790 PFJGGOSSDCGRIA-RTHLEPHNSA-N 338.751 2.038 5 50 EEBA Cc1nn([C@H](C)C(=O)Nc2ccc3c(c2)OCO3)c(C)c1[N+](=O)[O-] 1068548 JVSYWKCFFUSKMC-SNVBAGLBSA-N 332.316 2.337 5 50 EEBA Cc1c(CC(=O)Nc2ccnn2C[C@@H]2CCOC2)cccc1[N+](=O)[O-] 119267845 AOFOZFKAFITACC-ZDUSSCGKSA-N 344.371 2.317 5 50 EEBA CCCC(=O)O[C@@H](COCc1ccccc1)C[N+]1(C)CCOCC1 4310976 LGKQJIJHKQHGPW-GOSISDBHSA-N 336.452 2.392 5 50 EEBA COc1ccc(-n2c(C)nn(Cc3ccc([N+](=O)[O-])cc3)c2=O)cc1 4089151 HPMOJNNDNMXDFZ-UHFFFAOYSA-N 340.339 2.308 5 50 EEBA COc1cc(CN2CCN(c3ccccn3)CC2)cc([N+](=O)[O-])c1O 22591174 DMZIKNSEEYUXRR-UHFFFAOYSA-N 344.371 2.026 5 50 EEBA Cc1cnc(N[C@H](Cc2ccccc2)C(=O)N(C)C)c([N+](=O)[O-])c1 270192108 IAGUGFYVFOBZBN-CQSZACIVSA-N 328.372 2.410 5 50 EEBA CCc1nnc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])s1 2858965 WYURPDNFWYGRMO-UHFFFAOYSA-N 338.345 2.278 5 50 EEBA CCOC(=O)C1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OC)CC1 3884281 LUNCIOMUZAIZDW-UHFFFAOYSA-N 336.344 2.161 5 50 EEBA CC1(C)CC(NC(=O)COc2ccc([N+](=O)[O-])cc2)CC(C)(C)N1 5060043 DKIAYPJNIYAQBZ-UHFFFAOYSA-N 335.404 2.399 5 50 EEBA O=[N+]([O-])c1cccc(-c2nc3ccccn3c2CN2CCNCC2)c1 2599617 REKIDXQUVHXKQN-UHFFFAOYSA-N 337.383 2.315 5 50 EEBA O=C(O)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 5580742 NBFNPOFDSYOCFP-UHFFFAOYSA-N 345.336 2.420 5 50 EEBA COC(=O)Cn1nc(-c2cccc([N+](=O)[O-])c2)c2ccccc2c1=O 620720 NZBYNYUZTFMADA-UHFFFAOYSA-N 339.307 2.145 5 50 EEBA O=C(Cc1cccc([N+](=O)[O-])c1)NCCN1CCc2ccccc2C1 172745175 ODFQPCCYZAGRBU-UHFFFAOYSA-N 339.395 2.312 5 50 EEBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O 245226940 TTWDOFDLWQILPA-MZUWNQQASA-N 340.335 2.161 5 50 EEBA O=[N+]([O-])c1ccc([C@@]2(O)C[C@@H](C(Cl)(Cl)Cl)NO2)cc1 500036 UFXRKGGEIQEOMD-DTWKUNHWSA-N 327.551 2.404 5 50 EEBA COc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1OC 4081935 RTDYANZSMVCFJN-UHFFFAOYSA-N 345.355 2.454 5 50 EEBA C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O 3958870 VPNXUQDYTJJWRN-JTQLQIEISA-N 339.307 2.218 5 50 EEBA Cn1ccnc1CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 188479575 ZWFWWGGVVAOZQY-UHFFFAOYSA-N 343.387 2.005 5 50 EEBA Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)nc2c1 252523259 CEYWMSKIFFYCTG-LALPHHSUSA-N 328.372 2.243 5 50 EEBA O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1C[C@@H]2CCC[C@H](C1)C2O 169990338 JLQXEPHGBYJFDS-HBBFGDNQSA-N 329.356 2.309 5 50 EEBA Cc1ccc([N+](=O)[O-])c(OCCOCCN2C[C@H](C)O[C@H](C)C2)c1 16489402 VUMZMWOKZQZPFX-GASCZTMLSA-N 338.404 2.408 5 50 EEBA O=[N+]([O-])c1ccc(CCN2CCC(CN3CCC(O)CC3)CC2)cc1 952993290 GHTIMNKVGFINKA-UHFFFAOYSA-N 347.459 2.306 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1NC1CN(c2nc3ccccc3[nH]2)C1 1875279604 OKRVZCOKLQYEKE-UHFFFAOYSA-N 341.375 2.297 5 50 EEBA CCOC(=O)c1ccc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc1 1067948 IXOYPYRPIKSVOR-UHFFFAOYSA-N 346.343 2.224 5 50 EEBA CN1CCN(c2ccc(C(=O)NC3CCCCC3)cc2[N+](=O)[O-])CC1 6686531 HFPVPJSEMMYSFV-UHFFFAOYSA-N 346.431 2.409 5 50 EEBA NC(=O)c1ccc(CN2CCCC[C@@H]2c2cn[nH]c2)c([N+](=O)[O-])c1 114202999 JBKRKYBQTYZDCJ-CQSZACIVSA-N 329.360 2.144 5 50 EEBA O=[N+]([O-])c1ccc(Cl)c(CN2CCN(c3ncccn3)CC2)c1 22591223 XJFITCGGNQPLHI-UHFFFAOYSA-N 333.779 2.360 5 50 EEBA CCCN(CC)C(=O)[C@@H]1CO[C@H](CNc2ccc([N+](=O)[O-])cn2)C1 2332238066 XPOPDBHNZSURND-JSGCOSHPSA-N 336.392 2.065 5 50 EEBA CC[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1ncc(C)[nH]1 952883560 NONATSVTDJQSFQ-LLVKDONJSA-N 338.389 2.364 5 50 EEBA O=[N+]([O-])c1cccnc1N1CCN(Cc2ccc(Cl)cn2)CC1 302118727 CUHZAMGUBLSMBW-UHFFFAOYSA-N 333.779 2.360 5 50 EEBA CC(C)Oc1ncc(Cl)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 408520707 UEHUWLSDKLLREG-UHFFFAOYSA-N 339.739 2.266 5 50 EEBA O=C(O)c1cccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])c1 190194 ALNMJYQHRPWFPS-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@H](C2CCC2)C1 411873027 KUVKCSDRDGODFK-LRDDRELGSA-N 333.388 2.423 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCCC2(C1)OCCO2 253426440 PYXKZYJSYAHLLW-AWEZNQCLSA-N 334.372 2.329 5 50 EEBA COC(=O)c1cc(C)nc(N2CCC[C@@H](c3cn[nH]c3)C2)c1[N+](=O)[O-] 1775984719 GUKJECORWARFIF-LLVKDONJSA-N 345.359 2.192 5 50 EEBA Cc1cc(C)n(C(=O)Cn2nc([N+](=O)[O-])c(Br)c2C)n1 1430677 AQILDQNKYXCURF-UHFFFAOYSA-N 342.153 2.016 5 50 EEBA O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCCO1 253416449 DNSXEHGVELUFIA-HZPDHXFCSA-N 333.388 2.490 5 50 EEBA Cc1nc(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)oc1C 170604907 CZBLCVZGNUYFOV-UHFFFAOYSA-N 325.346 2.215 5 50 EEBA O=C1N=C([n+]2ccccc2)/C(=C\NNc2ccc([N+](=O)[O-])cc2)S1 38191468 OPUBJPKDPUNMNK-UHFFFAOYSA-O 342.360 2.454 5 50 EEBA CNc1cc(NCCCOCCO)cc(Br)c1[N+](=O)[O-] 1775990307 FBKOGZLXQCMOQA-UHFFFAOYSA-N 348.197 2.210 5 50 EEBA O=[N+]([O-])c1cccnc1Sc1ncn(-c2ncccc2[N+](=O)[O-])n1 8733519 ZZKHTZOHIFFQDV-UHFFFAOYSA-N 345.300 2.025 5 50 EEBA COc1ccc(CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 4957264 LUGUOBWCESADKK-UHFFFAOYSA-N 336.369 2.124 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@@H]1c1ccccc1 188229860 PRCLDKAVDZVPJW-JKSUJKDBSA-N 327.340 2.437 5 50 EEBA O=[N+]([O-])c1ccc(I)cc1N1CCCOCC1 1775991634 SIQNMEKTMXONER-UHFFFAOYSA-N 348.140 2.426 5 50 EEBA NC(=O)N1CC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 408516859 YBKIBPGXPMZQQJ-MRVPVSSYSA-N 332.282 2.426 5 50 EEBA CC[C@@H](C)NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 464540 LMYMRJGJGLLZGF-GFCCVEGCSA-N 333.388 2.362 5 50 EEBA Cn1cc([N+](=O)[O-])c(C(=O)NCC2(N3CCCCC3)CCCCC2)n1 241644233 PPKUTBVOPLGFJF-UHFFFAOYSA-N 349.435 2.247 5 50 EEBA C[C@H]1CC[C@@H](C)C[C@@H]1NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 226695301 POXYFTHHTNBRNQ-NRUUGDAUSA-N 337.401 2.458 5 50 EEBA C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nc2ccccc2s1 754704121 LGIOSHYQAKTZPH-ZYHUDNBSSA-N 347.400 2.113 5 50 EEBA O=[N+]([O-])c1cc(I)cnc1Br 14400976 ZEECRCKYHSULQO-UHFFFAOYSA-N 328.891 2.357 5 50 EEBA in-vitro COc1ccccc1N1CC[C@H](n2nc(C)c([N+](=O)[O-])c2C)C1=O 150992277 CMEUGYTXOBOEGC-ZDUSSCGKSA-N 330.344 2.395 5 50 EEBA O=c1oc2cc([N+](=O)[O-])ccc2n1Cc1nnc(C2CC2)n1C1CC1 170593971 DBLCOEIRXRIPMO-UHFFFAOYSA-N 341.327 2.355 5 50 EEBA CC(=O)c1ccc(N2CCN(C3CCOCC3)C[C@H]2C)c([N+](=O)[O-])c1 278884273 WQIXNBWCINJOIV-CYBMUJFWSA-N 347.415 2.487 5 50 EEBA Cc1cc([N+](=O)[O-])nn1C[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 2788087 FGUMZOZCGWQGCL-JTQLQIEISA-N 346.343 2.146 5 50 EEBA CCOC(=O)Cc1csc(CNc2cc(C)c([N+](=O)[O-])cn2)n1 952993323 GLTZJJMIKSHJCA-UHFFFAOYSA-N 336.373 2.472 5 50 EEBA O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1ccccc1F 380118 ADTTXIFBRYFVPP-UHFFFAOYSA-N 343.112 2.332 5 50 EEBA COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2O)cc1 4909230 BUPDBRSYOJWQIK-UHFFFAOYSA-N 347.352 2.436 5 50 EEBA Cc1cc(O)nc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])c(C)c3)C2)n1 952883397 ZILXGVAOCRBJBT-CYBMUJFWSA-N 329.360 2.398 5 50 EEBA O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1ccc([N+](=O)[O-])cc1Cl 2873717 QMCIDLDEXZQGNC-UHFFFAOYSA-N 345.698 2.384 5 50 EEBA CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2[N+](=O)[O-])c1 5049203 XFVPNMILOPSQEZ-UHFFFAOYSA-N 349.368 2.097 5 50 EEBA Cc1cc(C(F)(F)F)nn1CC(=O)Nc1cc(O)cc([N+](=O)[O-])c1 429971 SNZIFBFPRSJWKB-UHFFFAOYSA-N 344.249 2.463 5 50 EEBA O=C(C[C@H](NCc1ccccc1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280066 HHODNKFGFUHGFS-HNNXBMFYSA-N 343.339 2.166 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCOc1ccccc1 4844919 AECPFBWBDWPOBH-UHFFFAOYSA-N 336.369 2.261 5 50 EEBA NC(=O)c1ccc(CN2CCOCc3ccccc32)c([N+](=O)[O-])c1 348203176 AJZBTMIWSUJNBL-UHFFFAOYSA-N 327.340 2.231 5 50 EEBA O=[N+]([O-])c1ccc([C@H](O)CNC(=S)N[C@H]2C[C@H]3CC[C@H]2C3)cc1 252445378 HFEOOOYHYRDOJN-HQRZJTNHSA-N 335.429 2.281 5 50 EEBA O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1O 242302133 YPUKSBKRLZGTRF-NILFDRSVSA-N 332.356 2.378 5 50 EEBA COc1cc(N2CCC[C@H]([C@@H](O)c3nccn3C)C2)ccc1[N+](=O)[O-] 269351732 JUSSEXCNZBTNGB-BLLLJJGKSA-N 346.387 2.287 5 50 EEBA C[C@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1ccccc1)c1nn[nH]n1 1875349025 KJPCNIDPDOKHCZ-LLVKDONJSA-N 339.359 2.410 5 50 EEBA Cc1c(CC(=O)N2CCNC[C@H]2c2cccnc2)cccc1[N+](=O)[O-] 423616787 SIOIEXBVOKRKSX-KRWDZBQOSA-N 340.383 2.014 5 50 EEBA NCC[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 170621024 DWGVOGLUVBTXTI-GFCCVEGCSA-N 347.396 2.236 5 50 EEBA COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)c1 2752075 VMQOEJROHHTBSW-GHMZBOCLSA-N 348.359 2.247 5 50 EEBA O=[N+]([O-])c1c(N[C@@H]2C[C@@H](O)[C@H]2n2cccn2)ccc2ncccc12 952993158 DZYKQEYYZOKIBM-FMKPAKJESA-N 325.328 2.126 5 50 EEBA CC(C)Cc1nnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 2727637 INOFJOJNRTYYRB-UHFFFAOYSA-N 342.402 2.446 5 50 EEBA CCCOc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1OC 4838097 DTKWPDCMESFCKJ-GQCTYLIASA-N 347.327 2.352 5 50 EEBA O=C(Nc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H]1CCc2cn[nH]c2C1 253630310 ZPORGJFZXSZVDP-SSDOTTSWSA-N 336.735 2.421 5 50 EEBA CO[C@](F)(C(=O)Nc1ccc(C(=O)O)c([N+](=O)[O-])c1)C(F)(F)F 2190839 HMCFSWUZEGGRAW-SNVBAGLBSA-N 340.185 2.106 5 50 EEBA O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1O 242302132 YPUKSBKRLZGTRF-KCPJHIHWSA-N 332.356 2.378 5 50 EEBA COc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc(OC)c1 5090909 TYCARWGMYYSIKN-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1=O 101357990 RVKRGQRTAABIGB-NBLIUIFLSA-N 328.324 2.305 5 50 EEBA O=[N+]([O-])c1cnn(CCCc2nc(-c3ccc4c(c3)OCO4)no2)c1 4753327 VEYIPOOWSHYNGH-UHFFFAOYSA-N 343.299 2.203 5 50 EEBA O=C(O)c1cc([N+](=O)[O-])ccc1Sc1nnnn1-c1ccccc1 269006 ZEKBXTUQEKTDEV-UHFFFAOYSA-N 343.324 2.420 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 100320406 JNHXLWWYDPFNKR-AWRWRYAPSA-N 332.312 2.065 5 50 EEBA Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C 252516823 XBVOGHUFOAUEHB-KCPJHIHWSA-N 337.376 2.237 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@@H]1c1cccc([N+](=O)[O-])c1 42788 UMPJPEONKFXGFT-CQSZACIVSA-N 347.327 2.045 5 50 EEBA COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCCN)c1 4978327 UREPSTBQSMJAQV-UHFFFAOYSA-N 330.344 2.226 5 50 EEBA CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccc(F)cc1 188153466 AWQFYXOPOXUIDD-HNNXBMFYSA-N 333.319 2.434 5 50 EEBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O 245226941 TTWDOFDLWQILPA-XOSVDHCLSA-N 340.335 2.161 5 50 EEBA Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@H](C)O)C2)cccc1[N+](=O)[O-] 305631941 FZQZTDBXJVNAIK-MELADBBJSA-N 335.404 2.323 5 50 EEBA COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1[N+](=O)[O-] 3893529 AYQYLYBTGWIVLK-UHFFFAOYSA-N 334.353 2.355 5 50 EEBA CCOC(=O)c1ncn(-c2ccc([N+](=O)[O-])cc2C(=O)OC)c1C 142218212 GHWRXCNCMVAHGG-UHFFFAOYSA-N 333.300 2.052 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N1C[C@@H](C)O[C@H](C)C1 5041521 MYEHNMMOVPEOJM-NXEZZACHSA-N 325.390 2.409 5 50 EEBA O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1ccc(O)c([N+](=O)[O-])c1 119364455 HTZRHUBYAHGGPF-GLQYFDAESA-N 332.356 2.378 5 50 EEBA CCc1nn(C)c(N2CCN(C(C)=O)C3(CCCCC3)C2)c1[N+](=O)[O-] 328586944 HDPSZZQCEXNZKL-UHFFFAOYSA-N 349.435 2.262 5 50 EEBA CC(C)[C@@](C)(NCc1ccc(Br)c([N+](=O)[O-])c1)C(N)=O 289303946 IOMYLBMURLVMIN-CYBMUJFWSA-N 344.209 2.347 5 50 EEBA O=C(Cc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879260 SOKFHYPVABOYOP-UHFFFAOYSA-N 325.368 2.486 5 50 EEBA CCC(=O)N(CCCNC(=O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1 4724463 HLAKDZGVAJZLSW-UHFFFAOYSA-N 347.293 2.406 5 50 EEBA O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCCOC[C@H]2CCCO2)n1 252584770 CUAKFGDWCSYLFO-QLFBSQMISA-N 338.408 2.060 5 50 EEBA CCC[C@@H](NC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1)c1nnn[nH]1 183068870 JENZPLFEVRAYHY-WTNCMQEWSA-N 330.348 2.169 5 50 EEBA COC(=O)c1ccc(Cn2nc([N+](=O)[O-])c(Br)c2C)o1 35773 QDXROBZGVPIVNO-UHFFFAOYSA-N 344.121 2.290 5 50 EEBA CC(C)(C)c1nnc2n(c1=O)N=C(c1cccc([N+](=O)[O-])c1)CS2 225236 KUDVIKFFAPJDLR-UHFFFAOYSA-N 345.384 2.202 5 50 EEBA COCCO[C@H]1CCN(C(=O)c2cc(C)c(Cl)c([N+](=O)[O-])c2)C1 1775998876 JPECVPWRJHFITD-LBPRGKRZSA-N 342.779 2.434 5 50 EEBA COC(=O)C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 457125 SRWPQINNMWFODX-UHFFFAOYSA-N 326.736 2.273 5 50 EEBA CCN1C=C(C(=O)OC)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)OC)=C1 462056 WLYZJTVLZQOHKW-UHFFFAOYSA-N 346.339 2.128 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 4907647 QPOYHTZFCJNNSS-KRWDZBQOSA-N 326.308 2.032 5 50 EEBA O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC(c2nnco2)CC1 408516525 CPCMXDFHOLFHMW-AATRIKPKSA-N 328.328 2.397 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnn(Cc2ccccn2)c1 190768110 QRADTAFROSEMMD-UHFFFAOYSA-N 338.327 2.069 5 50 EEBA CCOC(=O)c1nc(O)c2cc3cc(OC)c(OC)cc3nc2n1 16940528 KIDJDJMACBOHKQ-UHFFFAOYSA-N 329.312 2.078 5 50 EEBA in-man CCNS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 2876758 YZJCMSRKZNEYBF-UHFFFAOYSA-N 349.368 2.145 5 50 EEBA O=C(O)[C@@H]1[C@H]2C=C[C@@H]([C@@H]3C[C@@H]23)[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 245226382 UNMJLXNHSYJMRJ-GXYBRJDSSA-N 328.324 2.302 5 50 EEBA CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1 456163 XKIZXWVFIJSNHM-VFNNOXKTSA-N 332.356 2.410 5 50 EEBA CN1C=C(C(=O)NCC[N+](C)(C)Cc2ccccc2)C=C/C1=C\N=O 135678119 ZNWUXMBVLVMAMM-QGOAFFKASA-O 341.435 2.373 5 50 EEBA C[C@@H](Sc1nnc(O)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 170085210 IFABOYHYQLPJMU-ZCFIWIBFSA-N 334.317 2.322 5 50 EEBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 225204267 MNPSFEMZUCGMAY-CHIMOYNISA-N 334.332 2.126 5 50 EEBA COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3CC2)c([N+](=O)[O-])c1 100058532 POQLTXUQTRSJEL-CHPZLBCBSA-N 328.324 2.305 5 50 EEBA C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](N2CCCC2)C1 229717852 BNGJYDRTTUONDI-WMLDXEAASA-N 346.431 2.482 5 50 EEBA COc1cccc2c1CCCCN2C(=O)Cn1cc([N+](=O)[O-])nc1C 129074169 OIXNGYQVWSIMTK-UHFFFAOYSA-N 344.371 2.478 5 50 EEBA Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C 170645882 XBVOGHUFOAUEHB-BYCMXARLSA-N 337.376 2.237 5 50 EEBA CCC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](O)(c2ccncc2)C1 302250 RLMRJGBZNPAVNP-KRWDZBQOSA-N 340.339 2.447 5 50 EEBA O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)NCc1cccs1 357180979 XVTRIIXHEVSJFU-UHFFFAOYSA-N 343.368 2.231 5 50 EEBA Cc1ccc([N+](=O)[O-])c(C)c1NS(=O)(=O)c1c(C)nn(C)c1C 130300261 YMADLHXLSHVDSR-UHFFFAOYSA-N 338.389 2.363 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3cc([N+](=O)[O-])ccc3Cl)C(=O)[C@H]12 244774201 PPMVVZMNIQGGOV-YXMPFFBPSA-N 334.715 2.081 5 50 EEBA COc1ccc(C(=O)NC[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 118772 AYLLIWSLUCCHAV-LBPRGKRZSA-N 344.323 2.173 5 50 EEBA Cc1nc([N+](=O)[O-])cn1CCCCN1C(=O)c2ccccc2C1=O 2968265 KGAXPRHNOOXWRS-UHFFFAOYSA-N 328.328 2.176 5 50 EEBA O=C(O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C(=O)O)cc1 41685 STPPGHFRERXELK-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA O=C(O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2C(=O)O)c1 188342 FLOQPNCRONAYIV-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA COC(=O)C(C)(C(=O)OC)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4088810 ZAQRNZJJAFYHPJ-UHFFFAOYSA-N 335.234 2.217 5 50 EEBA COc1cccc(N2CCN(c3ncccc3F)CC2)c1[N+](=O)[O-] 253418331 OEWGZBKPFIDVOU-UHFFFAOYSA-N 332.335 2.464 5 50 EEBA Cc1nnc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1C 174247372 JYGLSAAOZSYPCW-UHFFFAOYSA-N 331.376 2.075 5 50 EEBA COC(=O)Cc1ccc(N2C[C@H](C3CC3)O[C@H](C)C2)c([N+](=O)[O-])c1 296837677 SNKJWOHGBWXSFK-BDJLRTHQSA-N 334.372 2.314 5 50 EEBA CC1(C)COCCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] 146960827 AMGSKJGBSOJVDN-UHFFFAOYSA-N 334.781 2.048 5 50 EEBA O=[N+]([O-])c1ccc(-c2ncn(CN3CCO[C@H]4CCCC[C@H]43)n2)cc1 230118814 FLCJJXOAGAQLIH-CVEARBPZSA-N 343.387 2.454 5 50 EEBA O=[N+]([O-])c1ccc(NCCN(CCO)c2ccc([N+](=O)[O-])cc2)cc1 4774767 SWIMXOJIEOZZOY-UHFFFAOYSA-N 346.343 2.414 5 50 EEBA O=[N+]([O-])c1ccc2c(c1)[C@@H](O)n1nc(-c3ccncc3)nc1S2 610850 YCIAUNOMFAQXEH-CYBMUJFWSA-N 327.325 2.252 5 50 EEBA Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1nncn1C1CC1 120024331 ZDIWWTYWTSVWCS-UHFFFAOYSA-N 330.348 2.460 5 50 EEBA CC(C)C[C@]1(C)CC(=O)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O 137066584 BHNKGEJDIWNAMK-WMLDXEAASA-N 334.372 2.440 5 50 EEBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)n1 2767381 ATNIHBZXSHBDPV-UHFFFAOYSA-N 336.176 2.276 5 50 EEBA O=[N+]([O-])c1cc(F)ccc1N1CCC(c2ccnn2CCO)CC1 253398598 CNDFYLUVOWESKA-UHFFFAOYSA-N 334.351 2.307 5 50 EEBA CCCc1[nH]nc(C(=O)N[C@H](C)c2n[nH]c([C@@H](C)CC)n2)c1[N+](=O)[O-] 277967654 UTDSNWRCGKXBAU-DTWKUNHWSA-N 349.395 2.393 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1nc2ccccc2[nH]1 47731 KPWPXJKCUXQKME-UHFFFAOYSA-N 340.339 2.209 5 50 EEBA Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCOCC3(CC3)C2)c1 328586999 KYXSPURZJKNAPJ-UHFFFAOYSA-N 334.372 2.311 5 50 EEBA O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCCOC[C@@H]2CCCO2)n1 170606831 CUAKFGDWCSYLFO-RRFJBIMHSA-N 338.408 2.060 5 50 EEBA O=C(c1ccccc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 5421952 CAEZYDQJWCNKDO-UHFFFAOYSA-N 339.351 2.193 5 50 EEBA Cc1cc([N+](=O)[O-])c(Cl)cc1S(=O)(=O)NC(=O)CC1CC1 888099121 AAYPMJJVOKCRQO-UHFFFAOYSA-N 332.765 2.162 5 50 EEBA CN1CCCN(C(=O)c2nn(C)cc2[N+](=O)[O-])c2cc(Cl)ccc21 253417050 LJEWXKYGWBFAEM-UHFFFAOYSA-N 349.778 2.468 5 50 EEBA CN(C)c1ncccc1O[C@@H]1CCN(c2ncccc2[N+](=O)[O-])C1 282062105 ZZYGCTMYVCJGLI-GFCCVEGCSA-N 329.360 2.109 5 50 EEBA Cc1c(NC(=O)[C@@H](C)N2CC[C@@H](n3cccn3)C2)cccc1[N+](=O)[O-] 291756872 KXVWGLGYSCXOCE-ZIAGYGMSSA-N 343.387 2.374 5 50 EEBA CO[C@H]1C[C@@H](CN2CCCC2)N(c2ccc(C(C)=O)cc2[N+](=O)[O-])C1 408516308 ATVFNSLGDUIDMM-HOTGVXAUSA-N 347.415 2.487 5 50 EEBA CCC(C)(C)NC(=O)[C@@H](C)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 229718930 IWWWUDUKSBJWLB-CHWSQXEVSA-N 349.435 2.169 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@]1(O)CCc2ccccc21 159432510 XTYHPKLGOWYWFY-LJQANCHMSA-N 340.379 2.478 5 50 EEBA Cc1cc(NC(=O)CCCn2nc([N+](=O)[O-])c(Cl)c2C)no1 215061 KQPRMLLLPJUDGF-UHFFFAOYSA-N 327.728 2.468 5 50 EEBA O=[N+]([O-])c1cccc(-c2ncn(CN3CCO[C@H]4CCCC[C@H]43)n2)c1 249706943 PEYYEXZEKYQKJS-CVEARBPZSA-N 343.387 2.454 5 50 EEBA Cc1ccc(-n2nccc2NC(=O)c2cccc([N+](=O)[O-])c2C)nn1 155716222 ZFHYTVWLHDWTDL-UHFFFAOYSA-N 338.327 2.440 5 50 EEBA C[N@+]12CC[C@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@@H](C[C@H]32)[C@H]6[C@H]54 245225993 CTCZKABHVPGYMK-DRGYWFSFSA-N 349.454 2.237 5 50 EEBA Cc1cc(NC(=O)c2cnsn2)n(-c2ccc([N+](=O)[O-])cc2)n1 129597664 AAMDPALCNGMLBE-UHFFFAOYSA-N 330.329 2.193 5 50 EEBA COC(=O)c1cc(C(=O)NCCc2ccccc2)cc([N+](=O)[O-])c1 434596 DZHIQSINNLETOJ-UHFFFAOYSA-N 328.324 2.354 5 50 EEBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccnc1N1CCOCC1 19856799 JAWFSGBNCUVFON-UHFFFAOYSA-N 328.328 2.079 5 50 EEBA C[C@H]1COc2ccccc2CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 273042963 XGBXYWYLKAORLN-LBPRGKRZSA-N 341.367 2.477 5 50 EEBA O=[N+]([O-])c1cccnc1NCc1nnc2n1CC[C@H](C(F)(F)F)C2 952882108 RMUAATQZEOWHHL-QMMMGPOBSA-N 342.281 2.318 5 50 EEBA O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1ccc(O)c([N+](=O)[O-])c1 240744035 HTZRHUBYAHGGPF-KCPJHIHWSA-N 332.356 2.378 5 50 EEBA O=[N+]([O-])c1ccc2nc(NC[C@H](O)CN3CCCCC3)ccc2c1 170642756 KKULUCJDWMBIBY-HNNXBMFYSA-N 330.388 2.402 5 50 EEBA CCOc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])c(OCC)c1 15009173 XYDRPNHGBDJQIC-SOFGYWHQSA-N 347.327 2.352 5 50 EEBA Cc1noc([C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(C)C)n1 112024293 JYYAHJVCIDXUHX-AWEZNQCLSA-N 334.332 2.179 5 50 EEBA Cn1cc(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3O)CC2)cn1 170599074 RVFAXYHTZRVPSC-UHFFFAOYSA-N 330.344 2.054 5 50 EEBA COC(=O)c1cccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 191321 JKQFUIDOULTEAH-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA COC(=O)c1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1 469472 RLHKXBJWYIINQB-UHFFFAOYSA-N 330.296 2.399 5 50 EEBA O=[N+]([O-])c1ccccc1/C=C/CN1CCN(c2ncccn2)CC1 55292195 HFAZPLCUZFISFY-ZZXKWVIFSA-N 325.372 2.220 5 50 EEBA C[C@H]1COC2(CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])CC2)O1 169991444 KGSSLTSDCRFQQV-ZDUSSCGKSA-N 349.387 2.151 5 50 EEBA CC[C@H](CO)N1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 190222507 MSZLJTKUEKIGSI-OAHLLOKOSA-N 349.431 2.247 5 50 EEBA O=C(NCc1cccnc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 105750 FTANZISXTLBQGV-UHFFFAOYSA-N 325.280 2.026 5 50 EEBA Cn1c(SCc2ccc([N+](=O)[O-])cc2)nnc1-c1cnccn1 530969 AOABGRFQIPPMAQ-UHFFFAOYSA-N 328.357 2.473 5 50 EEBA Nc1ncnc2[nH]c(SCc3nc4ccc([N+](=O)[O-])cc4[nH]3)nc12 6017180 HNXJTAZMZVOZOO-UHFFFAOYSA-N 342.344 2.012 5 50 EEBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC([C@H](O)C(F)(F)F)CC1 151038016 DDRDWYUSEUSZQA-LBPRGKRZSA-N 348.277 2.076 5 50 EEBA O=[N+]([O-])c1c(N2CC(NC3CCOCC3)C2)ccc2ncccc12 952994814 VADHWVKJELAIMV-UHFFFAOYSA-N 328.372 2.100 5 50 EEBA CC1(C)[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCO[C@H]21 230137521 JAOAPBAFICRHIK-RRFJBIMHSA-N 333.388 2.250 5 50 EEBA CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCCc2nn(C)cc21 241132776 JLOCOEJPBOMJHB-HNNXBMFYSA-N 342.399 2.449 5 50 EEBA O=C(Nc1ccc2c[nH]nc2c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 180218224 ZVDNOQUWUOPJDJ-UHFFFAOYSA-N 326.268 2.452 5 50 EEBA Cc1c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(=O)O 4756954 LDCANKXSLMKZJI-UHFFFAOYSA-N 336.325 2.402 5 50 EEBA CCCC(=O)O[C@H](COCc1ccccc1)C[N+]1(C)CCOCC1 4310975 LGKQJIJHKQHGPW-SFHVURJKSA-N 336.452 2.392 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@]2(O)CCCC[C@H]2C1 160965717 MLFNLUJNNIAZLO-WMLDXEAASA-N 333.388 2.431 5 50 EEBA CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)c1c(C)nn(C)c1C 170605091 PHRMIYYVLXQEFU-CQSZACIVSA-N 331.376 2.408 5 50 EEBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccco3)c2)CC1 4117352 GHJAGHOEEOUXNM-UHFFFAOYSA-N 344.371 2.468 5 50 EEBA NCCCN(Cc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 261544389 XPPJLPNPUJEJIW-UHFFFAOYSA-N 349.412 2.135 5 50 EEBA Cc1ocnc1CN(C)[C@@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 1775990204 WAORBMURERDFKY-CYBMUJFWSA-N 344.371 2.238 5 50 EEBA O=[N+]([O-])c1ccc(N2CCN(Cc3ccc([N+](=O)[O-])o3)CC2)cc1 3879878 RTHMNGQTJQBRHZ-UHFFFAOYSA-N 332.316 2.418 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2cccs2)c2cc([N+](=O)[O-])ccc21 4985658 SKIZMVNBUNRYMF-HNNXBMFYSA-N 332.337 2.093 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)CCN2CC[C@H]2C(F)(F)F)cc1 408519068 WTOHPBLTKNLSSE-NSHDSACASA-N 338.307 2.005 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cn2cncn2)cc1 170597787 WCGOHDWBKOYORI-UHFFFAOYSA-N 338.327 2.069 5 50 EEBA O=[N+]([O-])c1cc(F)c(F)cc1S(=O)(=O)NC[C@H]1CCCS1 1775993587 GWQGUNFCYPYTBB-SSDOTTSWSA-N 338.357 2.047 5 50 EEBA CC(=O)Nc1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 289547 WILKEJSRYBJDSR-UHFFFAOYSA-N 325.280 2.354 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1Cl 462142 FOESQICWQOENEI-LBPRGKRZSA-N 339.735 2.439 5 50 EEBA CCN(CC)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C=O)C1 5060736 TYNNFQARMVJZID-CYBMUJFWSA-N 333.388 2.492 5 50 EEBA O=C(O)c1ccc(Sc2nnn(-c3ccccc3)n2)c([N+](=O)[O-])c1 133814 CAYLCEHMRFFSFG-UHFFFAOYSA-N 343.324 2.420 5 50 EEBA Cn1ccc(N2CCC[C@H](Sc3ccc([N+](=O)[O-])cn3)C2=O)n1 159686574 HAZLNRYQGMSTRP-NSHDSACASA-N 333.373 2.011 5 50 EEBA COC(=O)Cc1ccc(N2C[C@H](C)O[C@@H](C3CC3)C2)c([N+](=O)[O-])c1 296837681 SNKJWOHGBWXSFK-MEDUHNTESA-N 334.372 2.314 5 50 EEBA Cc1nn(Cn2nc(C)c([N+](=O)[O-])c2C)c(C)c1Br 2538868 WUDOEEMGHKNHBP-UHFFFAOYSA-N 328.170 2.490 5 50 EEBA COC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C(=O)O)cc1 5558168 ZWXVNMIXTUNOGW-UHFFFAOYSA-N 344.279 2.332 5 50 EEBA COC(=O)CSc1cc([N+](=O)[O-])cc2onc(C3OCCO3)c12 36893 DVXWWOQQDRJCAN-UHFFFAOYSA-N 340.313 2.047 5 50 EEBA CC(C)c1ccc(C(=O)N[C@@H]2CCC[C@H](C(N)=O)C2)cc1[N+](=O)[O-] 188032333 MLPBLKXMNPBDAX-WCQYABFASA-N 333.388 2.492 5 50 EEBA O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2cccnc2)c1 345838749 VWXFJTJWYQHUKZ-UHFFFAOYSA-N 337.339 2.148 5 50 EEBA Cc1nn(CCC(=O)O[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c(C)c1[N+](=O)[O-] 126585077 TXSVTWFRSNCQLF-TUKIKUTGSA-N 337.376 2.155 5 50 EEBA CCc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2C)nc(C)n1 180762956 AHXJOYOPGXFJAX-UHFFFAOYSA-N 336.373 2.365 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](c2ccsc2)C1 170605127 AMPTWEKAZPZZQQ-AWEZNQCLSA-N 333.369 2.452 5 50 EEBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](c2ccccn2)C1 798476427 GIIOGUFPRMDSFL-CYBMUJFWSA-N 347.396 2.476 5 50 EEBA O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCOC2(CCCCC2)C1 408519571 UPSHOMUUESZUOL-HNNXBMFYSA-N 334.372 2.190 5 50 EEBA O=[N+]([O-])c1c(N[C@@H]2C[C@H](O)[C@H]2n2cccn2)ccc2ncccc12 952993176 DZYKQEYYZOKIBM-YCPHGPKFSA-N 325.328 2.126 5 50 EEBA COC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc([N+](=O)[O-])cc2)C1=O 4695276 MJERFAMWDPIJMO-LBTPYSACSA-N 336.325 2.193 5 50 EEBA COc1ccc(Cl)cc1NC(=O)c1[nH]nc(OC)c1[N+](=O)[O-] 6381706 IZVIVZZJEVCUCV-UHFFFAOYSA-N 326.696 2.241 5 50 EEBA CC(=O)Nc1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 4957260 LAPOOPMOTXVKLH-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA COc1cc(C(=O)NCCc2ccns2)c([N+](=O)[O-])cc1OC 1336688304 XURRXJOTGWUZKZ-UHFFFAOYSA-N 337.357 2.041 5 50 EEBA CCN1CCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1=O 189863597 RLAWWBDTFXZWSG-ZDUSSCGKSA-N 348.403 2.228 5 50 EEBA Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@H](C)[S@](C)=O 120346345 ZJLUETSSNQGUPP-KPWVOAKYSA-N 327.406 2.490 5 50 EEBA O=C(CSc1nc2ccccc2s1)Nc1nonc1[N+](=O)[O-] 12360454 HCNPWPLOSWKKNA-UHFFFAOYSA-N 337.342 2.318 5 50 EEBA Cc1cc([N+](=O)[O-])cnc1N1CC[C@H](Oc2cccnc2N(C)C)C1 253426802 XRSBMKHOQIPJDL-AWEZNQCLSA-N 343.387 2.417 5 50 EEBA CC(=O)c1ccc(N2CCC(CO)(NC(C)C)CC2)c([N+](=O)[O-])c1 408525966 GPAWVWAPNKJXKB-UHFFFAOYSA-N 335.404 2.127 5 50 EEBA Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@@H](C)[S@@](C)=O 120346481 ZJLUETSSNQGUPP-XFNZEKPQSA-N 327.406 2.490 5 50 EEBA C[C@@H]1CCCN(c2ccc(C(=O)O[C@H]3CCOC3=O)cc2[N+](=O)[O-])C1 241776816 RSWVMSGMOJGKAJ-ABAIWWIYSA-N 348.355 2.303 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 100320408 JNHXLWWYDPFNKR-WBRVRECLSA-N 332.312 2.065 5 50 EEBA CCCC[C@@H]1NC(=O)N(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 225703380 XKOFWYCWZMVROQ-LBPRGKRZSA-N 348.359 2.034 5 50 EEBA CCn1c(SCC2OCCO2)nnc1-c1ccc([N+](=O)[O-])cc1 179985436 QQCLBOICTNHKSI-UHFFFAOYSA-N 336.373 2.338 5 50 EEBA CCOC(=O)c1c(N)sc2c1CCN(c1ncccc1[N+](=O)[O-])C2 267794610 ZQNQAAKVCXRROM-UHFFFAOYSA-N 348.384 2.373 5 50 EEBA CC(=O)Oc1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 42156 BSDDHAWCYJJNJI-UHFFFAOYSA-N 326.264 2.321 5 50 EEBA Cc1ccc2c(c1)[C@](O)(CC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N2 302843 YCIGKCQBAZDIJQ-QGZVFWFLSA-N 326.308 2.316 5 50 EEBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CCO)CC1 421025306 YJHSHZXMXRFSTP-ZIAGYGMSSA-N 335.404 2.406 5 50 EEBA COc1ccc(Br)cc1[C@@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 88904 GYNLENYWMBGSAY-CABZTGNLSA-N 329.150 2.054 5 50 EEBA CCOC(=O)[C@@H]1CCCCN1Cc1cc(OC)c(O)c([N+](=O)[O-])c1 4978542 OKGUVRCIWZZOGL-LBPRGKRZSA-N 338.360 2.227 5 50 EEBA COc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cn1 252478467 AMVZIHAJSUNADV-UHFFFAOYSA-N 348.334 2.134 5 50 EEBA O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCCOC[C@@H]2CCCO2)n1 170606829 CUAKFGDWCSYLFO-SOUVJXGZSA-N 338.408 2.060 5 50 EEBA COc1cccc(NCc2cccnc2N2CCOCC2)c1[N+](=O)[O-] 185166197 FFCLWJBYLNGLAF-UHFFFAOYSA-N 344.371 2.447 5 50 EEBA O=C(O)c1ccccc1NC(=S)NC(=O)c1ccccc1[N+](=O)[O-] 2997430 JMMVIHHYAKJLKS-UHFFFAOYSA-N 345.336 2.420 5 50 EEBA Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])nn1C 439607346 NMQHBGIDLDVTJT-UHFFFAOYSA-N 328.250 2.908 5 50 EEBA Cc1nn(CCC(=O)N[C@H]2CCc3c(O)cccc32)c(C)c1[N+](=O)[O-] 111604525 FYUYYDQCOPDSSF-AWEZNQCLSA-N 344.371 2.308 5 50 EEBA CCOc1cccc([N+](=O)[O-])c1C(=O)N=c1cc[nH]cc1C(C)=O 348524009 AZVUWORBBJYSIH-UHFFFAOYSA-N 329.312 2.265 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2ccn[nH]2)C1 172306910 WVLWOSXFYKEUCG-CYBMUJFWSA-N 329.360 2.407 5 50 EEBA O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@@H](O)c2ccccc2)c1 843086989 HPRRYPZLAKEKCR-FUHWJXTLSA-N 346.383 2.048 5 50 EEBA Cc1cc(O)nc(N2CC[C@@H](Nc3ccc(F)cc3[N+](=O)[O-])C2)n1 952994930 WZJNLGJVAMFOPE-LLVKDONJSA-N 333.323 2.229 5 50 EEBA CC1=C(C(=O)OCC(C)C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 103820 UNLNOXYSDORBPM-AWEZNQCLSA-N 333.344 2.422 5 50 EEBA C[C@@H](c1ccccc1)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(N)=O 794717244 KMFXNRCIMKLMJJ-ZBEGNZNMSA-N 331.347 2.481 5 50 EEBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(Br)cc1F 1428112 IVDLTESSWPCKNS-UHFFFAOYSA-N 343.112 2.332 5 50 EEBA COc1cc(C(=O)Nc2ccc([N+](=O)[O-])cn2)cc(OC)c1OC 4045952 VWTZGVQGXDCNEV-UHFFFAOYSA-N 333.300 2.268 5 50 EEBA COC(=O)c1ccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 148544 WOKUBAMSQCAANK-UHFFFAOYSA-N 331.280 2.366 5 50 EEBA CCCc1cc(=O)[nH]c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)n1 8576636 BQNMONXLLCRSMN-UHFFFAOYSA-N 348.384 2.361 5 50 EEBA O=C1NCCCN1C1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 253392440 ZCUVUHYTRRBYNW-UHFFFAOYSA-N 336.367 2.114 5 50 EEBA N=C1NC(=O)/C(=C/c2ccc(Br)c([N+](=O)[O-])c2)S1 4578035 QMZMFQSCRVRMSU-YWEYNIOJSA-N 328.147 2.496 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 120356 YUKLIBYIOFJUNF-QGZVFWFLSA-N 326.308 2.032 5 50 EEBA Cc1nn(CCC(=O)N[C@@H]2CCc3c(O)cccc32)c(C)c1[N+](=O)[O-] 111604523 FYUYYDQCOPDSSF-CQSZACIVSA-N 344.371 2.308 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2ccn[nH]2)C1 172306908 WVLWOSXFYKEUCG-ZDUSSCGKSA-N 329.360 2.407 5 50 EEBA COc1ccc(CN[C@@H]2COc3ccccc3[C@@H]2O)cc1[N+](=O)[O-] 288540054 KURSSSPCADETKR-DYVFJYSZSA-N 330.340 2.188 5 50 EEBA COC(=O)c1ccc(Sc2ncnc3nc[nH]c23)c([N+](=O)[O-])c1 4565134 VWUFMFQTOKJJEW-UHFFFAOYSA-N 331.313 2.199 5 50 EEBA COc1ccc(NC(=O)CSc2nnc(C)s2)c([N+](=O)[O-])c1 4695045 BQRSHARKWNKYHW-UHFFFAOYSA-N 340.386 2.494 5 50 EEBA Cn1cc(N2CCC[C@@H](Sc3ccc([N+](=O)[O-])cn3)C2=O)cn1 159646985 ASTTVMWRIYFFLS-GFCCVEGCSA-N 333.373 2.011 5 50 EEBA Cc1cccc(CN2CCC(Nc3ncc([N+](=O)[O-])c(N)n3)CC2)c1 170633464 AJEPFLSFSJXPSF-UHFFFAOYSA-N 342.403 2.352 5 50 EEBA C[N+](C)(C)CCc1cc(CC[N+](C)(C)C)cc(CC[N+](C)(C)C)c1 1775970875 TTWUPXYBTJSDAQ-UHFFFAOYSA-N 336.588 2.433 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](c1ccc(Cl)nc1)C1CC1 408516671 NKDWNPRRDDXNEB-CQSZACIVSA-N 335.751 2.107 5 50 EEBA COc1ccc([C@H]2CCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])cc1OC 159526359 UPQSYFAESVHXLF-LLVKDONJSA-N 346.343 2.312 5 50 EEBA Cc1nc(C2CCN(c3nc4ccccn4c3[N+](=O)[O-])CC2)no1 225526302 FGDFYVNFORNPHA-UHFFFAOYSA-N 328.332 2.318 5 50 EEBA Cc1cc(=O)n(Cc2cc(=O)oc3c(C)c(O)ccc23)cc1[N+](=O)[O-] 128675813 DXOUSDSEUTVMFO-UHFFFAOYSA-N 342.307 2.234 5 50 EEBA C[N@+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@H]32)[C@H]6[C@H]54 252441061 CTCZKABHVPGYMK-BCZLKOQISA-N 349.454 2.237 5 50 EEBA O=C(C1CC1)[C@@H]1CN(c2ccc([N+](=O)[O-])c3cnccc23)CCO1 170598742 KTNRVDUOHOMCMV-INIZCTEOSA-N 327.340 2.327 5 50 EEBA Cc1cc(NC(=O)COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)no1 443982 BGCJWFPTDYFRSO-QPJJXVBHSA-N 331.284 2.086 5 50 EEBA COC(=O)c1ccnc(N[C@H]2CCc3ncsc3C2)c1[N+](=O)[O-] 952877983 XGCUMTSMJBXVOC-QMMMGPOBSA-N 334.357 2.202 5 50 EEBA Cc1cc(S(=O)(=O)N2C[C@H](CO)c3ccccc32)ccc1[N+](=O)[O-] 292689746 KXPNKZDQBWMZIM-GFCCVEGCSA-N 348.380 2.188 5 50 EEBA COC(=O)Cc1ccc(N2C[C@H](C)O[C@H](C3CC3)C2)c([N+](=O)[O-])c1 296837684 SNKJWOHGBWXSFK-ZBEGNZNMSA-N 334.372 2.314 5 50 EEBA Cc1ncc([N+](=O)[O-])n1S(=O)(=O)c1ccc(Br)cc1 190005 DZJQJQQEENMDNA-UHFFFAOYSA-N 346.162 2.099 5 50 EEBA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 3873374 GWBPFRGXNGPPMF-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA biogenic,in-man NC(=O)c1ccccc1Nc1ccn2c(=O)c3ccccc3nc2n1 271832 VIFKYDXNCQKXTL-UHFFFAOYSA-N 331.335 2.085 5 50 EEBA Cc1ccc(C(=O)NC(=S)N2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 1049953 ODAFQOSBMYOKRP-GHMZBOCLSA-N 337.401 2.027 5 50 EEBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)n1cc(Cl)cn1 4744946 VRLBZOUNTYEJPH-UHFFFAOYSA-N 348.544 2.053 5 50 EEBA COc1cc(N2CCC[C@H]([C@H](O)c3nccn3C)C2)ccc1[N+](=O)[O-] 269351734 JUSSEXCNZBTNGB-LRDDRELGSA-N 346.387 2.287 5 50 EEBA COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(c3cnn(C)c3)CC2)c1 123462036 NSSBHJISMOXPHN-UHFFFAOYSA-N 344.371 2.357 5 50 EEBA O=[N+]([O-])c1cnc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)s1 192514780 FTIBDLUIVBILNA-OLZOCXBDSA-N 334.401 2.099 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](c2ccccn2)C1 798479479 GQCYEUBBELYBAE-ZDUSSCGKSA-N 347.396 2.476 5 50 EEBA CN(C)C(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1 5050994 NNLFCQOESBIDTG-FOWTUZBSSA-N 339.351 2.454 5 50 EEBA CC(=O)NN1C(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2C1=O 138751 NTHPSDJLVXBITC-UHFFFAOYSA-N 341.279 2.034 5 50 EEBA CCn1ccnc1[C@@H]1OCCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1 900761025 CHWXWRVGMBSIGM-HUUCEWRRSA-N 344.371 2.461 5 50 EEBA COc1cc(CN2CCN3CCC[C@@H]3[C@@H]2C)c([N+](=O)[O-])cc1OC 6416981 UQLQHGQDTZRGQL-GXTWGEPZSA-N 335.404 2.281 5 50 EEBA CCC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](O)(C(F)(F)F)C1 81436 HTKICTPSGNSXBV-GFCCVEGCSA-N 331.250 2.458 5 50 EEBA CCC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@](O)(c2ccncc2)C1 302259 RLMRJGBZNPAVNP-QGZVFWFLSA-N 340.339 2.447 5 50 EEBA CC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@H]2C(C)=NN=C2C[C@]1(C)O 239331309 KLUFAIXBSGETEP-HZMVEIRTSA-N 329.356 2.485 5 50 EEBA O=[N+]([O-])c1cnc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)s1 192514767 FTIBDLUIVBILNA-CHWSQXEVSA-N 334.401 2.099 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN=C2c2ccccc2)cc1 1875302186 CULXPVXLZIZDHF-UHFFFAOYSA-N 331.353 2.046 5 50 EEBA COc1cc(CN(CCO)Cc2ccccc2)cc([N+](=O)[O-])c1O 23281943 YIDXEMWWCDBATH-UHFFFAOYSA-N 332.356 2.304 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(O)(c2ccccc2)CC1 189793103 INPVTNSYMGEHRG-UHFFFAOYSA-N 341.367 2.301 5 50 EEBA Cc1nccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)cn1 225534876 HPKIKUWNFJUDLX-UHFFFAOYSA-N 338.327 2.318 5 50 EEBA O=C1NCCCC[C@H]1CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 225608234 QSYZMXVCXRMISR-AWEZNQCLSA-N 345.399 2.392 5 50 EEBA NC(=O)c1ccc(CN2CCCC[C@H]2c2cn[nH]c2)c([N+](=O)[O-])c1 114203002 JBKRKYBQTYZDCJ-AWEZNQCLSA-N 329.360 2.144 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O 239173652 OJSWZGUESFPIQQ-MZUWNQQASA-N 340.335 2.161 5 50 EEBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC1(C)OCCCO1 281923187 JWZSAVWCPGYAPB-UHFFFAOYSA-N 339.348 2.268 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(N2CC(Nc3ccccc3)C2)n1 952992269 CJHXKMRFZUJQCS-UHFFFAOYSA-N 328.328 2.077 5 50 EEBA COc1ccc(NC(=O)c2[nH]nc(OC)c2[N+](=O)[O-])cc1Cl 6621671 GGAHQUVJXGANEP-UHFFFAOYSA-N 326.696 2.241 5 50 EEBA C[N+]1(CCO[S@](=O)C23CC4CC(CC(C4)C2)C3)CCOCC1 4165216 OOJIKVGIQWSDDI-JENGMOOGSA-N 328.498 2.112 5 50 EEBA Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(C2OCCCO2)c1 2755243 LTPGBFZQXRERLB-UHFFFAOYSA-N 332.316 2.016 5 50 EEBA O=C(NCc1nc2cccnc2[nH]1)c1cc(Cl)cc([N+](=O)[O-])c1 194244819 CAXYMKYJMKZWCY-UHFFFAOYSA-N 331.719 2.450 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1 247708 XODLTOYHPDBTRW-UHFFFAOYSA-N 347.396 2.106 5 50 EEBA Cn1cc(C2CCN(C(=O)c3ccc([N+](=O)[O-])c(O)c3)CC2)cn1 131871547 PDNSUDIAJSJYLI-UHFFFAOYSA-N 330.344 2.054 5 50 EEBA O=[N+]([O-])c1ccc([C@@]2(O)C[C@H](C(Cl)(Cl)Cl)NO2)cc1 500038 UFXRKGGEIQEOMD-RKDXNWHRSA-N 327.551 2.404 5 50 EEBA O=C(O)c1cccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c1 3000225 OGLKNFYNGWOXRZ-UHFFFAOYSA-N 345.336 2.420 5 50 EEBA CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CN2CCC1CC2 347951925 QFIQSQMLOUTRFC-KRWDZBQOSA-N 346.431 2.340 5 50 EEBA COc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 183371 KFMJDJOTJHGYCD-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA Cn1cc([C@H]2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cn1 116320329 MHYMCPIFCODIKO-LBPRGKRZSA-N 344.371 2.184 5 50 EEBA CCOC(=O)c1cc(NC(=O)c2cc(OCC)ccc2[N+](=O)[O-])[nH]n1 239637119 BIXSRLDZEAUBTP-UHFFFAOYSA-N 348.315 2.146 5 50 EEBA CCOC(=O)Cc1csc(NC(=O)c2ccc([N+](=O)[O-])o2)n1 3164578 ATIRRCHVMBNHGD-UHFFFAOYSA-N 325.302 2.002 5 50 EEBA C[N@+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@H]32)[C@@H]6[C@@H]54 252441063 CTCZKABHVPGYMK-ROMDEGCMSA-N 349.454 2.237 5 50 EEBA NC(=O)c1[nH]c2c(Cl)cc([N+](=O)[O-])cc2c1CCCC(=O)O 1775971588 WBPFRDXNHHFFEP-UHFFFAOYSA-N 325.708 2.236 5 50 EEBA COc1ccc(C(=O)NCC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 471734 DCWXIIJHYFDODZ-UHFFFAOYSA-N 344.323 2.077 5 50 EEBA Cc1sc2ncn3nc(Cn4nc([N+](=O)[O-])cc4C)nc3c2c1C 2808757 OCXDOSIOBBBOMQ-UHFFFAOYSA-N 343.372 2.417 5 50 EEBA COc1ccc(CN[C@@](C)(CO)c2cccc(O)c2)cc1[N+](=O)[O-] 451033439 UGAIMUCYVZGXHY-KRWDZBQOSA-N 332.356 2.306 5 50 EEBA CN(Cc1csc(Br)c1)C(=O)c1n[nH]cc1[N+](=O)[O-] 119187124 UCSAZODPLAWUBO-UHFFFAOYSA-N 345.178 2.414 5 50 EEBA Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCCCC(C)(C)CO)c1C 121674221 CZOWCRGSXVRHEI-UHFFFAOYSA-N 344.433 2.289 5 50 EEBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H]1c1ccc2c(c1)OCCCO2 242389670 ZZLCSAZMBMQSEV-HZSPNIEDSA-N 332.356 2.177 5 50 EEBA CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1 457336 GBBDHRYWPDHSTO-GFCCVEGCSA-N 336.344 2.019 5 50 EEBA C[C@]12CCN(C[C@H](O)COc3cccc([N+](=O)[O-])c3)C[C@H]1C2(F)F 428721062 SKUANFXGCPKYGJ-CFVMTHIKSA-N 342.342 2.312 5 50 EEBA CC(=O)c1cc([N+](=O)[O-])ccc1NCCNC(=O)c1ccc(O)cc1 252500321 SSDAQUZYFSCCPZ-UHFFFAOYSA-N 343.339 2.345 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1NCc1nc(O)c2ccccc2n1 408522892 DUBLCNDDVUONQW-UHFFFAOYSA-N 328.332 2.381 5 50 EEBA CCC1=NN(C(=O)c2ccccc2[N+](=O)[O-])[C@](O)(C(F)(F)F)C1 436123 NELUTXDINSADRJ-GFCCVEGCSA-N 331.250 2.458 5 50 EEBA CN(C)c1ncccc1O[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 281849212 MCJFUIWOKNJEQT-ZDUSSCGKSA-N 329.360 2.109 5 50 EEBA O=C(c1ccc(Nc2ncccc2[N+](=O)[O-])cc1F)N1CCOCC1 253433077 RNYBBOMDLDAILW-UHFFFAOYSA-N 346.318 2.345 5 50 EEBA O=C1O[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3c1nc(-c2ccc([N+](=O)[O-])cc2)no1 197193207 NNQNAIAOFWBWKX-WECGXBHGSA-N 327.296 2.310 5 50 EEBA COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccn(C(C)C)n1 281270036 WXWOCVKTFLXOKK-UHFFFAOYSA-N 340.361 2.182 5 50 EEBA O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCN(c2ncccn2)CC1 375393 CJPQUMWYBMINEC-UHFFFAOYSA-N 347.762 2.001 5 50 EEBA COc1cc(C=O)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 2986420 XCTZDJRGLODNOG-UHFFFAOYSA-N 337.309 2.184 5 50 EEBA C[C@@H](NC(N)=O)c1noc(C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 253432112 VXDKZARURJIORW-SSDOTTSWSA-N 337.311 2.172 5 50 EEBA O=C(O)c1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 357433224 CZZFCZSGXPXVAI-UHFFFAOYSA-N 326.308 2.492 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccc(Cl)cc3[N+](=O)[O-])C(=O)[C@H]12 245227076 YSONTOHIUUJOAN-YXMPFFBPSA-N 334.715 2.081 5 50 EEBA CC[C@H](C)[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)OC)c1)C(=O)N(C)C 225519095 IMVWAGBOENOZPE-HZMBPMFUSA-N 337.376 2.296 5 50 EEBA Cc1nc(N2CCC[C@H](CN=S(C)(C)=O)C2)ccc1[N+](=O)[O-] 952992513 GZJJVGIOTMQULJ-GFCCVEGCSA-N 326.422 2.242 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccc([N+](=O)[O-])cc1 4152263 QWVVOELFHDMORY-CQSZACIVSA-N 348.355 2.052 5 50 EEBA O=C1[C@H]2CCCC[C@@H]2C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 13603359 VMUHWBDIKFRNAE-UWVGGRQHSA-N 334.288 2.005 5 50 EEBA CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 147805 OTFVSHQMLRFUHZ-AWEZNQCLSA-N 343.343 2.427 5 50 EEBA O=[N+]([O-])c1c(N[C@H](CO)C[C@H](O)c2ccccc2)nc2sccn12 269905261 GUKCTJWYDWZDKF-RYUDHWBXSA-N 348.384 2.201 5 50 EEBA CCO[C@@H]1C[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1(CC)CC 408515270 BVOQGKSYSDHYBP-NWDGAFQWSA-N 336.392 2.286 5 50 EEBA COc1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1 1385523 HVRUITTYWYPZQL-UHFFFAOYSA-N 339.311 2.436 5 50 EEBA CS(=O)(=O)c1cccnc1CNc1ncc([N+](=O)[O-])cc1Cl 362857648 XRPWKKAAKPMEPX-UHFFFAOYSA-N 342.764 2.054 5 50 EEBA Cc1cc(O)nc(N2CCC[C@H](Nc3cc(C)c([N+](=O)[O-])cn3)C2)n1 952994109 MCTJEYJBZHNZHR-LBPRGKRZSA-N 344.375 2.183 5 50 EEBA N[C@@H](Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1)C(=O)O 2575521 OHFDOVYRFJQGIR-LBPRGKRZSA-N 347.283 2.250 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 120352 YUKLIBYIOFJUNF-KRWDZBQOSA-N 326.308 2.032 5 50 EEBA CN1CCN(c2ccc([N+](=O)[O-])cc2NC(=O)c2ccco2)CC1 5048926 PKNMGNVMKCLCTL-UHFFFAOYSA-N 330.344 2.192 5 50 EEBA CC(=O)Oc1ccccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 241272 XENPBKONCCVRIF-UHFFFAOYSA-N 326.264 2.321 5 50 EEBA COC(=O)c1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 306863 HBIFHUCJKIVXOH-UHFFFAOYSA-N 330.296 2.399 5 50 EEBA O=c1cccc2n1C[C@H]1C[C@H]2CN(Cc2cccc([N+](=O)[O-])c2)C1 102729547 RYTJWZVFNQIWKR-GJZGRUSLSA-N 325.368 2.376 5 50 EEBA O=C1[C@H]2CC=C(Cl)C[C@H]2C(=O)N1CNc1cccc([N+](=O)[O-])c1 282947 JQXAVCCXLFHOSU-QWHCGFSZSA-N 335.747 2.482 5 50 EEBA NC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(Cc2ccccc2)CC1 55470088 FOXCYCXVNBGXLB-UHFFFAOYSA-N 340.383 2.016 5 50 EEBA CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CN2CCC1CC2 347951929 QFIQSQMLOUTRFC-QGZVFWFLSA-N 346.431 2.340 5 50 EEBA O=C(Nc1cc(Cl)cc([N+](=O)[O-])c1O)[C@H]1CCc2cn[nH]c2C1 253630311 ZPORGJFZXSZVDP-ZETCQYMHSA-N 336.735 2.421 5 50 EEBA Nc1ccc(C(=O)NCCOc2ccc(Cl)cn2)cc1[N+](=O)[O-] 128375950 PAONXDYOOSYSQF-UHFFFAOYSA-N 336.735 2.034 5 50 EEBA Cc1ccc(C(=O)O)cc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 239293 VBOHWCIYEAWYFU-UHFFFAOYSA-N 326.264 2.402 5 50 EEBA Cc1ccc(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 1066384 XYNJRILWJTTZHL-UHFFFAOYSA-N 339.307 2.138 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2cccs2)c2cc([N+](=O)[O-])ccc21 4985657 SKIZMVNBUNRYMF-OAHLLOKOSA-N 332.337 2.093 5 50 EEBA Cc1nn([C@H](C)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1[N+](=O)[O-] 2778358 DPXIMDOMLKOQTC-LLVKDONJSA-N 337.424 2.086 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@]2(O)CCCC[C@@H]2C1 160965645 MLFNLUJNNIAZLO-PBHICJAKSA-N 333.388 2.431 5 50 EEBA O=C(c1cc(C2CC2)[nH]n1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188568505 KOLQUHWTTBPSRV-UHFFFAOYSA-N 328.328 2.099 5 50 EEBA CCCCOCCCNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 2988272 KFLMDPHNZKOIMA-UHFFFAOYSA-N 338.360 2.318 5 50 EEBA Cn1c(=O)c(=O)n(C)c2cc([N+](=O)[O-])c(C3[C@H]4CCC[C@H]3CC4)cc21 334162896 GJQYCWPWJVXWGB-QWRGUYRKSA-N 343.383 2.439 5 50 EEBA O=[N+]([O-])c1ccc2c(c1N1CCCN(c3cccnn3)CC1)CCN2 253432077 IVUPZKXSXRNYAD-UHFFFAOYSA-N 340.387 2.070 5 50 EEBA COc1cccc(C2=CCN(C(=O)c3cnc(O)c([N+](=O)[O-])c3)C2)c1 365786572 HIEMHCCQIKPSEJ-UHFFFAOYSA-N 341.323 2.243 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N1C[C@H](C)O[C@@H](C)C1 5041520 MYEHNMMOVPEOJM-UWVGGRQHSA-N 325.390 2.409 5 50 EEBA C[C@@H]1CC[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3C(=O)O)C(=O)[C@H]2C1 239025598 BWIBNESTAZDYGU-QRTLGDNMSA-N 332.312 2.219 5 50 EEBA O=C1[C@H]2CC=C(Cl)C[C@@H]2C(=O)N1CNc1cccc([N+](=O)[O-])c1 100590815 JQXAVCCXLFHOSU-STQMWFEESA-N 335.747 2.482 5 50 EEBA Cc1ccc(C)c(-n2ccc3nc4ccn(N)c(=O)c4cc3c2=O)c1 40398738 LZWIAXFYFPPPEO-UHFFFAOYSA-N 332.363 2.031 5 50 EEBA CCN1C(=O)[C@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 315243 LQESQMJDLIEEOV-SFHVURJKSA-N 340.335 2.422 5 50 EEBA CCC1(CC)CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCS1 274461353 LDEIGXUOHRIEMT-UHFFFAOYSA-N 325.390 2.443 5 50 EEBA O=C(O)c1cccc([N+](=O)[O-])c1C(=O)Nc1ccc([N+](=O)[O-])cc1 4012903 WCFIMUCZBGRZPI-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA O=C(O)c1cc(NC(=O)c2ccccc2[N+](=O)[O-])cc(C(=O)O)c1 138757 AXRXIIZTCQUZPQ-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA O=C(NC[C@@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])c(O)c1 271839318 QJTBTFZFVRFTGA-GFCCVEGCSA-N 336.344 2.106 5 50 EEBA O=C(Cn1c(NCCO)nc2ccccc21)c1cccc([N+](=O)[O-])c1 2941574 ZXAWCIYGRGUMMP-UHFFFAOYSA-N 340.339 2.232 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1cccc2ccc(O)cc12 127746014 IROVAFXDLIEQLT-UHFFFAOYSA-N 339.307 2.254 5 50 EEBA C[C@H]1CN(C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] 448945007 GDPGXOXTCPJQDY-VIFPVBQESA-N 331.294 2.390 5 50 EEBA O=C(Nc1ccc(N2CCCC2=O)cn1)c1ccc(O)c([N+](=O)[O-])c1 408514026 CRCWJJRNYYUVFT-UHFFFAOYSA-N 342.311 2.075 5 50 EEBA Cc1cc(NC(=O)c2cc([N+](=O)[O-])nn2C)nn1Cc1ccccc1 4776264 QXLLKUVPARBLQM-UHFFFAOYSA-N 340.343 2.134 5 50 EEBA CC(=O)c1ccc(N2[C@H](C(N)=O)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 248378795 KQFYZIUDRBWDIU-ZENOOKHLSA-N 331.372 2.420 5 50 EEBA COc1n[nH]c(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1[N+](=O)[O-] 17071481 KAPPZRSNNWVIST-UHFFFAOYSA-N 341.667 2.140 5 50 EEBA Cc1ccc(CCNc2c([N+](=O)[O-])nn(-c3ccccc3)[n+]2[O-])cc1 4828173 AUDXMIMLQFERMJ-UHFFFAOYSA-N 339.355 2.377 5 50 EEBA Cc1ccc([N+](=O)[O-])c(OCCOCCN2C[C@@H](C)O[C@H](C)C2)c1 20653586 VUMZMWOKZQZPFX-HUUCEWRRSA-N 338.404 2.408 5 50 EEBA Cc1cc([N+](=O)[O-])cnc1N1CCC[C@@H](c2nc(N(C)C)no2)C1 253433030 QYVRQJQQTFFDRW-LLVKDONJSA-N 332.364 2.131 5 50 EEBA COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(F)c(C)c1 183830773 PPZMGDWHDSCHMW-CYBMUJFWSA-N 336.275 2.279 5 50 EEBA CCCNc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(=O)CCC 864085971 HAWSJTFSKJUCPV-UHFFFAOYSA-N 329.378 2.022 5 50 EEBA C[C@H]1[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCN1C 332477407 VMMZITMXXYIZSM-KBPBESRZSA-N 346.431 2.360 5 50 EEBA CC(=O)Oc1ccccc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 60129 ZUJSBXAXRUOMIK-UHFFFAOYSA-N 326.264 2.321 5 50 EEBA COc1ccccc1CNc1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-] 4828872 DBFXVDSUQDCDTJ-UHFFFAOYSA-N 341.327 2.035 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@H]1c1ccccc1 188229835 PRCLDKAVDZVPJW-CVEARBPZSA-N 327.340 2.437 5 50 EEBA O=[N+]([O-])c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cn1 355722726 RDDBZLBRNDPPJC-QGZVFWFLSA-N 328.372 2.039 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 73310 XCRDLYFXFXYOEY-QGZVFWFLSA-N 326.308 2.032 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(c2ccccc2)CC1 272140 MJBFQNWBBGGRHZ-UHFFFAOYSA-N 347.396 2.106 5 50 EEBA O=C(NCc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])c(O)c1 357672242 QIFRBUVAQVABOD-UHFFFAOYSA-N 344.323 2.392 5 50 EEBA Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)[C@H]4C[C@H]4[N+](=O)[O-])C3)nc2c1 252523260 CEYWMSKIFFYCTG-TYNCELHUSA-N 328.372 2.243 5 50 EEBA Cc1cc(C(=O)N2CCN(C3CCOCC3)C[C@H]2C)cc([N+](=O)[O-])c1 369667285 UWCBPTMWCRWEDD-CQSZACIVSA-N 347.415 2.229 5 50 EEBA O=Cc1ccccc1OC(=O)C[S@](=O)c1ccccc1[N+](=O)[O-] 5014260 FKQHKNVXTRHPCA-HSZRJFAPSA-N 333.321 2.121 5 50 EEBA Cc1nc(NC(=O)[C@H]2CCCN2C(=O)C2CCCC2)ccc1[N+](=O)[O-] 133558927 DYVDJCCUKATWLF-CQSZACIVSA-N 346.387 2.418 5 50 EEBA C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nc2ccccc2s1 754704120 LGIOSHYQAKTZPH-PWSUYJOCSA-N 347.400 2.113 5 50 EEBA Cc1cccc(C(=O)Nc2cccc(-c3n[nH]c(=O)[nH]3)c2)c1[N+](=O)[O-] 253418137 LJDGJTFNIKDQIQ-UHFFFAOYSA-N 339.311 2.234 5 50 EEBA Cc1ccc(CN2CCCC2)cc1NC(=O)c1n[nH]cc1[N+](=O)[O-] 159715627 RYMQFUOBALCDAI-UHFFFAOYSA-N 329.360 2.474 5 50 EEBA O=C(N[C@@H](C(=O)O)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2169862 MIVUDAUOXJDARR-CYBMUJFWSA-N 345.267 2.059 5 50 EEBA in-vitro O=C(Cn1cnc([N+](=O)[O-])n1)Nc1nc2c(Cl)cccc2s1 225407249 XLHVCYXWOLOFTO-UHFFFAOYSA-N 338.736 2.088 5 50 EEBA Cc1cccc([N+](=O)[O-])c1C(=O)NCCNC(=O)CC1CCCC1 225561056 ZTXSHXPFHYCJDT-UHFFFAOYSA-N 333.388 2.330 5 50 EEBA C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@@H](O)c1ccc(F)cc1 170087776 YLLMLGZYCWOCGD-RFAUZJTJSA-N 331.307 2.311 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-] 17072352 DFIXNPMJDGXDQG-ZDUSSCGKSA-N 348.355 2.052 5 50 EEBA CC(C)C[C@@]1(C)CC(=O)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O 137066629 BHNKGEJDIWNAMK-YOEHRIQHSA-N 334.372 2.440 5 50 EEBA Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@H](C)[S@@](C)=O 120346631 ZJLUETSSNQGUPP-SAHAZLINSA-N 327.406 2.490 5 50 EEBA CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1 457335 GBBDHRYWPDHSTO-LBPRGKRZSA-N 336.344 2.019 5 50 EEBA COC(=O)c1ccnc(NCC2(Br)CC2)c1[N+](=O)[O-] 952877396 POXSZADVEGIMET-UHFFFAOYSA-N 330.138 2.116 5 50 EEBA CC(=O)c1ccc(N2CCC(Cn3cncn3)CC2)c([N+](=O)[O-])c1 275041595 QPFLDPNRNNURQH-UHFFFAOYSA-N 329.360 2.306 5 50 EEBA COc1ccc([N+](=O)[O-])c(CC(=O)NCCc2cccnc2)c1F 408521128 JNSHDLSDCXMBHR-UHFFFAOYSA-N 333.319 2.039 5 50 EEBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H](c2cccs2)C1 180865947 GCUGLQVFJVGNJW-LBPRGKRZSA-N 333.369 2.452 5 50 EEBA C[C@H](Sc1nnc(O)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 170085208 IFABOYHYQLPJMU-LURJTMIESA-N 334.317 2.322 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1=O 100178909 RVKRGQRTAABIGB-FCIDVOKBSA-N 328.324 2.305 5 50 EEBA CCn1cc([C@H]2OCCC[C@@H]2NC(=O)c2cccc([N+](=O)[O-])c2)cn1 432762411 GGXZXTRECZAWLY-JKSUJKDBSA-N 344.371 2.461 5 50 EEBA O=C1CCc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3O)cc2N1 182048851 ZLYRNLCWXZSJGO-UHFFFAOYSA-N 327.296 2.437 5 50 EEBA CC(C)c1ccc(C(=O)N[C@H]2CCC[C@H](C(N)=O)C2)cc1[N+](=O)[O-] 188032360 MLPBLKXMNPBDAX-AAEUAGOBSA-N 333.388 2.492 5 50 EEBA Cc1cc(O)nc(N2CC[C@H](Nc3ccc(F)cc3[N+](=O)[O-])C2)n1 952994931 WZJNLGJVAMFOPE-NSHDSACASA-N 333.323 2.229 5 50 EEBA O=[N+]([O-])c1ccc2c(c1)nnn2CNc1nonc1-c1ccccc1 434688 MLVOEATVFJVCRH-UHFFFAOYSA-N 337.299 2.459 5 50 EEBA Nc1ncc(-c2cc(Cl)ccc2[N+](=O)[O-])c(SCC(=O)O)n1 3130183 BMZUGBSNKHEROW-UHFFFAOYSA-N 340.748 2.464 5 50 EEBA Cn1c(SCC(=O)N2CCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 467237 XLHDWAOFQWBQGQ-UHFFFAOYSA-N 347.400 2.105 5 50 EEBA COC(=O)c1cc(C(=O)Nc2nc(C)cc(C)n2)cc([N+](=O)[O-])c1 2852280 SPZTXXQRBGSYID-UHFFFAOYSA-N 330.300 2.041 5 50 EEBA C[C@@H](Cn1ncc2ccccc2c1=O)Nc1ncc([N+](=O)[O-])s1 192516167 IWFHETGCHNEUOV-VIFPVBQESA-N 331.357 2.262 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2 101357944 JBCAMKLHDOHEPK-YIKOMLBNSA-N 340.335 2.305 5 50 EEBA CCc1nnnn1-c1ccccc1NC(=O)c1ccc([N+](=O)[O-])s1 136629995 NCDCPOABOUHXSO-UHFFFAOYSA-N 344.356 2.447 5 50 EEBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC([C@@H](O)C(F)(F)F)CC1 151038062 DDRDWYUSEUSZQA-GFCCVEGCSA-N 348.277 2.076 5 50 EEBA CC(C)NC(=O)N1CCC[C@H]1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] 177863382 GEFPITAGZLRTFO-HNNXBMFYSA-N 348.403 2.136 5 50 EEBA Cc1cnc(OCC(=O)N2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 170022090 OIBVANMVISVHAQ-SNVBAGLBSA-N 347.293 2.478 5 50 EEBA O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(O)nn1 187420608 FLJIIPZPYCTVNV-UHFFFAOYSA-N 346.346 2.289 5 50 EEBA COc1ccc([N+](=O)[O-])cc1CNc1nnnn1-c1ccccc1 301076307 DRFYXNSMXUNZNV-UHFFFAOYSA-N 326.316 2.191 5 50 EEBA CCOc1ccc(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c([N+](=O)[O-])c1 239403081 RMFAUPVCEYYWTE-FCIDVOKBSA-N 346.339 2.455 5 50 EEBA Cc1ccccc1[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2C)CCN1 825189393 FDYCSTRAQKYZIT-QGZVFWFLSA-N 340.383 2.393 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1 4152280 KHQPILQHBIECIS-AWEZNQCLSA-N 348.355 2.052 5 50 EEBA COc1ccc(C(=O)NC(=S)Nc2cc(C)ccn2)cc1[N+](=O)[O-] 309602 BMGPVQBGFOGUKW-UHFFFAOYSA-N 346.368 2.434 5 50 EEBA Cc1ccccc1[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2C)CCN1 825189392 FDYCSTRAQKYZIT-KRWDZBQOSA-N 340.383 2.393 5 50 EEBA O=C(c1cccs1)N1C[C@H]2C[C@H](C1)c1ccc([N+](=O)[O-])c(=O)n1C2 1857526230 CTJVGPQXRYAGOZ-GHMZBOCLSA-N 345.380 2.078 5 50 EEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](Cc2nn[nH]n2)C1 1875272862 SSNFYGRMOLPWMJ-QMMMGPOBSA-N 342.281 2.196 5 50 EEBA CCOC(=O)c1cnc(C)c(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c1 356288941 CSSAGEYAPACWHJ-UHFFFAOYSA-N 345.311 2.433 5 50 EEBA COc1ccc(Br)cc1[C@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 88907 GYNLENYWMBGSAY-JOYOIKCWSA-N 329.150 2.054 5 50 EEBA C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nncn1C 194250605 QAYMXOJFHMJNCB-SECBINFHSA-N 345.384 2.472 5 50 EEBA CCc1nc(CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])cs1 170604200 IQZARZCFFMVYGX-UHFFFAOYSA-N 331.357 2.462 5 50 EEBA CCc1[nH]nc(C(=O)N2CCCN(C)c3ccccc32)c1[N+](=O)[O-] 192596525 FNQUMTKRRRXPHQ-UHFFFAOYSA-N 329.360 2.367 5 50 EEBA COc1ccc(-n2c(S)nnc2Cn2nc([N+](=O)[O-])cc2C)cc1 6533762 WPNSTJYFFUIKQV-UHFFFAOYSA-N 346.372 2.026 5 50 EEBA CCC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@](O)(C(F)(F)F)C1 108257 MLMYUQKPABAGRO-ZDUSSCGKSA-N 345.277 2.387 5 50 EEBA COC(=O)CNC(=O)CCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 4542657 VHJWSBGZAOEBFS-UHFFFAOYSA-N 332.312 2.077 5 50 EEBA O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCn2c(nnc2C(F)F)C1 408515634 KFVBLNACDSBPNN-AATRIKPKSA-N 349.297 2.180 5 50 EEBA Cn1cc(C(=O)O[C@@H]2CCCN(c3ccc(F)cc3[N+](=O)[O-])C2)cn1 170605083 WFGJIAFAMATDCR-CYBMUJFWSA-N 348.334 2.293 5 50 EEBA O=C1c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[S@@](=O)N1c1ccccc1 245235768 NDEKPPFFSPXGCF-HSZRJFAPSA-N 333.281 2.186 5 50 EEBA Cc1cccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)n1 5050172 ITZZXJCLHWDKKB-UHFFFAOYSA-N 342.355 2.387 5 50 EEBA COc1cc2c(cc1OC)[C@@H](C)N(c1ncnc(N)c1[N+](=O)[O-])CC2 4059595 PCRYCHOKIBKTJB-SECBINFHSA-N 345.359 2.108 5 50 EEBA C[C@H]1C[C@H](C(=O)O)CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 263367559 UGZIHEKQRGFYGX-WPRPVWTQSA-N 326.736 2.431 5 50 EEBA COC(=O)c1cc(C)nc(NCC2(Br)CC2)c1[N+](=O)[O-] 952877550 RCOFVNVGAIRXAI-UHFFFAOYSA-N 344.165 2.424 5 50 EEBA CC1CCN(c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])CC1 4826638 HZPKYOGYYMAOOI-UHFFFAOYSA-N 337.767 2.304 5 50 EEBA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2[N+](=O)[O-])cc1 3832972 CXXWYBQCIBCFRI-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA Cc1ccn(Cc2csc(-c3ncccn3)n2)c(=O)c1[N+](=O)[O-] 225473879 VSUZTPLJOVFILE-UHFFFAOYSA-N 329.341 2.027 5 50 EEBA COC(=O)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 183352 QHGUQTBMHZZNAP-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc([N+](=O)[O-])ccc1OCC 619476 BNZDGZAUNSEZNI-CQSZACIVSA-N 349.343 2.185 5 50 EEBA C[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])N1CCOC[C@H]1C 252510852 CHBMRYAOPQIKSG-GHMZBOCLSA-N 341.795 2.087 5 50 EEBA O=C(CCN1C(=O)c2ccccc2C1=O)Nc1ccccc1[N+](=O)[O-] 4036721 AHMNIEJHBAPISR-UHFFFAOYSA-N 339.307 2.220 5 50 EEBA O=c1cccc2n1C[C@H]1C[C@H]2CN(Cc2ccccc2[N+](=O)[O-])C1 100504280 MJYXEPIJNWYEMC-ZFWWWQNUSA-N 325.368 2.376 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N=c1nc(C(C)C)[nH]s1 1875279142 RDGJMDNYZIXKFN-UHFFFAOYSA-N 342.402 2.101 5 50 EEBA CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 147808 QXKAZVBKEYQWPQ-CQSZACIVSA-N 343.343 2.427 5 50 EEBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](c2cccs2)C1 180865962 GCUGLQVFJVGNJW-GFCCVEGCSA-N 333.369 2.452 5 50 EEBA O=C(N[C@@H]1CCCC[C@H]1n1cccn1)c1ccc(O)c([N+](=O)[O-])c1 119111308 AMPZEHTXOICULC-CHWSQXEVSA-N 330.344 2.411 5 50 EEBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)C(=O)NC2=O 453016 YHHVPDQHTKTUBE-FPYGCLRLSA-N 337.291 2.130 5 50 EEBA Cc1nc(N2CCN(C[C@@H](O)c3ccccc3)CC2)ccc1[N+](=O)[O-] 150767173 NVPUKCQJZMQZMC-QGZVFWFLSA-N 342.399 2.154 5 50 EEBA COC(=O)C1=C(C)NC(C)=C(C(=O)O)[C@H]1c1cccc([N+](=O)[O-])c1 19314837 JPXPPUOCSLMCHK-CQSZACIVSA-N 332.312 2.087 5 50 EEBA in-vitro CCOc1cc2c(cc1NC(=O)Cn1ccc([N+](=O)[O-])n1)O[C@@H](C)C2 131608041 KSAOQHSPXZXPIZ-JTQLQIEISA-N 346.343 2.152 5 50 EEBA Cc1ccc2[nH]c(CNC(=O)c3ccc([N+](=O)[O-])c(O)c3)nc2c1 170610051 GCUDRZSBJXIXIN-UHFFFAOYSA-N 326.312 2.415 5 50 EEBA COC(=O)C[C@]1(NCc2ccc(Cl)c([N+](=O)[O-])c2)CCCOC1 770674327 BTYHOOVCTUEWKB-OAHLLOKOSA-N 342.779 2.450 5 50 EEBA CCOC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)C[C@@]1(O)C(F)(F)F 108403 PGYSPBYLYBIIOE-GFCCVEGCSA-N 347.249 2.412 5 50 EEBA COc1cc(C(=O)NCCCOC(C)C)c([N+](=O)[O-])cc1OC 4783107 FJKQDEAALDFBKC-UHFFFAOYSA-N 326.349 2.157 5 50 EEBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 247714532 MNPSFEMZUCGMAY-PXWWUCIGSA-N 334.332 2.126 5 50 EEBA CC(C)c1ccc(C(=O)N[C@H]2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] 188032420 MLPBLKXMNPBDAX-YPMHNXCESA-N 333.388 2.492 5 50 EEBA O=C1NC(=O)/C(=C\c2ccccc2OCc2ccc([N+](=O)[O-])cc2)N1 73193 XKASYDYGZMTTPP-NTEUORMPSA-N 339.307 2.354 5 50 EEBA CCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccccc1[N+](=O)[O-] 132717 YTJOKCARKQSHOJ-ZDUSSCGKSA-N 329.316 2.038 5 50 EEBA N=c1c2c(=O)oc3ccccc3c2ccn1CCNc1ncccn1 1776111133 AFQUAKLFEFORMX-UHFFFAOYSA-N 333.351 2.129 5 50 EEBA Cc1nc2ccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)cn2n1 408515475 IZNCEAACNALYEG-UHFFFAOYSA-N 347.356 2.055 5 50 EEBA Cc1cnc(OCC(=O)N2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 170022088 OIBVANMVISVHAQ-JTQLQIEISA-N 347.293 2.478 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCSCc2ccco2)cc1 2864310 CQZDBDCYCAUCRM-UHFFFAOYSA-N 342.398 2.400 5 50 EEBA O=[N+]([O-])c1ccc(-c2nc3ccc(Br)cn3[n+]2[O-])cc1 2905165 DLXVTOIVVHSZIP-UHFFFAOYSA-N 335.117 2.305 5 50 EEBA CC[C@H]1CN(CC(C)(C)O)[C@H](CC)CN1c1ccc([N+](=O)[O-])cn1 225813456 OQAMNCASRFQGEC-KGLIPLIRSA-N 336.436 2.440 5 50 EEBA CO[C@@H](C)[C@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 863948408 PHIOCUXEAGIDQH-IUCAKERBSA-N 345.193 2.439 5 50 EEBA Cc1cc(Sc2nnnn2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 301098450 JNVNHAMNEIPXOH-UHFFFAOYSA-N 329.345 2.035 5 50 EEBA O=C(NC1CCCCC1)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 291465 PLPCOXIDAVHBMM-GFCCVEGCSA-N 331.372 2.397 5 50 EEBA COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@H](C)c1nncn1C 225823761 NYXFUDMOQLCDFJ-SNVBAGLBSA-N 333.348 2.034 5 50 EEBA Cc1ccc2c(c1)[C@](O)(CC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N2 316449 HGXPUTOWULFMLV-QGZVFWFLSA-N 326.308 2.316 5 50 EEBA CCC1(CC)C(=O)N(C(=O)c2cccc([N+](=O)[O-])c2)C(=O)N=C1O 4996975 DAWQQHKDCIHPLR-UHFFFAOYSA-N 333.300 2.460 5 50 EEBA Cc1ccnc(S[C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)n1 100116370 SYMWGEWQLVETFV-LBPRGKRZSA-N 344.352 2.117 5 50 EEBA Cc1cc(C(=O)N[C@@H]2CS(=O)(=O)c3ccccc32)ccc1[N+](=O)[O-] 118633556 SCZKAFVYSSHFSB-CYBMUJFWSA-N 346.364 2.162 5 50 EEBA CC1(C)CN(CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1 328588712 NADVWZASAPKQDH-KRWDZBQOSA-N 336.388 2.244 5 50 EEBA O=[N+]([O-])c1cccc(S(=O)(=O)N(Cc2ccccn2)C2CC2)c1 194821142 XCMRDUDKODMYKO-UHFFFAOYSA-N 333.369 2.343 5 50 EEBA COc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] 5014243 XULWSEOMRJVCEV-UHFFFAOYSA-N 336.369 2.424 5 50 EEBA COc1n[nH]c(C(=O)Nc2nc3ccc(C)cc3s2)c1[N+](=O)[O-] 6789096 ZDAXRDXBLTUNMG-UHFFFAOYSA-N 333.329 2.497 5 50 EEBA CC1(C)CN(CC(=O)Nc2ccccc2[N+](=O)[O-])Cc2c[nH]nc21 1775985641 AUFJVRWLNSEGCA-UHFFFAOYSA-N 329.360 2.050 5 50 EEBA O=[N+]([O-])c1cccc(-c2ncn(CN3CCO[C@@H]4CCCC[C@H]43)n2)c1 249706945 PEYYEXZEKYQKJS-HZPDHXFCSA-N 343.387 2.454 5 50 EEBA CCOC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 464227 XRGRYVGJDVRJPA-ATWMFIQVSA-N 332.356 2.410 5 50 EEBA Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H](c2nc(N(C)C)no2)C1 253433031 QYVRQJQQTFFDRW-NSHDSACASA-N 332.364 2.131 5 50 EEBA COc1cccc(C(=O)NCC2(c3ccccn3)CC2)c1[N+](=O)[O-] 192894779 ANHORSHQSFEXLY-UHFFFAOYSA-N 327.340 2.460 5 50 EEBA O=C(Nc1ccn(Cc2ccccc2)n1)c1n[nH]c([N+](=O)[O-])c1Cl 18162084 JMTYOGKXLZBBGH-UHFFFAOYSA-N 346.734 2.468 5 50 EEBA Cc1cc(O)nc(N2CCC[C@H](Nc3ccccc3[N+](=O)[O-])C2)n1 952994859 VPGSAEBAALXAES-LBPRGKRZSA-N 329.360 2.480 5 50 EEBA C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](C)N2CCc3ncc([N+](=O)[O-])cc3C2)C1 408149619 RFORAPMMUOHZAO-MGPQQGTHSA-N 346.431 2.241 5 50 EEBA C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)c2cccc(Cl)c2O1 170608938 ROHWAYILOMMRTG-SECBINFHSA-N 336.735 2.259 5 50 EEBA CC(C)c1nc([C@@H]2CCCCCN2c2ncc([N+](=O)[O-])c(N)n2)no1 374822682 SXHJXZRYVHRDFH-JTQLQIEISA-N 347.379 2.595 5 50 EEBA NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 225204212 MNPSFEMZUCGMAY-PUYPPJJSSA-N 334.332 2.126 5 50 EEBA Nc1c(Br)cc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 83749839 QLJXQFVJXPGVTR-UHFFFAOYSA-N 349.084 2.233 5 50 EEBA COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2O)cc1OC 12952638 YZDUQGVCABDIDJ-UHFFFAOYSA-N 346.339 2.290 5 50 EEBA CCc1nsc(N2CCCN(c3cc(N)ccc3[N+](=O)[O-])CC2)n1 193461266 ZICDHRRWFMMJPO-UHFFFAOYSA-N 348.432 2.308 5 50 EEBA O=[N+]([O-])c1cnc(N2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 5051524 SRZMNKFNKLLQMH-UHFFFAOYSA-N 343.343 2.220 5 50 EEBA O=[N+]([O-])c1cnc2ccc(N3CCC[C@H](c4nccs4)C3)nn12 170592917 UITYFTYCUJTILA-JTQLQIEISA-N 330.373 2.478 5 50 EEBA CN1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccccc1 225600069 VQYMHDXOOQUUNH-GUYCJALGSA-N 338.371 2.495 5 50 EEBA Cc1ccc(C(=O)NC(=S)N2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] 1049955 ODAFQOSBMYOKRP-QWRGUYRKSA-N 337.401 2.027 5 50 EEBA CN(c1ncc([N+](=O)[O-])c(NC2CC2)n1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 248037086 JUPNLWZDFKEPAS-CYZMBNFOSA-N 333.392 2.209 5 50 EEBA CO[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccc(F)cc1 188153489 AWQFYXOPOXUIDD-OAHLLOKOSA-N 333.319 2.434 5 50 EEBA O=C1c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[S@](=O)N1Cc1ccccc1 245236171 QLSAUETWQATGKK-DEOSSOPVSA-N 347.308 2.182 5 50 EEBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@H](c2ccon2)C1 1775986753 YBDQDGOWKKKCPS-VIFPVBQESA-N 327.300 2.089 5 50 EEBA C/C=C/C[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1Br 192383578 BIURSQKNNCCFDK-GKQMSVHHSA-N 343.177 2.414 5 50 EEBA CCn1c(=O)n(CC)c2c([N+](=O)[O-])c(N3CCCC3)c([N+](=O)[O-])cc21 4708700 NEPORYCDLVRZKL-UHFFFAOYSA-N 349.347 2.259 5 50 EEBA COc1ccc([C@H]2SCCN2C(=O)CCC(=O)O)cc1[N+](=O)[O-] 431468 FOSKOJCEAQIESZ-CQSZACIVSA-N 340.357 2.042 5 50 EEBA O=C(O)Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1 2880879 CLKZUFTXCIVGBD-UHFFFAOYSA-N 330.296 2.239 5 50 EEBA O=[N+]([O-])c1c(F)cccc1NCCNS(=O)(=O)c1cccs1 120030800 FFOGSFWMCYQQRJ-UHFFFAOYSA-N 345.377 2.186 5 50 EEBA COc1ccc(C)cc1CCNC(=O)c1cc(C)nc(O)c1[N+](=O)[O-] 339239354 YRGIMLYQJUYYOH-UHFFFAOYSA-N 345.355 2.293 5 50 EEBA CC[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)O 6719143 NZZMMMQBVOSFSI-AWEZNQCLSA-N 338.363 2.134 5 50 EEBA CCOc1cccnc1N1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 952994425 PGSSGFQDPDPMED-UHFFFAOYSA-N 343.387 2.419 5 50 EEBA O=c1[nH]c(/C=C/c2cccc(Br)c2)nc(O)c1[N+](=O)[O-] 15684962 JCTAEWIWUXAQRJ-SNAWJCMRSA-N 338.117 2.317 5 50 EEBA NC(=O)C1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 306836 UVZLJWVQVXGUGM-UHFFFAOYSA-N 332.385 2.420 5 50 EEBA Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O)cc1[N+](=O)[O-] 3884726 ZOIDZMVEJCJFHW-UHFFFAOYSA-N 336.325 2.402 5 50 EEBA CC(C)OC[C@H]1C[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1 4132652 YMYGJWMPPJSIFG-BXUZGUMPSA-N 336.344 2.280 5 50 EEBA C[N+]1(CCO[S@@](=O)C23CC4CC(CC(C4)C2)C3)CCOCC1 4165215 OOJIKVGIQWSDDI-ACDDGSSXSA-N 328.498 2.112 5 50 EEBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2)CC1 20522518 RMGXYRFAMBVSKA-UHFFFAOYSA-N 339.395 2.482 5 50 EEBA Cc1c(NC(=O)[C@H](C)N2CC[C@@H](n3cccn3)C2)cccc1[N+](=O)[O-] 291756870 KXVWGLGYSCXOCE-UONOGXRCSA-N 343.387 2.374 5 50 EEBA Cc1cnn(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)o2)c1 2781121 SLJGMAMRKICMMB-UHFFFAOYSA-N 329.316 2.243 5 50 EEBA COc1ccc(CN[C@](C)(CO)c2cccc(O)c2)cc1[N+](=O)[O-] 451033440 UGAIMUCYVZGXHY-QGZVFWFLSA-N 332.356 2.306 5 50 EEBA Cn1nc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N)c2ccccc21 189850631 KDMFEYOALFWKQY-UHFFFAOYSA-N 339.355 2.036 5 50 EEBA Cc1cc(CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 121418640 RBNDHMGQXBGLJB-UHFFFAOYSA-N 344.371 2.239 5 50 EEBA CN(C)c1ccc2nc3ccc(=[N+](C)C)c([N+](=O)[O-])c-3sc2c1 16890018 JICGHBSILZBPAI-UHFFFAOYSA-N 329.405 2.407 5 50 EEBA in-vitro O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCCOC[C@H]2CCCO2)n1 252584771 CUAKFGDWCSYLFO-RBSFLKMASA-N 338.408 2.060 5 50 EEBA O=C(NC1(C(F)(F)F)CC1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 1334578806 SVOSQJKNIJYVQW-UHFFFAOYSA-N 347.297 2.233 5 50 EEBA Cc1ccc2c(c1)[C@](O)(CC(=O)c1ccccc1[N+](=O)[O-])C(=O)N2 528463 ZYHQZWQRFZASJE-QGZVFWFLSA-N 326.308 2.316 5 50 EEBA C[C@H](C[N+]1(C)CCOCC1)OC[C@@H]1CCC[N@+]2(C)CCCC[C@H]12 247664457 VNZYHBOMJJKSJY-HDAAZOAOSA-N 326.525 2.277 5 50 EEBA biogenic Cn1cc([N+](=O)[O-])c(C(=O)NCc2cc3cc(Cl)ccc3[nH]2)n1 374585 FPKWSPWFXDNLKO-UHFFFAOYSA-N 333.735 2.393 5 50 EEBA NC(=O)c1c(NC(=O)c2cccc([N+](=O)[O-])c2)sc2c1CCC2 432110 POXMJNHKOQAQCM-UHFFFAOYSA-N 331.353 2.496 5 50 EEBA COc1ccc(Nc2c([N+](=O)[O-])cc(C(N)=O)cc2[N+](=O)[O-])cc1 670417721 CHTQTTNNRHGUSL-UHFFFAOYSA-N 332.272 2.354 5 50 EEBA CC(=O)Oc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 241269 ZZTNZPJPJMFVIH-UHFFFAOYSA-N 326.264 2.321 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCC2(C1)OCCO2 253426443 PYXKZYJSYAHLLW-CQSZACIVSA-N 334.372 2.329 5 50 EEBA COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc([N+](=O)[O-])cc2)C1=O 4695279 MJERFAMWDPIJMO-XAPLUZPNSA-N 336.325 2.193 5 50 EEBA CN(Cc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2c(=O)n1C 195514505 CDVGFZDZPKZUKP-UHFFFAOYSA-N 338.367 2.474 5 50 EEBA COc1ccc(C[C@](C)(CO)NCc2cccnc2[N+](=O)[O-])cc1 933430336 NIDZACKDJSKEQP-QGZVFWFLSA-N 331.372 2.082 5 50 EEBA Cc1ccnc(N2CCN(c3ncncc3Cl)CC2)c1[N+](=O)[O-] 225814908 PPPHZFXPHFKRSX-UHFFFAOYSA-N 334.767 2.068 5 50 EEBA O=[N+]([O-])c1cc(CN2CCC[C@H](N3CCNCC3)C2)ccc1Cl 170082909 ZNLLLMPGMFIADS-AWEZNQCLSA-N 338.839 2.118 5 50 EEBA CC1(C)C[C@]2(CCO1)OC(=O)C[C@@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1 4872637 VUCQBYFAJRXTHE-DYVFJYSZSA-N 348.355 2.424 5 50 EEBA Cc1nn(C)c(NCc2cc(Br)ccn2)c1[N+](=O)[O-] 292936740 DZVBVSUPHKQTMY-UHFFFAOYSA-N 326.154 2.406 5 50 EEBA O=C(C[C@@H](NC1CCCCC1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280089 PSGQMESPGAZUFV-CQSZACIVSA-N 335.360 2.299 5 50 EEBA COc1cc(C=O)ccc1OCC(=O)Nc1ccc([N+](=O)[O-])cc1 4892607 SELOVHZBRNGRRF-UHFFFAOYSA-N 330.296 2.433 5 50 EEBA Cc1sc2ncn3nc(Cn4cc([N+](=O)[O-])cn4)nc3c2c1C 2808461 WYHLYRQZCQCSBI-UHFFFAOYSA-N 329.345 2.109 5 50 EEBA CS(=O)(=O)c1ccccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] 172425177 NMLKJZWEJOYKAC-UHFFFAOYSA-N 346.364 2.201 5 50 EEBA Nc1cc2n(n1)CCN(c1cccc(Br)c1[N+](=O)[O-])C2 685943284 KDGRQZWQZWKAEH-UHFFFAOYSA-N 338.165 2.156 5 50 EEBA CC(=O)c1cc(NCc2cccc(S(N)(=O)=O)c2)ccc1[N+](=O)[O-] 253415226 HBXUSVHDIVNGGD-UHFFFAOYSA-N 349.368 2.057 5 50 EEBA CC1(C)CC(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC(C)(C)N1 181126728 YMELVNUPNFNBJD-UHFFFAOYSA-N 349.387 2.363 5 50 EEBA Cc1cc(=O)oc(C)c1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 285463 NOPLOBLCLLHGSL-UHFFFAOYSA-N 331.280 2.205 5 50 EEBA O=C(NCC1CCOCC1)[C@@H]1CCCN1c1ccccc1[N+](=O)[O-] 239667824 BRNUDVTVCSJYSI-INIZCTEOSA-N 333.388 2.106 5 50 EEBA Cc1nn(C)c(N2CCC[C@H](Oc3ncccc3F)C2)c1[N+](=O)[O-] 278747494 MHKZMCQZBREQPT-NSHDSACASA-N 335.339 2.219 5 50 EEBA COc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1 449703 VABRMTSOEUUNLO-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC[C@@H](c2nc[nH]n2)C1 952875964 VOUOADKGEFHPKZ-SNVBAGLBSA-N 335.751 2.386 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@]2(O)CCCC[C@@H]2C1 160965557 MLFNLUJNNIAZLO-RHSMWYFYSA-N 333.388 2.431 5 50 EEBA CC1(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)OCCCO1 191159280 VWXZESHZCQXPJZ-UHFFFAOYSA-N 348.277 2.497 5 50 EEBA C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](N2CCCC2)C1 229717856 BNGJYDRTTUONDI-RHSMWYFYSA-N 346.431 2.482 5 50 EEBA Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1C 374316296 HWNQRUWIUPRMCF-HNNXBMFYSA-N 344.371 2.457 5 50 EEBA O=[N+]([O-])c1cc[n+]([O-])cc1N1CCC[C@@H](c2c[nH]c3ncccc23)C1 1775985629 XVRBAJNCJBIMCJ-GFCCVEGCSA-N 339.355 2.489 5 50 EEBA C[N+](C)(CCN1C(=O)C2=C(SCCS2)C1=O)Cc1ccccc1 392543 YDKJWGKBXGOSBQ-UHFFFAOYSA-N 349.501 2.323 5 50 EEBA C[N+](C)(C)C[C@@H](CC(=O)O)OC(=O)CCCCCCCCC(=O)O 96094886 GBFPILOKXGQZKW-CQSZACIVSA-O 346.444 2.285 5 50 EEBA in-vitro C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 22309393 XFAHFRBDDMOVKQ-SJCJKPOMSA-N 342.351 2.482 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCCSc1ccccn1 5338270 NQYJGVRJUQBKNR-UHFFFAOYSA-N 339.398 2.060 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 454307 FNHJISBGJCAHMH-QGZVFWFLSA-N 326.308 2.032 5 50 EEBA O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1ccc(O)c([N+](=O)[O-])c1 119364701 HTZRHUBYAHGGPF-DFBGVHRSSA-N 332.356 2.378 5 50 EEBA O=C(N[C@H]1CCCC[C@H]1n1cccn1)c1ccc(O)c([N+](=O)[O-])c1 119111084 AMPZEHTXOICULC-QWHCGFSZSA-N 330.344 2.411 5 50 EEBA O=c1c2ccccc2nc(/C=C/c2ccc([N+](=O)[O-])o2)n1CCCO 4350448 PPWMMWQBJRDQFH-SOFGYWHQSA-N 341.323 2.451 5 50 EEBA CCOc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1[N+](=O)[O-] 465079 WUVWYBXVNJIZOV-UHFFFAOYSA-N 329.312 2.345 5 50 EEBA O=C(Nc1ccc2nn[nH]c2c1)c1cc([N+](=O)[O-])c2nsnc2c1 408513834 WGFMVVVMBWVRFV-UHFFFAOYSA-N 341.312 2.123 5 50 EEBA CCC1=NN(C(=O)c2ccccc2[N+](=O)[O-])[C@@](O)(C(F)(F)F)C1 436121 NELUTXDINSADRJ-LBPRGKRZSA-N 331.250 2.458 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 248130590 JNHXLWWYDPFNKR-QYAIJTBZSA-N 332.312 2.065 5 50 EEBA O=[N+]([O-])c1ccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)o1 292232 YMWZKQAKGHJXEB-UHFFFAOYSA-N 345.355 2.234 5 50 EEBA CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 3884426 XHGPWZQBCGONPX-UHFFFAOYSA-N 335.360 2.288 5 50 EEBA O=C(Cc1ccccc1[N+](=O)[O-])NCCc1ccc2c(c1)CCO2 172148537 QBSQVZLFPPQLAQ-UHFFFAOYSA-N 326.352 2.431 5 50 EEBA CC[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)[C@H](CC)CN1CC(C)(C)O 225813437 OQAMNCASRFQGEC-ZIAGYGMSSA-N 336.436 2.440 5 50 EEBA Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](Oc2cccnc2N(C)C)C1 253426807 XRSBMKHOQIPJDL-CQSZACIVSA-N 343.387 2.417 5 50 EEBA COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1 19227928 MCTRZKAKODSRLQ-UHFFFAOYSA-N 346.339 2.176 5 50 EEBA biogenic,in-vitro COc1cc2c(cc1OC)[C@@H](c1cccc([N+](=O)[O-])c1)NC(=O)C2 296297 PPRLVNUHOQJPDK-QGZVFWFLSA-N 328.324 2.374 5 50 EEBA Cc1ncc(CN2CCN(c3ncc([N+](=O)[O-])cc3C)CC2)s1 241965670 UUXGVBMIESBRMF-UHFFFAOYSA-N 333.417 2.385 5 50 EEBA COc1cccc(CCNc2nc(O)c3cc([N+](=O)[O-])ccc3n2)c1 408515564 ARLLOJURGZQRDQ-UHFFFAOYSA-N 340.339 2.907 5 50 EEBA CCc1n[nH]c(SCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])n1 18173099 GZSIHVNVZJMLIM-UHFFFAOYSA-N 337.361 2.015 5 50 EEBA O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H]1CCCO1 253416451 DNSXEHGVELUFIA-JKSUJKDBSA-N 333.388 2.490 5 50 EEBA CC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@H]2C(C)=NN=C2C[C@@]1(C)O 239331311 KLUFAIXBSGETEP-YLFCFFPRSA-N 329.356 2.485 5 50 EEBA CCN1C(=O)S[C@@H]([C@H](O)c2ccc(Cl)c([N+](=O)[O-])c2)C1=O 1395161 KWTOLMPVXVECLY-ZJUUUORDSA-N 330.749 2.366 5 50 EEBA Cc1nn(C)c(N2CCC[C@@H](c3noc(C4CC4)n3)C2)c1[N+](=O)[O-] 253429542 SWJVRMNUKRSZEB-LLVKDONJSA-N 332.364 2.281 5 50 EEBA O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)nc1 229817948 RUVCBHJIHXYGSJ-NVXWUHKLSA-N 342.399 2.285 5 50 EEBA C[C@@H]1COc2ccccc2CN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 273042962 XGBXYWYLKAORLN-GFCCVEGCSA-N 341.367 2.477 5 50 EEBA O=[N+]([O-])c1cnc2ccc(N3CCC[C@@H](c4nccs4)C3)nn12 170592918 UITYFTYCUJTILA-SNVBAGLBSA-N 330.373 2.478 5 50 EEBA COc1ccc(C(=O)NCc2ccn3ccnc3c2)cc1[N+](=O)[O-] 178072213 YYDONZWLBIKMGN-UHFFFAOYSA-N 326.312 2.181 5 50 EEBA O=C(C[C@H]1Nc2ccccc2NC1=O)Nc1ccc([N+](=O)[O-])cc1 4123740 NGLXCTNGKAIBDQ-CQSZACIVSA-N 326.312 2.356 5 50 EEBA C[C@H](NC(N)=O)c1noc(C(C)(C)c2ccc([N+](=O)[O-])cc2F)n1 253432113 VXDKZARURJIORW-ZETCQYMHSA-N 337.311 2.172 5 50 EEBA CCOC(=O)Cc1csc(CNc2nccc(C)c2[N+](=O)[O-])n1 1334859420 XDHPDOFAACLBSX-UHFFFAOYSA-N 336.373 2.472 5 50 EEBA COc1cccc2c1CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)C2 170605215 OWJWNHUALQTQCL-UHFFFAOYSA-N 327.340 2.384 5 50 EEBA COC(=O)c1cc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cs1 253425630 AUZAOKCXLDHZHO-UHFFFAOYSA-N 342.354 2.244 5 50 EEBA CCCN1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2OC)CC1 5041863 GJVAYHLKGOCIIW-UHFFFAOYSA-N 338.433 2.328 5 50 EEBA CC(C)N1C[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1=O 100755 KTLIPIZCWIOJPZ-SECBINFHSA-N 325.752 2.444 5 50 EEBA COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ccc([N+](=O)[O-])cc1 235734 VFQXEYKTWNRSQE-UHFFFAOYSA-N 346.339 2.176 5 50 EEBA Cc1nc(C)n(C[C@H]2CCCN(c3ccc(N)cc3[N+](=O)[O-])C2)n1 225819920 FASMRCLKQHFFNR-ZDUSSCGKSA-N 330.392 2.302 5 50 EEBA CC(C)CCc1nnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 194878159 ZJHQGCFXUXVCSY-UHFFFAOYSA-N 340.361 2.367 5 50 EEBA Cc1cc(C(=O)NCC(=O)Nc2c(C)cccc2O)ccc1[N+](=O)[O-] 184164758 QKMOQSGUAQBRAY-UHFFFAOYSA-N 343.339 2.286 5 50 EEBA CCOC(=O)Cn1nc(C)c(NC(=O)c2cccc([N+](=O)[O-])c2)c1C 1427199 IADCZEOVESOQDG-UHFFFAOYSA-N 346.343 2.224 5 50 EEBA O=C(O)COc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 2879829 JJAQFBHXEPMIIP-UHFFFAOYSA-N 330.296 2.239 5 50 EEBA Cc1cc(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n(C)n1 421496139 LPKUXGZKEIQUEG-UHFFFAOYSA-N 328.372 2.370 5 50 EEBA Cc1c(F)cc(S(=O)(=O)N(C)Cc2ccncc2)cc1[N+](=O)[O-] 133131019 UIDBFVLCOBRVSJ-UHFFFAOYSA-N 339.348 2.258 5 50 EEBA COc1cccc(N2CCCN(c3nc(C)ns3)CC2)c1[N+](=O)[O-] 185496386 JDZLPSHWMQEDHU-UHFFFAOYSA-N 349.416 2.480 5 50 EEBA O=C(O)COc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 2838018 OJYGFCBLRWSTRM-UHFFFAOYSA-N 346.295 2.076 5 50 EEBA O=[N+]([O-])c1cc(Br)nc(I)c1O 675050483 KSXOZWLYYZAWBH-UHFFFAOYSA-N 344.890 2.063 5 50 EEBA Cc1ccc(N2C[C@H](C(=O)Nc3ncc([N+](=O)[O-])s3)CC2=O)cc1 5027873 WIVBWTCSGYLKIE-SNVBAGLBSA-N 346.368 2.351 5 50 EEBA CC(=O)[C@@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@@H]2C(C)=NN=C2C[C@@]1(C)O 1204434 WLADKGWPKZATAW-QBPKDAKJSA-N 329.356 2.485 5 50 EEBA CC1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1 4998566 REDTXNPVXNIHEG-UHFFFAOYSA-N 333.388 2.304 5 50 EEBA CCn1ccnc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1=O 179725920 NPVLMTDPZCBRRZ-UHFFFAOYSA-N 344.371 2.219 5 50 EEBA O=C(O)c1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc([N+](=O)[O-])c1 2923746 LMRXQWROITWHQN-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA Cc1cc(NCCN2C(=O)c3ccccc3C2=O)ncc1[N+](=O)[O-] 253421052 ONKSQDRYEIKCGK-UHFFFAOYSA-N 326.312 2.006 5 50 EEBA Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 4702005 TUGCIDBJIXUYPK-UHFFFAOYSA-N 336.325 2.433 5 50 EEBA COCCSc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)s1 4814269 VMEGQHNPQUDXMI-UHFFFAOYSA-N 340.386 2.437 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)C(=O)NC2 129326925 GLGPDWKMBJAYAP-UHFFFAOYSA-N 325.324 2.410 5 50 EEBA O=C(Nc1ccc2[nH]nnc2c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 176736385 FBEYXWNWVRNYMC-UHFFFAOYSA-N 349.310 2.304 5 50 EEBA Cn1cccc1[C@@H]1COCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 221918075 SKCVWCDOOAYPHF-DLBZAZTESA-N 331.372 2.040 5 50 EEBA CC(C)Cn1cc(NC(=O)NCc2ccc(O)c([N+](=O)[O-])c2)cn1 952994326 ZOBWZYAXWIUJDW-UHFFFAOYSA-N 333.348 2.475 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCc2nc(N(C)C)sc2C1 1331743954 RTDDOXDUDVVWEJ-UHFFFAOYSA-N 336.421 2.205 5 50 EEBA O=C(O)C[C@H](NC(=O)COc1ccccc1)c1cccc([N+](=O)[O-])c1 3627022 JGHQYBLASGWIQP-HNNXBMFYSA-N 344.323 2.306 5 50 EEBA COCc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1cncc(F)c1 354218605 CTSZQOLLEMUWIX-UHFFFAOYSA-N 341.320 2.076 5 50 EEBA C[C@H](c1ccccc1)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(N)=O 794717242 KMFXNRCIMKLMJJ-BZNIZROVSA-N 331.347 2.481 5 50 EEBA Cc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2O)s1 5051505 GKJKHVWHNPBERS-UHFFFAOYSA-N 326.359 2.191 5 50 EEBA O=C(COc1ccccc1[N+](=O)[O-])NCCc1nc2ccccc2[nH]1 2933983 SXKUKAOOBSUNFI-UHFFFAOYSA-N 340.339 2.209 5 50 EEBA O=C(OCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 473136 FBZZHBSYOUGALM-UHFFFAOYSA-N 326.264 2.005 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1COc2ccccc2O1 354114579 JGLRMZLVGIFUEB-OAHLLOKOSA-N 342.351 2.484 5 50 EEBA CCNC(=O)/N=c1\sc([N+](=O)[O-])cn1Cc1ccc(OC)cc1 71767357 PQRFHPBKGONGHY-PEZBUJJGSA-N 336.373 2.145 5 50 EEBA O=C(C[C@@H]1CNN(c2ccccc2)C1=O)Nc1ccc([N+](=O)[O-])cc1 1740818238 MYGCFBIBHDJTIH-GFCCVEGCSA-N 340.339 2.091 5 50 EEBA O=[N+]([O-])c1ccc([C@H](O)CN2CCN(Cc3ccccc3)CC2)cc1 446529 NOOZVSMQWFDGGH-LJQANCHMSA-N 341.411 2.446 5 50 EEBA C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)n1cc([N+](=O)[O-])cn1 1432075 BWDNPELAPIXUAY-NSHDSACASA-N 327.344 2.193 5 50 EEBA O=[N+]([O-])c1ccc(CCN2CCC(CN3CC[C@@H](CO)C3)CC2)cc1 952993407 GWJIZOUWTRBGDN-GOSISDBHSA-N 347.459 2.164 5 50 EEBA C[C@@H]1O[C@H](C)C[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 412655520 OPNOSAYRQNNJNM-MBNYWOFBSA-N 344.371 2.324 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1O)N1CCCCC[C@@H]1c1ncon1 189649212 MMQTVTIKDCYCKU-GFCCVEGCSA-N 332.316 2.441 5 50 EEBA CCOC(=O)Cc1csc(NC(=O)c2ccc([N+](=O)[O-])cc2)n1 2906497 GQUQBMUWGAAMJN-UHFFFAOYSA-N 335.341 2.409 5 50 EEBA COC(=O)c1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 8205154 BHTHFWDQFSDSFM-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA O=[N+]([O-])c1cc(F)cc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c1 174991105 BUWSOYLQHAJSMG-UHFFFAOYSA-N 336.304 2.411 5 50 EEBA CCOC(=O)Cc1csc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)n1 16993647 VKSZVHFYVKBHPR-UHFFFAOYSA-N 349.368 2.338 5 50 EEBA O=C(CCN1C(=O)c2ccccc2C1=O)Nc1cccc([N+](=O)[O-])c1 2596060 WHUDMSUZNZTRQB-UHFFFAOYSA-N 339.307 2.220 5 50 EEBA COc1cccc2c1CCCCN2C(=O)c1nn(C)cc1[N+](=O)[O-] 253425496 FJPFQPWNYXFQME-UHFFFAOYSA-N 330.344 2.320 5 50 EEBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CCO)CC1 421025298 YJHSHZXMXRFSTP-KBPBESRZSA-N 335.404 2.406 5 50 EEBA O=[N+]([O-])c1cc[n+]([O-])cc1N1CCC[C@H](c2c[nH]c3ncccc23)C1 1775985630 XVRBAJNCJBIMCJ-LBPRGKRZSA-N 339.355 2.489 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3cc([N+](=O)[O-])ccc3Cl)C(=O)[C@@H]12 5017566 PPMVVZMNIQGGOV-BLTAXRJOSA-N 334.715 2.081 5 50 EEBA CC1(C)CC(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC(C)(C)N1 4722427 FSYFFWNZVBGBLR-UHFFFAOYSA-N 341.433 2.182 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CS(=O)(=O)c1ccccc1 4816045 JHRRQYSQTXFPEC-UHFFFAOYSA-N 334.353 2.316 5 50 EEBA C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 22309401 XFAHFRBDDMOVKQ-YVEFUNNKSA-N 342.351 2.482 5 50 EEBA O=[N+]([O-])c1cnc2ccc(NCCCn3cnc4ccccc43)nn12 130937212 AXGYMDRDFJUZPG-UHFFFAOYSA-N 337.343 2.489 5 50 EEBA Cc1cn(Cc2cccc(S(=O)(=O)C(F)(F)F)c2)nc1[N+](=O)[O-] 888096320 ALXNGRVJFPKDSN-UHFFFAOYSA-N 349.290 2.442 5 50 EEBA COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@H](C)OC(C)(C)C1 194508881 XDTOXTYSJUCCIQ-NSHDSACASA-N 337.376 2.312 5 50 EEBA COc1ccc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc1OC 84077 GUOSQCZGYQTRIU-UHFFFAOYSA-N 334.332 2.064 5 50 EEBA COCc1nnc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)s1 461272 RZGOCRNTPHVRPX-UHFFFAOYSA-N 328.737 2.498 5 50 EEBA O=C(O)C[C@H](c1ccccc1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 4714251 WNXPSCOODSMEKU-CYBMUJFWSA-N 340.291 2.407 5 50 EEBA O=C1[C@@H]2CCCC[C@H]2C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 100498942 VMUHWBDIKFRNAE-NXEZZACHSA-N 334.288 2.005 5 50 EEBA CC(C)(C)OC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 22416199 WSYLWRPEYFRYQL-UHFFFAOYSA-N 335.360 2.288 5 50 EEBA C[C@]1(c2cccnc2)N=C(O)N(Cc2ccc([N+](=O)[O-])c(F)c2)C1=O 328593866 SSCUTAYLZAHSGO-MRXNPFEDSA-N 344.302 2.301 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1F)N1CCN(c2ccccc2)C(=O)C1 170596210 QVPGPLHDAOFGAN-UHFFFAOYSA-N 343.314 2.223 5 50 EEBA COc1ccc(CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 32794597 LRQKZERJGOUPNS-UHFFFAOYSA-N 336.369 2.424 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@H](C)[C@@H]1CCCO1 5041742 FYXQGRHDFNMIGI-SKDRFNHKSA-N 325.390 2.457 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccc([N+](=O)[O-])cc1 4152265 QWVVOELFHDMORY-AWEZNQCLSA-N 348.355 2.052 5 50 EEBA CCn1cnnc1[C@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 225527884 SGUYMAMYLAIWCC-JTQLQIEISA-N 347.404 2.299 5 50 EEBA C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@H](C2CCC2)C1 411873026 KUVKCSDRDGODFK-BLLLJJGKSA-N 333.388 2.423 5 50 EEBA Cc1ccc2c(c1)[C@@](O)(CC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N2 316448 HGXPUTOWULFMLV-KRWDZBQOSA-N 326.308 2.316 5 50 EEBA CC1(C)CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1 328588713 NADVWZASAPKQDH-QGZVFWFLSA-N 336.388 2.244 5 50 EEBA Cc1ccc(Cn2cccc/c2=N\C(=O)c2n[nH]cc2[N+](=O)[O-])cc1 179400220 OBIYIBIXNJUBCH-XDJHFCHBSA-N 337.339 2.217 5 50 EEBA C[C@]12CCN(C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C[C@@H]1C2(F)F 428721069 SKUANFXGCPKYGJ-SNPRPXQTSA-N 342.342 2.312 5 50 EEBA COCc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 475612 QYFFRVYZFKYQFV-UHFFFAOYSA-N 328.737 2.498 5 50 EEBA Cn1cnnc1SCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2534573 YDJLEYQSUIFTFT-UHFFFAOYSA-N 327.753 2.108 5 50 EEBA CCOC(=O)C1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1 449693 JCUXVMAKJPLIEE-VOTSOKGWSA-N 332.356 2.410 5 50 EEBA CO[C@@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 230237337 XTIGDKASHUQGLK-SNVBAGLBSA-N 334.781 2.048 5 50 EEBA O=C(/C=C/c1cccc(O)c1)N1CCc2ncc([N+](=O)[O-])cc2C1 157337094 GVNPHKAMRZPVSK-SNAWJCMRSA-N 325.324 2.294 5 50 EEBA C/C=C/C[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1Br 192383572 BIURSQKNNCCFDK-HPOULIHZSA-N 343.177 2.414 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 4907644 QPOYHTZFCJNNSS-QGZVFWFLSA-N 326.308 2.032 5 50 EEBA O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1[C@H]2C=C[C@H]([C@H]1C(=O)O)[C@@H]1C[C@@H]21 229835398 UNMJLXNHSYJMRJ-WCBJTDJXSA-N 328.324 2.302 5 50 EEBA CCN(CC)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C=O)C1 5060738 TYNNFQARMVJZID-ZDUSSCGKSA-N 333.388 2.492 5 50 EEBA O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1ccc([N+](=O)[O-])c(Cl)c1 133627637 ACROAVUCHVPBIJ-UHFFFAOYSA-N 346.730 2.348 5 50 EEBA CS(=O)(=O)N1CCN(c2ccccc2[N+](=O)[O-])Cc2ccccc21 328586859 GUFGTLVBNKAYDJ-UHFFFAOYSA-N 347.396 2.381 5 50 EEBA CC[C@H]1CN(c2ccc([N+](=O)[O-])cn2)[C@@H](CC)CN1CC(C)(C)O 252539886 OQAMNCASRFQGEC-KBPBESRZSA-N 336.436 2.440 5 50 EEBA Cc1cc(S(=O)(=O)N2C[C@@H](CO)c3ccccc32)ccc1[N+](=O)[O-] 292689748 KXPNKZDQBWMZIM-LBPRGKRZSA-N 348.380 2.188 5 50 EEBA CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1nccn1CC1CC1 952890821 JOYNLQNACWDJGF-LBPRGKRZSA-N 344.375 2.148 5 50 EEBA COC(=O)c1cc(Br)c(C)c(NC(C)=O)c1[N+](=O)[O-] 5060459 NJVHEIYSNOFPCA-UHFFFAOYSA-N 331.122 2.411 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCc2cccc(O)c21 1802369 ROHKTNNCVVLGAV-UHFFFAOYSA-N 334.353 2.442 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cnc(C(C)C)[nH]1 1664448366 BUVCYGFNLFTGKA-UHFFFAOYSA-N 338.389 2.228 5 50 EEBA O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(Cc2ccccc2)CC1 124680640 BVBUBGWIPNIXDD-UHFFFAOYSA-N 341.371 2.340 5 50 EEBA O=c1[nH]c(/C=C\c2ccc(-c3ccccc3)o2)c([N+](=O)[O-])c(=O)[nH]1 4501866 IVCGBAJZLINLEK-VURMDHGXSA-N 325.280 2.402 5 50 EEBA C[C@@H](C(=O)N1CCN(c2ccccn2)CC1)c1ccc([N+](=O)[O-])cc1 4986348 QKLSKNXLPJGLIC-CQSZACIVSA-N 340.383 2.442 5 50 EEBA Cn1cc(C[C@H](CO)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 408524013 PKFXIDOHAULSCQ-LLVKDONJSA-N 344.293 2.363 5 50 EEBA CCOC(=O)C(CCCOc1ccc([N+](=O)[O-])cc1)C(=O)OCC 2880587 OOCJAIVGNHBMLF-UHFFFAOYSA-N 339.344 2.496 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1c1ncccn1 874434039 YFQRWVZCXSKMBP-CYBMUJFWSA-N 348.384 2.219 5 50 EEBA CS(=O)(=O)C1(CNc2ccc(-c3cccc([N+](=O)[O-])c3)nn2)CC1 1775999313 RVEASJWJDIQTCR-UHFFFAOYSA-N 348.384 2.041 5 50 EEBA O=[N+]([O-])c1ccc(CS(=O)(=O)N(Cc2ccccn2)C2CC2)cc1 192854014 UTXWISYTIDBHRZ-UHFFFAOYSA-N 347.396 2.484 5 50 EEBA CN(C)CCCOC1CCN(c2ccc([N+](=O)[O-])c3[nH]ncc23)CC1 1775998483 DEOMDWGXJUGAIW-UHFFFAOYSA-N 347.419 2.408 5 50 EEBA CC(C)n1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)n[nH]2)cn1 170606245 ZEIWYSWUYDHXRR-UHFFFAOYSA-N 341.331 2.410 5 50 EEBA COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H](c3ccccn3)C2)n1 804685902 NTJQLMNFIMAZBO-NSHDSACASA-N 328.328 2.165 5 50 EEBA O=C(C[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 119104736 MZULIHPWPKFCAN-AWEZNQCLSA-N 344.323 2.302 5 50 EEBA COC(=O)[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1)c1cccc(O)c1 343131360 GMGUYWUBQXCDQH-HNNXBMFYSA-N 344.323 2.253 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1Cn1ccnc1 131894653 NAUCRHJPWKMZDF-INIZCTEOSA-N 328.372 2.415 5 50 EEBA Cn1nnnc1SCc1ccc([N+](=O)[O-])cc1Br 129916020 QCHHACFVFGGDMT-UHFFFAOYSA-N 330.167 2.173 5 50 EEBA COC(=O)c1ccccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 5005919 MJNIWHRMXFCGFR-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA CN1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccccc1 225600100 VQYMHDXOOQUUNH-DYVFJYSZSA-N 338.371 2.495 5 50 EEBA COc1cc2c(cc1OC)[C@H](C)N(c1ncnc(N)c1[N+](=O)[O-])CC2 4059596 PCRYCHOKIBKTJB-VIFPVBQESA-N 345.359 2.108 5 50 EEBA O=C(C[C@@H](NCc1ccccc1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280067 HHODNKFGFUHGFS-OAHLLOKOSA-N 343.339 2.166 5 50 EEBA O=C(c1cccc([N+](=O)[O-])c1)N1N=C(C2CC2)C[C@]1(O)C(F)(F)F 1012084 OBNZAMPCRCFFGN-ZDUSSCGKSA-N 343.261 2.458 5 50 EEBA O=C1c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[S@](=O)N1c1ccccc1 245235769 NDEKPPFFSPXGCF-QHCPKHFHSA-N 333.281 2.186 5 50 EEBA Cn1cc(N2CC[C@H](NCc3ccc(Cl)cc3[N+](=O)[O-])C2)cn1 1333684457 KEXORHTZFJJVSB-ZDUSSCGKSA-N 335.795 2.350 5 50 EEBA CCOC(=O)[C@@H]1CCCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1 456165 XKIZXWVFIJSNHM-MYSGNRETSA-N 332.356 2.410 5 50 EEBA Cc1cccnc1NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4853149 VUAYWLRAIXHCCU-UHFFFAOYSA-N 342.355 2.387 5 50 EEBA C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@H](O)c1ccc(F)cc1 170087771 YLLMLGZYCWOCGD-PSLIRLAXSA-N 331.307 2.311 5 50 EEBA Cc1nc(N(C)C2CCN(CCn3cccn3)CC2)ccc1[N+](=O)[O-] 150772974 KGAKDWVWRFQKCV-UHFFFAOYSA-N 344.419 2.096 5 50 EEBA CCOC(=O)c1ccnc(NCCNc2cccc(F)n2)c1[N+](=O)[O-] 1776005435 BSUVRFYHFLBJJZ-UHFFFAOYSA-N 349.322 2.225 5 50 EEBA CCOC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 465556 JCKBOVJENNCERS-DNGMOHDESA-N 332.356 2.410 5 50 EEBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(-n3nc(C)cc3C)c2)CC1 4117351 HQDYJNRATBRJPW-UHFFFAOYSA-N 343.387 2.066 5 50 EEBA O=[N+]([O-])c1ccc([C@]2(O)C[C@H](C(Cl)(Cl)Cl)NO2)cc1 500039 UFXRKGGEIQEOMD-BDAKNGLRSA-N 327.551 2.404 5 50 EEBA Cn1c(=O)c([N+](=O)[O-])c(N2CCN3CCCC[C@H]3C2)c2ccccc21 685940435 LMYXPWOAMJGXJR-ZDUSSCGKSA-N 342.399 2.121 5 50 EEBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc2c(c1)OCCO2 318705 ICQFBYFLJYHIDF-UHFFFAOYSA-N 336.325 2.167 5 50 EEBA COC1(c2nccn2C)CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 952993573 ZFOVASXUBXJTTH-UHFFFAOYSA-N 331.376 2.174 5 50 EEBA C[C@@H]1CN(C2CCOCC2)CCN1c1ncc(Cl)cc1[N+](=O)[O-] 278762935 NTSQCJLUDCPATQ-LLVKDONJSA-N 340.811 2.333 5 50 EEBA O=C(c1cnc(O)c([N+](=O)[O-])c1)N1Cc2ccccc2C2(CC2)C1 194030933 DEVLBUDWGSFDHY-UHFFFAOYSA-N 325.324 2.383 5 50 EEBA CCN1C(=O)S[C@H]([C@@H](O)c2ccc(Cl)c([N+](=O)[O-])c2)C1=O 1395162 KWTOLMPVXVECLY-VHSXEESVSA-N 330.749 2.366 5 50 EEBA O=[N+]([O-])c1ccc(CCN2CCC(CN(CCO)C3CC3)CC2)cc1 952994422 PEUWYIFKNRZSBE-UHFFFAOYSA-N 347.459 2.306 5 50 EEBA O=C1NC(=O)/C(=C\c2ccc(OCc3cccc([N+](=O)[O-])c3)cc2)N1 303803 XVLVALBCDAMYQN-OQLLNIDSSA-N 339.307 2.354 5 50 EEBA Cn1cccc1[C@@H]1COCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 131613708 SKCVWCDOOAYPHF-IRXDYDNUSA-N 331.372 2.040 5 50 EEBA O=[N+]([O-])c1cc(CN2CCN(c3ncccn3)CC2)ccc1Cl 22591621 AQMWKLLCDJRWSJ-UHFFFAOYSA-N 333.779 2.360 5 50 EEBA C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 263367554 UGZIHEKQRGFYGX-PSASIEDQSA-N 326.736 2.431 5 50 EEBA O=[N+]([O-])c1ccccc1OCC(O)COc1ccccc1[N+](=O)[O-] 3145739 GXDNMMGKIAJSBA-UHFFFAOYSA-N 334.284 2.322 5 50 EEBA biogenic COC(=O)/C=C/c1ccc(NC[C@H](C)c2nncn2C)c([N+](=O)[O-])c1 170606516 JMDDUCVPWPOVMM-ZRQQLDRUSA-N 345.359 2.125 5 50 EEBA Cc1nn([C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)c(C)c1[N+](=O)[O-] 1068547 JVSYWKCFFUSKMC-JTQLQIEISA-N 332.316 2.337 5 50 EEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(c2cccnn2)C1 194721092 LFVBLYYUBVJXKC-ZDUSSCGKSA-N 341.371 2.092 5 50 EEBA O=C(CNc1ccc(O)cc1)OCC(=O)c1ccc([N+](=O)[O-])cc1 2775222 LEGQOXXEWGZQGH-UHFFFAOYSA-N 330.296 2.138 5 50 EEBA Cc1ccc2c(c1)nc(CNC(=O)c1cc([N+](=O)[O-])ccc1N)n2C 189819840 SNQXATLTBIEPKZ-UHFFFAOYSA-N 339.355 2.302 5 50 EEBA CCCOc1ccc([N+](=O)[O-])cc1[C@@H]1NC(=O)NC(C)=C1C(=O)OC 4845438 HVQUCMUFDXIAQP-AWEZNQCLSA-N 349.343 2.185 5 50 EEBA CS(=O)(=O)Nc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 6268049 SVRSTMWGOXIFML-UHFFFAOYSA-N 335.341 2.219 5 50 EEBA C[C@@H]1C[C@H](C(=O)O)CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 263367557 UGZIHEKQRGFYGX-SCZZXKLOSA-N 326.736 2.431 5 50 EEBA CNc1ncncc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 952995725 WQRVXWDEXOQUGU-UHFFFAOYSA-N 342.359 2.279 5 50 EEBA COc1ccc2nc(NC(=O)c3[nH]nc(OC)c3[N+](=O)[O-])sc2c1 12648857 JHPFPXGJSSWFRH-UHFFFAOYSA-N 349.328 2.197 5 50 EEBA CCc1nccn1[C@@H](C)CC(=O)NCc1ccc(O)c([N+](=O)[O-])c1 952877197 MROFANHBKHFWRR-NSHDSACASA-N 332.360 2.327 5 50 EEBA Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1nc2ccc(F)cc2n1C 225584169 UVJUKJIZICFAOD-UHFFFAOYSA-N 343.318 2.254 5 50 EEBA COC(=O)c1ccc(O)c(NC(=O)c2cc([N+](=O)[O-])ccc2OC)c1 225737864 GMCIYYGEWPGDFV-UHFFFAOYSA-N 346.295 2.348 5 50 EEBA O=C(CNC(=S)NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 1794635 XMXBJLYYGXHLDD-UHFFFAOYSA-N 343.364 2.082 5 50 EEBA aggregator O=C(NC1[C@H]2CC3C[C@H]1CN(C3)C2)c1ccc([N+](=O)[O-])cc1Cl 928995888 LCHSTSMXJDCWAJ-SSOKKCIESA-N 335.791 2.318 5 50 EEBA CCN1C(=O)[C@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 73295 PUKINCMZUYEQTH-SFHVURJKSA-N 340.335 2.422 5 50 EEBA Nc1cccc([N+](=O)[O-])c1C(=O)NCc1ccn(-c2ccccc2)n1 253425701 YXNSBUADHAGZOD-UHFFFAOYSA-N 337.339 2.293 5 50 EEBA CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1ccc(C(=O)NC)cc1 288209280 UKEGSIQDLKQPIN-UHFFFAOYSA-N 331.376 2.116 5 50 EEBA C[C@@H]1CN(C)CCN1C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] 448945003 GDPGXOXTCPJQDY-SECBINFHSA-N 331.294 2.390 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cc(-c2ccncc2)n[nH]1 171296737 ANKFTQWPBCYRFS-UHFFFAOYSA-N 339.311 2.397 5 50 EEBA Nc1ccc([N+](=O)[O-])c(N2CCC(CC(=O)N3CCCC3)CC2)c1 192779762 LATDDSVIPFVGMX-UHFFFAOYSA-N 332.404 2.406 5 50 EEBA Nc1ccc(C(=O)N2CCO[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] 181161348 LULILHTWJMEUPV-OAHLLOKOSA-N 341.367 2.261 5 50 EEBA CCOP(=O)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)OCC 263621672 YDMRXISJBMWADA-UHFFFAOYSA-N 338.278 2.054 5 50 EEBA COc1ccc(Br)cc1[C@@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 88911 GYNLENYWMBGSAY-SKDRFNHKSA-N 329.150 2.054 5 50 EEBA CC(C)C(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@@]1(O)C(F)(F)F 108432 SFURRAREFXBMRG-CYBMUJFWSA-N 345.277 2.438 5 50 EEBA O=[N+]([O-])c1cnc2ccc(NCc3ccccc3-n3ccnc3)nn12 170604241 GPUMVXYPSIGFRL-UHFFFAOYSA-N 335.327 2.435 5 50 EEBA CCn1cnnc1[C@@H]1CCCN(c2nc3ccccn3c2[N+](=O)[O-])C1 225527779 FWDHNDLCVMQASC-GFCCVEGCSA-N 341.375 2.238 5 50 EEBA Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC1=NCCS1 253415345 FFLSLXFSPKLZCK-UHFFFAOYSA-N 344.190 2.498 5 50 EEBA COc1ccc(CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 442509 HNEBYUUTKPLQIM-UHFFFAOYSA-N 336.369 2.124 5 50 EEBA Cc1cc(C(=O)NCc2ccn3ccnc3c2)c(N)c([N+](=O)[O-])c1 178060441 PKHWQZRVSYNRTJ-UHFFFAOYSA-N 325.328 2.063 5 50 EEBA CC(=O)c1cccc(NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c1 4358206 TUEFBZXLJDAQRP-UHFFFAOYSA-N 345.336 2.358 5 50 EEBA COC(=O)c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 285205 ZEZJYJVWJSWPOF-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA C[C@H](C(=O)O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 237441451 KVOQCMOUOJAZEO-SECBINFHSA-N 347.293 2.209 5 50 EEBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCc2ccccc2[C@H]1CO 170084049 VPTJJVMCAZHBKE-OAHLLOKOSA-N 328.324 2.032 5 50 EEBA COc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(OC)c1 4697750 KQGGUSJSMLUVJH-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA Cc1noc([C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(C)C)n1 112028290 ILQHQJSEFXPJJV-AWEZNQCLSA-N 334.332 2.179 5 50 EEBA Cc1nn(CC(=O)NCc2cc3ccccc3[nH]2)c(C)c1[N+](=O)[O-] 373708 IFDDRIBMCISMPR-UHFFFAOYSA-N 327.344 2.206 5 50 EEBA Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)no1 170619675 SMFNEBLWDMEDAW-UHFFFAOYSA-N 328.284 2.457 5 50 EEBA Cc1c(C(=O)N2CCN(c3ccccn3)CC2)cccc1[N+](=O)[O-] 4699427 CYVGLGSYKMJWOI-UHFFFAOYSA-N 326.356 2.261 5 50 EEBA Cc1c([N+](=O)[O-])cnn1Cc1nn2c(-c3cccs3)nnc2s1 20606985 WSPWENUPLODFMO-UHFFFAOYSA-N 347.385 2.376 5 50 EEBA C[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3ccc(Cl)cc3[N+](=O)[O-])C(=O)[C@H]12 245227075 YSONTOHIUUJOAN-FJJYHAOUSA-N 334.715 2.081 5 50 EEBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1c(Cl)ccc2nsnc12 170592253 TWBFPQVEHJOQOE-UHFFFAOYSA-N 338.736 2.088 5 50 EEBA CCOC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 29225159 BEZXGSZPWXRHIN-INIZCTEOSA-N 342.351 2.499 5 50 EEBA in-vitro Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCO[C@H]1c1ccccc1 188229886 PRCLDKAVDZVPJW-HOTGVXAUSA-N 327.340 2.437 5 50 EEBA Cc1noc(C)c1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O 225535602 MRZBXTVDMNIEAR-UHFFFAOYSA-N 339.373 2.258 5 50 EEBA CC1=NN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@](O)(C(F)(F)F)C1 204528 SYYKKCCMUDZCEK-LBPRGKRZSA-N 331.250 2.376 5 50 EEBA Cc1noc(C)c1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4901036 GBTPTZKBXQKGGE-UHFFFAOYSA-N 330.344 2.162 5 50 EEBA O=C(CSc1nc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)N1CCCCC1 6998714 XLUJZWHSEGLTTO-UHFFFAOYSA-N 347.400 2.485 5 50 EEBA O=C(N[C@H](C(=O)O)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2169861 MIVUDAUOXJDARR-ZDUSSCGKSA-N 345.267 2.059 5 50 EEBA COc1cccc(C=O)c1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 2975807 FDGOUZMWSWNZIB-UHFFFAOYSA-N 337.309 2.184 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(O)cc1C(=O)O 4695715 FHHCNAUXXNYHGZ-UHFFFAOYSA-N 332.268 2.016 5 50 EEBA COc1ccccc1N1CCC[C@@H](n2cc(C)c([N+](=O)[O-])n2)C1=O 328589460 HSZIWVBTRHPEHY-CYBMUJFWSA-N 330.344 2.476 5 50 EEBA Cc1nc(NCc2cccnc2N2CCN(C)CC2)ccc1[N+](=O)[O-] 268429722 AWJWQDRYFNMNCN-UHFFFAOYSA-N 342.403 2.057 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc2c(cc1F)NC(=O)CC2 189998566 AKLHPICTGADNGK-UHFFFAOYSA-N 344.302 2.453 5 50 EEBA O=[N+]([O-])c1cc(Br)c2nsnc2c1N1CCOCC1 4141957 SYURFVBYQOZNLT-UHFFFAOYSA-N 345.178 2.199 5 50 EEBA CCc1nccn1[C@H](C)CC(=O)NCc1ccc(O)c([N+](=O)[O-])c1 952877196 MROFANHBKHFWRR-LLVKDONJSA-N 332.360 2.327 5 50 EEBA CCO[C@@H]1C[C@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)[C@@H]1OC 273938172 CWLAHBJLKLZCBP-ZENOOKHLSA-N 336.388 2.442 5 50 EEBA O=[N+]([O-])c1cnc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)s1 249219097 FTIBDLUIVBILNA-QWHCGFSZSA-N 334.401 2.099 5 50 EEBA CN1CCN(c2ccccc2NC(=O)c2ccc([N+](=O)[O-])o2)CC1 2443701 ICWQOMBLDBHQHC-UHFFFAOYSA-N 330.344 2.192 5 50 EEBA Cc1ncsc1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O 170604920 DROJDOBRPBKEPX-UHFFFAOYSA-N 327.387 2.375 5 50 EEBA Cc1cc(=O)oc2cc(OCC(=O)N3CCCCC3)c([N+](=O)[O-])cc12 937213 NIVIKYGUUSEGQV-UHFFFAOYSA-N 346.339 2.401 5 50 EEBA COc1ccc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(OC)c1 197063 BGJKKECFJVJHOQ-UHFFFAOYSA-N 334.332 2.064 5 50 EEBA COC(=O)c1cc(C(=O)Nc2ccc3c(c2)OCO3)cc([N+](=O)[O-])c1 2857200 UQCSPRGKATWWLV-UHFFFAOYSA-N 344.279 2.362 5 50 EEBA O=C(O)C[C@@H](c1ccccc1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 4714252 WNXPSCOODSMEKU-ZDUSSCGKSA-N 340.291 2.407 5 50 EEBA COc1ccc([C@@H]2CCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])cc1OC 159526230 UPQSYFAESVHXLF-NSHDSACASA-N 346.343 2.312 5 50 EEBA C[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(O)c1 182408595 XVUGTLPWFCMIJE-SWLSCSKDSA-N 332.356 2.391 5 50 EEBA CCOc1cccnc1N1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 952994857 VPBCBKIYIDJRGN-UHFFFAOYSA-N 343.387 2.419 5 50 EEBA CC(C)[C@](C)(NCc1ccc(Br)c([N+](=O)[O-])c1)C(N)=O 289303949 IOMYLBMURLVMIN-ZDUSSCGKSA-N 344.209 2.347 5 50 EEBA CC(C)[C@](C)(NCc1ccc(Br)cc1[N+](=O)[O-])C(N)=O 312808690 RQEPQUZYCOAJES-ZDUSSCGKSA-N 344.209 2.347 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1 19498387 SUQLDIGMLLWLIT-DLBZAZTESA-N 328.372 2.338 5 50 EEBA CC(C)C(=O)N[C@H]1CCCN(c2nc3sccn3c2[N+](=O)[O-])C1 225531680 XHVKPICSPUDXCV-JTQLQIEISA-N 337.405 2.045 5 50 EEBA Cc1cc(=O)c(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c[nH]1 170591201 JSGFQHPXSHPEOA-UHFFFAOYSA-N 327.340 2.396 5 50 EEBA O=[N+]([O-])c1cc2c(cc1CNCCc1ccc3c(c1)OCO3)OCO2 19720743 VYKJKFHHJVXARA-UHFFFAOYSA-N 344.323 2.385 5 50 EEBA Cc1ccc(N2C[C@@H](C(=O)Nc3ncc([N+](=O)[O-])s3)CC2=O)cc1 5027874 WIVBWTCSGYLKIE-JTQLQIEISA-N 346.368 2.351 5 50 EEBA O=C(O)c1cccc([N+](=O)[O-])c1C(=O)Nc1cccc([N+](=O)[O-])c1 2923754 NSJWVLQJKXAOES-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA O=C(c1cccc(Cn2cc([N+](=O)[O-])ccc2=O)c1)N1CCCCC1 298782291 OOCORCNLHDYTCL-UHFFFAOYSA-N 341.367 2.431 5 50 EEBA Cn1c(/C=C/c2cccc3ccccc23)c([N+](=O)[O-])c(=O)n(C)c1=O 4132114 QXDIKLBSIUPLJS-ZHACJKMWSA-N 337.335 2.316 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H](OCC3CC3)C2)cc1 328588370 OICLCEHJUBZXCA-CQSZACIVSA-N 340.401 2.175 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2ccncc2F)[C@@H](C)C1 1775992312 YOGXKYXJOJOZPQ-NSHDSACASA-N 348.382 2.369 5 50 EEBA O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 4543571 PPFVANTUCBVZTB-UHFFFAOYSA-N 347.396 2.106 5 50 EEBA COc1ccc(C=O)cc1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 2985962 WSYZRXZWHHMDIK-UHFFFAOYSA-N 337.309 2.184 5 50 EEBA O=C(Nc1cccnc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4866013 HSYSJASKYAXAMU-UHFFFAOYSA-N 328.328 2.079 5 50 EEBA CNC(=O)c1ccc(N(CCN(C)C)C2CCCC2)c([N+](=O)[O-])c1 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C[C@@]1(c2cccnc2)N=C(O)N(Cc2ccc([N+](=O)[O-])c(F)c2)C1=O 328593865 SSCUTAYLZAHSGO-INIZCTEOSA-N 344.302 2.301 5 50 EEBA O=C(CNc1ccccc1[N+](=O)[O-])N1CCc2ccc(O)cc2C1 170675656 SQGCKCDCWGUSPK-UHFFFAOYSA-N 327.340 2.297 5 50 EEBA Cc1cc(OCCCCN2C(=O)NC(C)(C)C2=O)ccc1[N+](=O)[O-] 2862956 WYQPKUAXBNHLEP-UHFFFAOYSA-N 335.360 2.393 5 50 EEBA O=[N+]([O-])c1cccc(OC[C@H](O)CNCC[C@@H](O)c2ccccc2)c1 843086990 HPRRYPZLAKEKCR-SJLPKXTDSA-N 346.383 2.048 5 50 EEBA O=C(O)CN1C(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2C1=O 4599679 XMGPSFDLTPNHOU-UHFFFAOYSA-N 342.263 2.068 5 50 EEBA CCc1n[nH]c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)n1 4867498 AIHLYRMQTXVIFH-UHFFFAOYSA-N 337.361 2.015 5 50 EEBA O=[N+]([O-])c1cc(CN2CCC[C@@H](N3CCNCC3)C2)ccc1Cl 170082911 ZNLLLMPGMFIADS-CQSZACIVSA-N 338.839 2.118 5 50 EEBA CCOC(=O)c1nc(C2CCN(c3ccccc3[N+](=O)[O-])CC2)n[nH]1 278125878 YQIHLAKQOFKEHJ-UHFFFAOYSA-N 345.359 2.274 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@@H]2[C@@H]1c1cccc([N+](=O)[O-])c1 19770501 JOSPDSUBUHTOLT-IRXDYDNUSA-N 328.372 2.338 5 50 EEBA CCOCc1nnc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1 2734736 HHPPDAQIXNBBMW-UHFFFAOYSA-N 338.345 2.244 5 50 EEBA COc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 4598704 GAPBZWDSVRAZAD-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1N=C(C2CC2)C[C@]1(O)C(F)F 8663677 PXJFCLUTOOYLBP-AWEZNQCLSA-N 325.271 2.160 5 50 EEBA CC(=O)NCCN(c1cc(C)c([N+](=O)[O-])cn1)C1CCSCC1 225778808 WDOIBGUYLNRNCR-UHFFFAOYSA-N 338.433 2.136 5 50 EEBA O=C(Cc1ccccc1)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19773580 DGWMZFMAJNRYBF-UHFFFAOYSA-N 339.395 2.482 5 50 EEBA CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 8780922 GYUIHEHPGSLFPR-UHFFFAOYSA-N 348.384 2.361 5 50 EEBA CCOC(=O)c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])c(F)cc1C 253423036 BHBUEQIQMKPYOL-UHFFFAOYSA-N 336.279 2.194 5 50 EEBA O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H]1CCCO1 253416444 DNSXEHGVELUFIA-HOTGVXAUSA-N 333.388 2.490 5 50 EEBA Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1C 374316297 HWNQRUWIUPRMCF-OAHLLOKOSA-N 344.371 2.457 5 50 EEBA CCc1nccn1CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 1177513993 LWXSUAVTTMIBIT-UHFFFAOYSA-N 327.344 2.265 5 50 EEBA Cc1cccc(N2CCC(c3ccnn3CCO)CC2)c1[N+](=O)[O-] 170602852 HOELOMHAGIIUNC-UHFFFAOYSA-N 330.388 2.476 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N1C[C@H](C)O[C@H](C)C1 16346616 MYEHNMMOVPEOJM-AOOOYVTPSA-N 325.390 2.409 5 50 EEBA O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2cccn2)C1 253392869 HRJSGYZDSUMFKZ-CQSZACIVSA-N 343.387 2.457 5 50 EEBA Cc1cc(N(C)C2CCN(CCn3cccn3)CC2)ncc1[N+](=O)[O-] 241911202 UAMXMDNJOUBCPG-UHFFFAOYSA-N 344.419 2.096 5 50 EEBA CCOC(=O)C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 460352 JBAZGZUXJXZDEP-VMPITWQZSA-N 332.356 2.410 5 50 EEBA Cc1nc2nc(Sc3c([N+](=O)[O-])c(C)nn3C)nn2c(C)c1C 301251281 DFXKHNUVMNAYJS-UHFFFAOYSA-N 333.377 2.151 5 50 EEBA CC(=O)c1ccc(N2[C@H](C(N)=O)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 248378794 KQFYZIUDRBWDIU-IOASZLSFSA-N 331.372 2.420 5 50 EEBA O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC[C@H](c2nc[nH]n2)C1 952875963 VOUOADKGEFHPKZ-JTQLQIEISA-N 335.751 2.386 5 50 EEBA CCN1C(=O)N[C@@H](c2ccc(OC)c([N+](=O)[O-])c2)C(C(=O)OC)=C1C 1074991 JKGMBVKWGOMWIM-AWEZNQCLSA-N 349.343 2.137 5 50 EEBA CC(C)(C)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 5101439 XETPOWJSNKPVGH-UHFFFAOYSA-N 328.800 2.164 5 50 EEBA O=C(O)[C@H]1CS[C@H](c2cc([N+](=O)[O-])ccc2N2CCCCC2)N1 4623415 BMCJYTDGYNXUSC-TZMCWYRMSA-N 337.401 2.373 5 50 EEBA COC(=O)CSc1ccc(C(=O)N2CCCCC2)cc1[N+](=O)[O-] 48130 YVEOXZYNAPWPQE-UHFFFAOYSA-N 338.385 2.486 5 50 EEBA O=[N+]([O-])c1ccc([C@@H](O)CN2CCN(Cc3ccccc3)CC2)cc1 446528 NOOZVSMQWFDGGH-IBGZPJMESA-N 341.411 2.446 5 50 EEBA COc1ccc(C(=O)N[C@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] 282803924 NABRHZMXGKONJK-LBPRGKRZSA-N 330.344 2.144 5 50 EEBA O=C(Nc1ccc2c(c1)OCO2)c1cc([N+](=O)[O-])cc2cn[nH]c12 1422276 KZTNYRJPWXGPCG-UHFFFAOYSA-N 326.268 2.452 5 50 EEBA O=[N+]([O-])c1c(N[C@@H](CO)C[C@H](O)c2ccccc2)nc2sccn12 269905258 GUKCTJWYDWZDKF-NEPJUHHUSA-N 348.384 2.201 5 50 EEBA COC(=O)[C@@H]1CCCN1Cc1ccc(Br)c([N+](=O)[O-])c1 157794743 DISAGDUYDMSLGF-NSHDSACASA-N 343.177 2.495 5 50 EEBA O=C(C[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 119104649 MZULIHPWPKFCAN-CQSZACIVSA-N 344.323 2.302 5 50 EEBA O=c1c(Br)cc([N+](=O)[O-])cn1CCN1CCCCC1 239367086 AHJCIJUSBBJBBK-UHFFFAOYSA-N 330.182 2.005 5 50 EEBA CC(=O)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1 3904561 JINNWFWPDYOYLT-UHFFFAOYSA-N 336.367 2.003 5 50 EEBA CC(C)n1c(Sc2ncc([N+](=O)[O-])cn2)nnc1C1CCNCC1 253419593 QCGXVCXZHONJPJ-UHFFFAOYSA-N 349.420 2.175 5 50 EEBA COc1cc(C(=O)NCc2cnc(C(C)C)[nH]2)c([N+](=O)[O-])cc1OC 1472094793 LFQRQUJXBYPYFT-UHFFFAOYSA-N 348.359 2.389 5 50 EEBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N1CCCC[C@H]1C 181497 KVOMVUPZOQDTLD-MRVPVSSYSA-N 345.197 2.263 5 50 EEBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 1466560 AZQXQDRWECMYFY-JTQLQIEISA-N 339.307 2.218 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC(Cn2cccn2)CC1 126070193 ZDVYORNUPTXSFY-UHFFFAOYSA-N 332.335 2.483 5 50 EEBA COC(=O)C[C@@]1(NCc2ccc(Cl)c([N+](=O)[O-])c2)CCCOC1 770674324 BTYHOOVCTUEWKB-HNNXBMFYSA-N 342.779 2.450 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1-n1ccnn1 123928362 ZCUZHDGTVCVHQZ-UHFFFAOYSA-N 339.311 2.193 5 50 EEBA O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2c(cccc2[N+](=O)[O-])C1 161481498 CPVUUDBIQKNACT-CYBMUJFWSA-N 326.356 2.323 5 50 EEBA O=C(O)/C=C/c1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 5150664 QFYRNZZUBLTWLR-JXMROGBWSA-N 348.336 2.493 5 50 EEBA CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2nnc(C)n2C2CC2)c1 283062335 JZSWHICGJUOIOP-UHFFFAOYSA-N 345.359 2.158 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1N=C(C2CC2)C[C@@]1(O)C(F)F 17066571 PXJFCLUTOOYLBP-CQSZACIVSA-N 325.271 2.160 5 50 EEBA O=C(O)[C@@H]1CS[C@H](c2cc([N+](=O)[O-])ccc2N2CCCCC2)N1 4623412 BMCJYTDGYNXUSC-GXTWGEPZSA-N 337.401 2.373 5 50 EEBA CCN1C(=O)[C@@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 73297 PUKINCMZUYEQTH-GOSISDBHSA-N 340.335 2.422 5 50 EEBA CCC(C)(C)NC(=O)[C@H](C)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 229718939 IWWWUDUKSBJWLB-QWHCGFSZSA-N 349.435 2.169 5 50 EEBA COc1cccc2c1CCCCN2C(=O)Cn1ccc([N+](=O)[O-])n1 129051237 QCNYBFAEPFJVLR-UHFFFAOYSA-N 330.344 2.169 5 50 EEBA Cc1nc2ccc(NS(=O)(=O)c3ccc([N+](=O)[O-])c(C)c3)cn2n1 241587857 OXQSLUGQBFFWHY-UHFFFAOYSA-N 347.356 2.055 5 50 EEBA O=C1N/C(=C/c2ccc(O)c([N+](=O)[O-])c2)C(=O)N1c1ccccc1 16225273 JZYPJKKITHIXQI-XYOKQWHBSA-N 325.280 2.398 5 50 EEBA CC(=O)Nc1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 318711 LMTRLUVBAIFQQK-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA O=C(O)CCCN1C(=O)c2cccc3c([N+](=O)[O-])ccc(c23)C1=O 4172084 IDVHGRZRZDBHOV-UHFFFAOYSA-N 328.280 2.209 5 50 EEBA CN1CCN(c2ccc([N+](=O)[O-])c(NCc3cccnc3)c2)CC1 4117521 UGIONADHPAWLPG-UHFFFAOYSA-N 327.388 2.354 5 50 EEBA Cc1cc2ncn(C[C@@H](O)Cn3cc([N+](=O)[O-])c(C)n3)c2cc1C 179857422 FCYQJCKZYQNCPY-CYBMUJFWSA-N 329.360 2.127 5 50 EEBA COCCO[C@@H]1CCN(C(=O)c2cc(C)c(Cl)c([N+](=O)[O-])c2)C1 1775998869 JPECVPWRJHFITD-GFCCVEGCSA-N 342.779 2.434 5 50 EEBA Cc1noc(C)c1CN(C)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O 170604897 RMRVWBXIMUUMMW-UHFFFAOYSA-N 339.373 2.240 5 50 EEBA O=C(O)c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 2485380 ZFLXFTBYIZKZQB-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCCC[C@H]1c1nc(-c2ccccc2)no1 247445653 YLMVSOGBQUVVCO-HZSPNIEDSA-N 342.355 2.455 5 50 EEBA C[C@@H]1C[C@@H]1C(=O)OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-] 240707744 HQIMHBIUPIKGPP-BZPMIXESSA-N 332.356 2.399 5 50 EEBA Cn1nnnc1-c1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 160418533 ZSOISRGSLWOHRC-UHFFFAOYSA-N 342.290 2.177 5 50 EEBA Cc1ccnc2[nH]c(Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)nc12 170599537 SCAKIIBLSMCSEG-UHFFFAOYSA-N 325.284 2.131 5 50 EEBA CCSc1nnc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)s1 2949175 NWQQQINOGJYZMS-UHFFFAOYSA-N 336.354 2.359 5 50 EEBA CCn1cnnc1[C@H]1CCCN(c2nc3ccccn3c2[N+](=O)[O-])C1 225527806 FWDHNDLCVMQASC-LBPRGKRZSA-N 341.375 2.238 5 50 EEBA C[C@@H](c1ccccc1)[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(N)=O 794717243 KMFXNRCIMKLMJJ-MEDUHNTESA-N 331.347 2.481 5 50 EEBA CC(=O)c1cccc(NCN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 175696 KTIYQLQLXPJLHZ-UHFFFAOYSA-N 339.307 2.463 5 50 EEBA O=C(N[C@H]1[C@H]2C[C@H]3C[C@@H]1C[C@@](O)(C3)C2)c1cc([N+](=O)[O-])ccc1F 239235657 WLCCNTIEFHQWKG-NNWIRHMRSA-N 334.347 2.403 5 50 EEBA Cc1cccc(C)c1OC[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 194149836 XYXCOZPCRZWQGD-GFCCVEGCSA-N 346.387 2.451 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc([N+](=O)[O-])ccc1Cl 462143 FOESQICWQOENEI-GFCCVEGCSA-N 339.735 2.439 5 50 EEBA CCN(C[C@@H](C)OC)c1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] 360237168 GKRQNRLEUORNGN-GFCCVEGCSA-N 346.387 2.421 5 50 EEBA Cc1ccc(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])cc1 4703602 FJDVVSHIVWWOJV-UHFFFAOYSA-N 335.385 2.294 5 50 EEBA CN(C)c1ncccc1O[C@H]1CCN(c2ncccc2[N+](=O)[O-])C1 282062111 ZZYGCTMYVCJGLI-LBPRGKRZSA-N 329.360 2.109 5 50 EEBA CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 3898508 IWDGXZIPCBUINW-UHFFFAOYSA-N 349.368 2.097 5 50 EEBA CNc1cc(N2CCN(C(=O)c3ccco3)CC2)ccc1[N+](=O)[O-] 4688282 IUAFTAXFPLFVRQ-UHFFFAOYSA-N 330.344 2.192 5 50 EEBA CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@H]1c1cccc([N+](=O)[O-])c1 42787 UMPJPEONKFXGFT-AWEZNQCLSA-N 347.327 2.045 5 50 EEBA COC(=O)/C=C/c1ccc(NC[C@@H](C)c2nncn2C)c([N+](=O)[O-])c1 170606517 JMDDUCVPWPOVMM-OKPNEXGHSA-N 345.359 2.125 5 50 EEBA Cc1ccc(S(=O)(=O)Nc2ccccc2[C@H](O)C[N+](=O)[O-])cc1 174249 HPFCFCOLWSBUBE-OAHLLOKOSA-N 336.369 2.106 5 50 EEBA Cc1ccc(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1 4739211 ZYNJOJVYVUUIJR-UHFFFAOYSA-N 335.385 2.294 5 50 EEBA Cc1c(CC(=O)N2CCNC[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] 423616792 SIOIEXBVOKRKSX-QGZVFWFLSA-N 340.383 2.014 5 50 EEBA COc1ccc2c(c1)OC[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C2 362407886 OIYJYDBHFFEAMA-GFCCVEGCSA-N 346.314 2.476 5 50 EEBA C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(O)c1 182408555 XVUGTLPWFCMIJE-WFASDCNBSA-N 332.356 2.391 5 50 EEBA O=[N+]([O-])c1c(N[C@@H](CO)C[C@@H](O)c2ccccc2)nc2sccn12 269905263 GUKCTJWYDWZDKF-VXGBXAGGSA-N 348.384 2.201 5 50 EEBA C[C@@H](C[N+]1(C)CCOCC1)OC[C@@H]1CCC[N@@+]2(C)CCCC[C@H]12 252441435 VNZYHBOMJJKSJY-CTAFRAEOSA-N 326.525 2.277 5 50 EEBA biogenic O=C(C[C@H]1CNN(c2ccccc2)C1=O)Nc1ccc([N+](=O)[O-])cc1 1740818246 MYGCFBIBHDJTIH-LBPRGKRZSA-N 340.339 2.091 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@]2(O)CCCC[C@H]2C1 160965823 MLFNLUJNNIAZLO-YOEHRIQHSA-N 333.388 2.431 5 50 EEBA O=C(N[C@@H]1[C@H]2C[C@H]3C[C@@H]1C[C@@](O)(C3)C2)c1cc([N+](=O)[O-])ccc1F 239235656 WLCCNTIEFHQWKG-IEJHMPNHSA-N 334.347 2.403 5 50 EEBA CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)OC)c1 253392559 LTMYMTDBLHKXTR-CQSZACIVSA-N 336.344 2.161 5 50 EEBA O=C(Cc1ccc([N+](=O)[O-])cc1)NCCOC(=O)c1ccccc1 2896181 ZGFFJYZEWGTGEP-UHFFFAOYSA-N 328.324 2.111 5 50 EEBA Cc1nccn1CCCN1CCN(c2ccccc2[N+](=O)[O-])CC1 269138779 YWGFHIKDLBJQDZ-UHFFFAOYSA-N 329.404 2.312 5 50 EEBA COc1cc2c(=O)oc3c(OC)c(O)cc4c(=O)oc(c1OC)c2c34 900426 LXEQIOGTMDLLEC-UHFFFAOYSA-N 344.275 2.222 5 50 EEBA biogenic,in-vitro Cc1cc(O)nc(N2CCC[C@@H](Nc3ccccc3[N+](=O)[O-])C2)n1 952994858 VPGSAEBAALXAES-GFCCVEGCSA-N 329.360 2.480 5 50 EEBA Cc1c(C(=O)N2CCN(C(=O)c3ccco3)CC2)cccc1[N+](=O)[O-] 2707864 RSJOBIXJMMQWNJ-UHFFFAOYSA-N 343.339 2.094 5 50 EEBA O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])o1 20313971 UBLZFOWPOCQVEF-UHFFFAOYSA-N 331.328 2.272 5 50 EEBA Cn1ccc(N2CCC[C@@H](Sc3ccc([N+](=O)[O-])cn3)C2=O)n1 159686714 HAZLNRYQGMSTRP-LLVKDONJSA-N 333.373 2.011 5 50 EEBA Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1[C@H]2CCCO[C@H]2C1(C)C 252516824 XBVOGHUFOAUEHB-NILFDRSVSA-N 337.376 2.237 5 50 EEBA CNC(=O)/C(=C\c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 5002861 CRASJOAKSOAJDX-RVDMUPIBSA-N 325.324 2.112 5 50 EEBA O=C(NCc1nnc[nH]1)c1cc([N+](=O)[O-])ccc1Nc1ccccc1 242183863 XCOWFDQXUDMOIB-UHFFFAOYSA-N 338.327 2.387 5 50 EEBA C[C@H](O)CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 126726347 ZNMYAWZWTJSITN-UPJWGTAASA-N 335.404 2.188 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2ccncc2F)[C@H](C)C1 1775992309 YOGXKYXJOJOZPQ-LLVKDONJSA-N 348.382 2.369 5 50 EEBA NS(=O)(=O)c1cccc(NC/C=C/c2ccccc2[N+](=O)[O-])c1 170612405 SRAHYASKSQYASA-GQCTYLIASA-N 333.369 2.368 5 50 EEBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H](Cc2nn[nH]n2)C1 1875272861 SSNFYGRMOLPWMJ-MRVPVSSYSA-N 342.281 2.196 5 50 EEBA C[C@H]1CN(CC(F)(F)F)CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 456743216 POAIJTUAXVECMI-VIFPVBQESA-N 335.282 2.144 5 50 EEBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N1CCCCCC1 196102 HSISOEYBFROWNA-UHFFFAOYSA-N 345.197 2.265 5 50 EEBA COc1cc(C(=O)Nc2ccccc2-n2ccnn2)ccc1[N+](=O)[O-] 195285310 PWVMEICMAQQHMQ-UHFFFAOYSA-N 339.311 2.436 5 50 EEBA COc1ccc(OC)c(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 271677 PVCUSAIHTCKCEP-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCSCc2ccco2)c1 5050217 RKNHUBQOIRBKBH-UHFFFAOYSA-N 342.398 2.400 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1 4152279 KHQPILQHBIECIS-CQSZACIVSA-N 348.355 2.052 5 50 EEBA Cc1nnc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])s1 2875618 IYFORJYPUUZTIG-UHFFFAOYSA-N 331.400 2.309 5 50 EEBA COc1ccc(S(=O)(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 3833469 ZDUGEADWUFAWQO-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCN2CCCC[C@@H]12 229605207 DWEPEBQBGSTRRR-GJZGRUSLSA-N 332.404 2.140 5 50 EEBA O=C1O[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3c1nc(-c2ccc([N+](=O)[O-])cc2)no1 247326191 NNQNAIAOFWBWKX-ZGYLKHSLSA-N 327.296 2.310 5 50 EEBA Cc1sc2ncn3nc(Cn4ccc([N+](=O)[O-])n4)nc3c2c1C 2808274 GMNPGVPBFHQNTE-UHFFFAOYSA-N 329.345 2.109 5 50 EEBA COC(=O)CCN(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 1802519 YMOCUVYPANPNFT-UHFFFAOYSA-N 329.312 2.200 5 50 EEBA CS(=O)(=O)NC[C@@H]1CCCN(c2cc(Cl)ccc2[N+](=O)[O-])C1 253415408 IIJYFOVCVSXHJO-JTQLQIEISA-N 347.824 2.014 5 50 EEBA Cc1nc(N2CCC(CN=S(C)(C)=O)CC2)ccc1[N+](=O)[O-] 952993181 LYSNMSGGMRUJBY-UHFFFAOYSA-N 326.422 2.242 5 50 EEBA O=C1NC(=O)/C(=C\c2cc([N+](=O)[O-])cc(Br)c2O)S1 13476324 BBVWTNYPEUPHIJ-FARCUNLSSA-N 345.130 2.387 5 50 EEBA C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 22309388 XFAHFRBDDMOVKQ-PXAZEXFGSA-N 342.351 2.482 5 50 EEBA O=C1c2ccccc2C(=O)N1CCOc1c(Cl)cncc1[N+](=O)[O-] 253417826 MXORDPMHASRVHW-UHFFFAOYSA-N 347.714 2.318 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)c2ccc(C(=O)O)cc2C1=O 285231 PKJAHSJIWCHJMH-UHFFFAOYSA-N 326.264 2.402 5 50 EEBA CC(=O)[C@@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@H]2C(C)=NN=C2C[C@]1(C)O 239432785 WLADKGWPKZATAW-HZMVEIRTSA-N 329.356 2.485 5 50 EEBA Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C 170645885 XBVOGHUFOAUEHB-TUKIKUTGSA-N 337.376 2.237 5 50 EEBA CN(C)c1noc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1 170601824 KKWPVQCRJKRHDT-MRVPVSSYSA-N 337.361 2.083 5 50 EEBA O=[N+]([O-])c1cnn(CCNCc2sccc2Br)c1 195564579 BMZGVRCCXSYDTG-UHFFFAOYSA-N 331.195 2.405 5 50 EEBA O=C(Nc1cc([N+](=O)[O-])ccc1C(=O)O)c1ccc([N+](=O)[O-])cc1 2840030 FTIDDOZKCSMCGA-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA COc1ccc(OC)c(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 4289704 LVJGQRBHDJBSDJ-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA COc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 3852470 KZPNGPLYSPMHBJ-UHFFFAOYSA-N 331.284 2.442 5 50 EEBA biogenic Cc1nn(CCC(=O)O[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c(C)c1[N+](=O)[O-] 241897335 TXSVTWFRSNCQLF-KCPJHIHWSA-N 337.376 2.155 5 50 EEBA CCOC(=O)[C@H]1CCCCN1Cc1cc(OC)c(O)c([N+](=O)[O-])c1 4978549 OKGUVRCIWZZOGL-GFCCVEGCSA-N 338.360 2.227 5 50 EEBA Cc1c([C@H]2OCC[C@@H]2C(=O)Nc2cc([N+](=O)[O-])ccc2F)cnn1C 275427125 UVGQKRREENUBPH-NHYWBVRUSA-N 348.334 2.492 5 50 EEBA Nc1ncc(-c2cc([N+](=O)[O-])ccc2Cl)c(SCC(=O)O)n1 4529652 DZFWFJIKSFAXFT-UHFFFAOYSA-N 340.748 2.464 5 50 EEBA C[C@@H]1[C@@H](NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)CCC[C@H]1C 245312049 RZMFWVKJIBQXQX-NRUUGDAUSA-N 337.401 2.458 5 50 EEBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)(F)F)cc2)n1 2762582 RLHREQZCONCAKE-UHFFFAOYSA-N 330.222 2.479 5 50 EEBA COc1cc([N+](=O)[O-])ccc1OCC(=O)NC(=O)Nc1ccccc1 357345731 KRSCMXSNSDEQBP-UHFFFAOYSA-N 345.311 2.331 5 50 EEBA Cc1cc(F)cc(C(=O)Nc2ccc(-c3nnn[nH]3)cc2)c1[N+](=O)[O-] 129421827 SCSHISWUEDQCAF-UHFFFAOYSA-N 342.290 2.475 5 50 EEBA O=[N+]([O-])c1ccc(F)cc1N1CCC(c2ccnn2CCO)CC1 240423768 FQRYTHHITXEXFR-UHFFFAOYSA-N 334.351 2.307 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)NCCCn1cc(C)cn1 5041903 HMEXYXDUPYFQQB-UHFFFAOYSA-N 349.416 2.485 5 50 EEBA CC[C@H](C)n1c(=N)c(C(=O)OC)cc2c(=O)n3cccc(C)c3nc21 100662666 PAUZQXRMJQJHEF-NSHDSACASA-N 340.383 2.195 5 50 EEBA COc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])c1 100058528 POQLTXUQTRSJEL-FCIDVOKBSA-N 328.324 2.305 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCC[C@@H]1c1nc[nH]n1 123014816 VEEBJVLJCKDLCO-GFCCVEGCSA-N 346.347 2.481 5 50 EEBA O=C(Nc1ccccc1C(=O)O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1556949 DUQFNDGQDIGOCC-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA COc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1[N+](=O)[O-] 3893532 DGLYTOXYMKCIEU-UHFFFAOYSA-N 348.380 2.350 5 50 EEBA O=C1c2ccccc2C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4900857 TUEICSRHMDIWAB-UHFFFAOYSA-N 328.240 2.126 5 50 EEBA O=C(N1CCCC1)C12C[C@@H]3C[C@H](C1)CC(n1cnc([N+](=O)[O-])n1)(C3)C2 18172619 SYVZLHLPSMIQMA-ZPVISIIKSA-N 345.403 2.104 5 50 EEBA Cc1ccc(S(=O)(=O)Nc2ccccc2[C@@H](O)C[N+](=O)[O-])cc1 174252 HPFCFCOLWSBUBE-HNNXBMFYSA-N 336.369 2.106 5 50 EEBA COC1CCN(c2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)CC1 328593843 RBVVNGSEJUFACT-UHFFFAOYSA-N 339.367 2.186 5 50 EEBA Cc1cnc(N(C)C2CCN(CCn3cccn3)CC2)c([N+](=O)[O-])c1 242140837 WPQPAORTCPOPBB-UHFFFAOYSA-N 344.419 2.096 5 50 EEBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCc2ccccc2[C@@H]1CO 170084051 VPTJJVMCAZHBKE-HNNXBMFYSA-N 328.324 2.032 5 50 EEBA Cc1nn(C)c(C(=O)Nc2ccc(Cn3cccn3)cc2)c1[N+](=O)[O-] 374572 PAXQVWMFGBWZFG-UHFFFAOYSA-N 340.343 2.134 5 50 EEBA COC1(c2nccn2C)CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 952992665 QWEYZLVGXCENHJ-UHFFFAOYSA-N 331.376 2.174 5 50 EEBA COc1ncccc1C(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 241707076 QMKPBBQVJGHKJN-UHFFFAOYSA-N 339.311 2.140 5 50 EEBA Cc1nn(C)c(NCc2nc(-c3cccc(F)c3)no2)c1[N+](=O)[O-] 365119658 DFMOCYZONMQGJX-UHFFFAOYSA-N 332.295 2.438 5 50 EEBA COc1ccc(CNc2cccnc2-n2cncn2)cc1[N+](=O)[O-] 128874980 PGAFEPFDPPOQGS-UHFFFAOYSA-N 326.316 2.191 5 50 EEBA Cc1nc(C2CCN(c3nc4sccn4c3[N+](=O)[O-])CC2)n[nH]1 225537666 GPPHVKBZGQRUAM-UHFFFAOYSA-N 333.377 2.115 5 50 EEBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31 245226942 TTWDOFDLWQILPA-YRWVIOBZSA-N 340.335 2.161 5 50 EEBA O=C(N[C@@H]1CCN(c2ccccn2)C1)c1cc(F)ccc1[N+](=O)[O-] 161408879 YUDUTTABRPHAKG-GFCCVEGCSA-N 330.319 2.138 5 50 EEBA CN(C(=O)[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 253430327 KPKTXFSUKPMGML-CYBMUJFWSA-N 326.356 2.479 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)OCc1ccccc12 189824858 RVHSMQYYXJEKAW-GOSISDBHSA-N 339.351 2.449 5 50 EEBA CCN(CC)c1cc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])cc1F 4701953 MQURRCZKVYEOKC-UHFFFAOYSA-N 338.383 2.249 5 50 EEBA NS(=O)(=O)c1ccc(Nc2nc(Cl)ccc2[N+](=O)[O-])cc1 4952282 BYTTVPWQGMUBAG-UHFFFAOYSA-N 328.737 2.034 5 50 EEBA C[C@H](C(=O)N1CCN(c2ccccn2)CC1)c1ccc([N+](=O)[O-])cc1 4986347 QKLSKNXLPJGLIC-AWEZNQCLSA-N 340.383 2.442 5 50 EEBA O=C1[C@H]2CCCC[C@H]2C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 100498935 VMUHWBDIKFRNAE-AOOOYVTPSA-N 334.288 2.005 5 50 EEBA CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)OC)c1 253392558 LTMYMTDBLHKXTR-AWEZNQCLSA-N 336.344 2.161 5 50 EEBA O=c1ccc([N+](=O)[O-])cn1CCSc1nnc(-c2ccccc2)[nH]1 159696403 DHVUSDFCWWDMJJ-UHFFFAOYSA-N 343.368 2.334 5 50 EEBA COc1ccc(NC(=O)CN2CCO[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 230126952 YLQRNYLADYKGQR-ZBFHGGJFSA-N 349.387 2.185 5 50 EEBA Cc1cc2nc(-c3cc(N4CCOCC4)ccc3[N+](=O)[O-])ccn2n1 4052540 ZMUXHDBEHINODQ-UHFFFAOYSA-N 339.355 2.450 5 50 EEBA O=C(CN1CCCC1)Nc1ccc([N+](=O)[O-])cc1Br 5063487 GGMJHEHTHSIKDG-UHFFFAOYSA-N 328.166 2.392 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](c2ccsc2)C1 170605128 AMPTWEKAZPZZQQ-CQSZACIVSA-N 333.369 2.452 5 50 EEBA O=[N+]([O-])c1ccc(NCCNS(=O)(=O)Cc2ccccc2)cc1 4104317 GWASJFUYNKYFME-UHFFFAOYSA-N 335.385 2.126 5 50 EEBA O=C(Nc1ccc([N+](=O)[O-])cc1N1CCOCC1)c1cccnc1 16651734 PYPYXVWIZZGYLX-UHFFFAOYSA-N 328.328 2.079 5 50 EEBA O=C(O)c1ccc(Cn2cc(Br)c([N+](=O)[O-])n2)cc1 368979 VGWJEMWTFJJPLX-UHFFFAOYSA-N 326.106 2.300 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31 239173653 OJSWZGUESFPIQQ-YRWVIOBZSA-N 340.335 2.161 5 50 EEBA O=[N+]([O-])c1cccc(OC[C@@H](O)CNCC[C@H](O)c2ccccc2)c1 843086992 HPRRYPZLAKEKCR-WMZOPIPTSA-N 346.383 2.048 5 50 EEBA O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCCO1 253416441 DNSXEHGVELUFIA-CVEARBPZSA-N 333.388 2.490 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)Oc1ccccc1C(N)=O 4765551 VQUUPMIDVQCJAA-UHFFFAOYSA-N 331.284 2.313 5 50 EEBA CC[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)O 6719144 NZZMMMQBVOSFSI-CQSZACIVSA-N 338.363 2.134 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccs2)CC1 285275 SGWNRIGPTSZLTA-UHFFFAOYSA-N 345.380 2.255 5 50 EEBA O=c1c2cc3c(=O)n(C4CC4)ccc3nc2ccn1-c1ccncc1 38829378 ZKZXVCYOLCZVIM-UHFFFAOYSA-N 330.347 2.431 5 50 EEBA Cc1cc2ncn(C[C@H](O)Cn3cc([N+](=O)[O-])c(C)n3)c2cc1C 179857409 FCYQJCKZYQNCPY-ZDUSSCGKSA-N 329.360 2.127 5 50 EEBA Cc1cc(C(=O)N[C@H]2CS(=O)(=O)c3ccccc32)ccc1[N+](=O)[O-] 118633558 SCZKAFVYSSHFSB-ZDUSSCGKSA-N 346.364 2.162 5 50 EEBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1cc([N+](=O)[O-])cc(Cl)c1O 239331296 KLCLZWWVASNUES-JTNSGFRCSA-N 334.715 2.265 5 50 EEBA CCCc1[nH]nc(C(=O)N[C@@H](C)c2n[nH]c([C@H](C)CC)n2)c1[N+](=O)[O-] 277967652 UTDSNWRCGKXBAU-BDAKNGLRSA-N 349.395 2.393 5 50 EEBA COC(CN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C1CC1)OC 952992738 CEAQCDMGYQSKCI-UHFFFAOYSA-N 333.344 2.300 5 50 EEBA C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCO[C@@H](C2CCC2)C1 411873028 KUVKCSDRDGODFK-MLGOLLRUSA-N 333.388 2.423 5 50 EEBA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)cc1[N+](=O)[O-] 230318430 MAVQGQJZTWZOMB-DLTLXFJOSA-N 328.324 2.126 5 50 EEBA CCn1nccc1CCN1CCN(c2ccccc2[N+](=O)[O-])CC1 276345633 VDVQTVDWKVYHHO-UHFFFAOYSA-N 329.404 2.176 5 50 EEBA C[C@@H]1CC[C@@H](C)[C@@H](NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)C1 226695285 POXYFTHHTNBRNQ-BREBYQMCSA-N 337.401 2.458 5 50 EEBA CCCn1cc(CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])c(C)n1 1775991612 SCTDKAKCKRENSZ-UHFFFAOYSA-N 333.348 2.303 5 50 EEBA C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 246982770 DZJNXNLGSQQXCB-DOMZBBRYSA-N 344.415 2.478 5 50 EEBA CCCOc1ccc([N+](=O)[O-])cc1[C@H]1NC(=O)NC(C)=C1C(=O)OC 4845437 HVQUCMUFDXIAQP-CQSZACIVSA-N 349.343 2.185 5 50 EEBA O=C(c1ccc([N+](=O)[O-])cc1O)N1CCCCC[C@H]1c1ncon1 189649232 MMQTVTIKDCYCKU-LBPRGKRZSA-N 332.316 2.441 5 50 EEBA CCN1C(=O)[C@@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 315245 LQESQMJDLIEEOV-GOSISDBHSA-N 340.335 2.422 5 50 EEBA CCOC(=O)c1ccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1 371354 AQLSWHBZTBASRU-UHFFFAOYSA-N 332.316 2.066 5 50 EEBA COC(=O)c1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 240483 CQJAWXXYCBUCCE-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA Cc1c(CC(=O)Nc2ccnn2C[C@H]2CCOC2)cccc1[N+](=O)[O-] 119267955 AOFOZFKAFITACC-CYBMUJFWSA-N 344.371 2.317 5 50 EEBA O=C(c1ccccc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 285062 HDFNPPJLPUHQAX-UHFFFAOYSA-N 339.351 2.193 5 50 EEBA COc1cc2c(cc1OC)[C@H](c1cccc([N+](=O)[O-])c1)NC(=O)C2 296299 PPRLVNUHOQJPDK-KRWDZBQOSA-N 328.324 2.374 5 50 EEBA O=C(c1ncc(F)cc1F)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 192221717 PWTKYKGWHDHDDI-UHFFFAOYSA-N 335.266 2.171 5 50 EEBA CC(=O)Nc1ccc(NC(=O)CCCn2cc([N+](=O)[O-])cn2)cc1 1071132 GJTVZXDTZSHFJT-UHFFFAOYSA-N 331.332 2.169 5 50 EEBA C[C@@H](N)c1ccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 170684864 RDEFNOMANGBUCD-LLVKDONJSA-N 335.385 2.093 5 50 EEBA CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCCc2nn(C)cc21 241132777 JLOCOEJPBOMJHB-OAHLLOKOSA-N 342.399 2.449 5 50 EEBA Cc1ccnc(S[C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)n1 18122098 SYMWGEWQLVETFV-GFCCVEGCSA-N 344.352 2.117 5 50 EEBA CCN(Cc1ccccc1)C(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 158540424 DZXATVFLQUYKHZ-UHFFFAOYSA-N 349.774 2.459 5 50 EEBA O=[N+]([O-])c1cnc(NCC2(N3CCCCC3)CCOCC2)s1 192459130 AXCHQYHSXMKSCB-UHFFFAOYSA-N 326.422 2.498 5 50 EEBA CCc1nc(C(C)(C)NCc2cc([N+](=O)[O-])cc3c2OCOC3)no1 225649891 VZTJJAYPNMUIPD-UHFFFAOYSA-N 348.359 2.432 5 50 EEBA CCOC(=O)[C@@H]1CCCN(Cc2cc(OC)c(O)c([N+](=O)[O-])c2)C1 5326077 AZOOUCHJTXIGDU-GFCCVEGCSA-N 338.360 2.084 5 50 EEBA Nc1ccc(C(=O)N2CCO[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] 181161369 LULILHTWJMEUPV-HNNXBMFYSA-N 341.367 2.261 5 50 EEBA Cc1cc(N[C@H](Cc2ccccc2)C(=O)N(C)C)ncc1[N+](=O)[O-] 270257604 TYULWAZXCACUQN-CQSZACIVSA-N 328.372 2.410 5 50 EEBA NC(=O)c1ccc(NCc2ccccc2-n2ccnc2)c([N+](=O)[O-])c1 170087850 KTUIZAFEDOZUHB-UHFFFAOYSA-N 337.339 2.492 5 50 EEBA CC[C@H](C)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 5910051 GQYKDMFXDPLCNZ-JTQLQIEISA-N 328.800 2.164 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 248662279 GQSCVNOYSOGNOA-SOUVJXGZSA-N 333.436 2.430 5 50 EEBA COC(=O)c1cc(C)nc(NCc2cnn3c2CCCC3)c1[N+](=O)[O-] 1332931140 DHANUHSAFKUCOH-UHFFFAOYSA-N 345.359 2.230 5 50 EEBA CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@@H]1CN2CCC1CC2 347941084 GYMCYQWAKIEGJB-QGZVFWFLSA-N 342.399 2.102 5 50 EEBA CC1=NN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@](O)(C(F)(F)F)C1 204530 SYYKKCCMUDZCEK-GFCCVEGCSA-N 331.250 2.376 5 50 EEBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 245309084 AQJMIPJCUWITQP-QYAIJTBZSA-N 332.312 2.065 5 50 EEBA COc1cc(N2CCC[C@@H]([C@@H](O)c3nccn3C)C2)ccc1[N+](=O)[O-] 269351736 JUSSEXCNZBTNGB-MLGOLLRUSA-N 346.387 2.287 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1c1ncccn1 874434040 YFQRWVZCXSKMBP-ZDUSSCGKSA-N 348.384 2.219 5 50 EEBA CC(=O)c1ccc(NC[C@@H](CO)Cc2cccnc2)c([N+](=O)[O-])c1 408524056 PRANOIVXZPGYDK-AWEZNQCLSA-N 329.356 2.456 5 50 EEBA CN1C=C(C(=O)NCC[N+](C)(C)Cc2ccccc2)C=CC1=CN=O 1857524614 ZNWUXMBVLVMAMM-UHFFFAOYSA-O 341.435 2.373 5 50 EEBA COC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 4134561 IVFQOUNCDDZSNQ-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA COc1ccc(CN[C@H]2COc3ccccc3[C@H]2O)cc1[N+](=O)[O-] 288540060 KURSSSPCADETKR-SUMWQHHRSA-N 330.340 2.188 5 50 EEBA CCCN(Cc1csc([N+](=O)[O-])c1)[C@H](COC)C(=O)OCC 170611905 IAZRSTRXYHGIPR-GFCCVEGCSA-N 330.406 2.446 5 50 EEBA Cc1ccc([N+](=O)[O-])c(N2CCC(C(=O)Nc3nncs3)CC2)n1 253417993 RKMRFIBZBJGBAH-UHFFFAOYSA-N 348.388 2.005 5 50 EEBA C[C@H]1C[C@@H](C)CN(C(=O)[C@H](C)N2CCc3ncc([N+](=O)[O-])cc3C2)C1 408149621 RFORAPMMUOHZAO-MJBXVCDLSA-N 346.431 2.241 5 50 EEBA O=c1c2ccccc2nc(/C=C/c2ccc([N+](=O)[O-])cc2)n1CCO 4856239 VGTLDOKEXWBADI-JXMROGBWSA-N 337.335 2.467 5 50 EEBA O=C(c1cc([N+](=O)[O-])ccc1N1CCCCCC1)N1CCOCC1 4998412 BEBWWKHERQWMKV-UHFFFAOYSA-N 333.388 2.448 5 50 EEBA CCc1ccc(C(=O)NCc2nc(C(=O)O)cs2)cc1[N+](=O)[O-] 124146725 NWRLBHQCXXTXFK-UHFFFAOYSA-N 335.341 2.242 5 50 EEBA O=[N+]([O-])c1ccc(N2CCN(CCCc3cncc(F)c3)CC2)nc1 170607023 VEEGLJKHOVTARO-UHFFFAOYSA-N 345.378 2.279 5 50 EEBA C[C@H]1[C@@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCN1C 332477414 VMMZITMXXYIZSM-UONOGXRCSA-N 346.431 2.360 5 50 EEBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](CO)c2ccccc21 292503132 GCMLTLKZCIIZGB-LBPRGKRZSA-N 348.380 2.188 5 50 EEBA CC(C)c1ccc(C(=O)N[C@@H]2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] 188032389 MLPBLKXMNPBDAX-DGCLKSJQSA-N 333.388 2.492 5 50 EEBA COc1ccc([N+](=O)[O-])cc1CNC(=O)N1C[C@@H](C)OC(C)(C)C1 194508868 XDTOXTYSJUCCIQ-LLVKDONJSA-N 337.376 2.312 5 50 EEBA CN1C(=O)c2ccc(C(=O)Nc3ccccc3[N+](=O)[O-])cc2C1=O 4865442 KQQJPKCQMONGHY-UHFFFAOYSA-N 325.280 2.073 5 50 EEBA COC(=O)c1cc(OCC(=O)N2CCCCCC2)ccc1[N+](=O)[O-] 264755559 IDFCICRCEKGKJL-UHFFFAOYSA-N 336.344 2.163 5 50 EEBA C[N@@+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@@H]32)[C@@H]6[C@H]54 252460232 CTCZKABHVPGYMK-YIPKKHAISA-N 349.454 2.237 5 50 EEBA biogenic Cc1ccnc(N2CCC(CN(CCO)C(C)C)CC2)c1[N+](=O)[O-] 952880342 AJTXQLMFPQRHEC-UHFFFAOYSA-N 336.436 2.217 5 50 EEBA O=C(O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc(C(=O)O)c1 192326 REXGWFDACQNFQT-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA COc1ccccc1Nc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 675030036 JFOQFXLTMADZHP-UHFFFAOYSA-N 332.272 2.354 5 50 EEBA COc1ccc(CCNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 621235 DLNFULDYYCHPKB-UHFFFAOYSA-N 330.340 2.341 5 50 EEBA Cn1cnc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N)cc2)n1 170605214 SOUJBBRUOBSLNG-UHFFFAOYSA-N 338.327 2.225 5 50 EEBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1 4104331 NNYUHWKIACPNBT-UHFFFAOYSA-N 332.404 2.254 5 50 EEBA CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 103817 UNLNOXYSDORBPM-CQSZACIVSA-N 333.344 2.422 5 50 EEBA COc1ccc(Cl)cc1NC(=O)CCCn1cnc([N+](=O)[O-])n1 215143 CRMQYRLVMZSNCW-UHFFFAOYSA-N 339.739 2.267 5 50 EEBA COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCCO)cc1 4998289 ZQBMEFRGIPDBRZ-UHFFFAOYSA-N 331.328 2.260 5 50 EEBA Cn1nccc1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 124409596 YMZHPENLDDVPDI-UHFFFAOYSA-N 332.335 2.487 5 50 EEBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCCc1ccccn1 189960455 ONEKFBNPPJOCHW-UHFFFAOYSA-N 335.385 2.438 5 50 EEBA O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cc(C(F)(F)F)ccc1Cl 1017754 MXAJYGSMFXDTIF-UHFFFAOYSA-N 349.656 2.497 5 50 EEBA C[C@@H]1[C@@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCN1C 332477415 VMMZITMXXYIZSM-ZIAGYGMSSA-N 346.431 2.360 5 50 EEBA O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)S(=O)(=O)CC2 178059132 PUZLVMRALYXVNN-UHFFFAOYSA-N 346.364 2.106 5 50 EEBA COc1ccc(/C=C(/NC(=O)c2cccc([N+](=O)[O-])c2)C(=O)O)cc1 13111254 BRUNDGXLHYOYDJ-OQLLNIDSSA-N 342.307 2.459 5 50 EEBA CCN(C[C@H]1CCCO1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 315019864 UATOTEMEFUTOGK-LLVKDONJSA-N 348.808 2.438 5 50 EEBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C[C@H](C)OC)C(C)C 354571110 DOSSUYIVAKJMQQ-NSHDSACASA-N 346.405 2.037 5 50 EEBA C[N@+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@@H]32)[C@@H]6[C@H]54 252460231 CTCZKABHVPGYMK-JCGVQRKDSA-N 349.454 2.237 5 50 EEBA biogenic,in-vitro Cc1ccnc(N2CCC(CN=S(C)(C)=O)CC2)c1[N+](=O)[O-] 1332473542 HMEFKTONLGXHQX-UHFFFAOYSA-N 326.422 2.242 5 50 EEBA CCOC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)C[C@]1(O)C(F)(F)F 108399 PGYSPBYLYBIIOE-LBPRGKRZSA-N 347.249 2.412 5 50 EEBA CN(C)CCNc1ccc(CO)c2oc3ccc(O)cc3c(=O)c12 5486798 BOTXZPXSICDQHE-UHFFFAOYSA-N 328.368 2.118 5 50 EEBA Cc1cc(N[C@@H]2CCCN(c3cccnc3)C2=O)ncc1[N+](=O)[O-] 253426893 SKEASRNKULXXSC-CYBMUJFWSA-N 327.344 2.301 5 50 EEBA COC(=O)c1cc([N+](=O)[O-])cn(Cc2ccc3c(c2)CCC3)c1=O 169987296 UKOACGQTNPOADV-UHFFFAOYSA-N 328.324 2.080 5 50 EEBA CCN1CCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1=O 189863621 RLAWWBDTFXZWSG-CYBMUJFWSA-N 348.403 2.228 5 50 EEBA O=C(Cc1ccccc1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19773810 XGWCRUXYAMTYFT-UHFFFAOYSA-N 339.395 2.482 5 50 EEBA COC(=O)c1cc(C)nc(N2CC[C@@H](c3ccccn3)C2)c1[N+](=O)[O-] 804685454 JZGPKRXMCSLHDS-GFCCVEGCSA-N 342.355 2.474 5 50 EEBA COCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 2855607 SBVSWIUUXOOBGD-UHFFFAOYSA-N 343.339 2.223 5 50 EEBA Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@@H](C)[S@](C)=O 120346185 ZJLUETSSNQGUPP-RKFFSXRUSA-N 327.406 2.490 5 50 EEBA O=[N+]([O-])c1ccc(N2CCN(C(=S)NCc3ccco3)CC2)cc1 5041978 FLLWPDAZUANLPX-UHFFFAOYSA-N 346.412 2.385 5 50 EEBA Cc1cc(O)nc(N2CCC[C@@H](Nc3cc(C)c([N+](=O)[O-])cn3)C2)n1 952994108 MCTJEYJBZHNZHR-GFCCVEGCSA-N 344.375 2.183 5 50 EEBA C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@H](O)c1ccc(F)cc1 170087768 YLLMLGZYCWOCGD-VFZGTOFNSA-N 331.307 2.311 5 50 EEBA N=C(O)c1c[nH]nc1[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 328604904 LSYDQGFPFFHEIC-MRVPVSSYSA-N 349.372 2.283 5 50 EEBA CCn1cc(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cn1 191725526 OYAMCFHJXXHKCL-UHFFFAOYSA-N 343.387 2.413 5 50 EEBA O=C(O)c1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 5513707 ZQDXHQLYUTYWAH-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA Cc1c(C(=O)NC(=S)NCc2cccnc2)cccc1[N+](=O)[O-] 457286 QXRPZPREIPHWKE-UHFFFAOYSA-N 330.369 2.103 5 50 EEBA CN1C(=O)[C@@](O)(CC(=O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 5013530 JYBAVVMAJUBJSJ-QGZVFWFLSA-N 344.298 2.171 5 50 EEBA Cc1nn(CC(=O)NCCc2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] 1068536 HVGYNZDYDGCUSI-UHFFFAOYSA-N 336.779 2.420 5 50 EEBA O=C(N[C@@H]1CCN2CCCC[C@@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 229868264 YVOQNENHXLNBCJ-OCCSQVGLSA-N 328.372 2.433 5 50 EEBA CC[C@](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])(C(N)=O)C(C)C 180293898 AHINBWPUVRALNV-CQSZACIVSA-N 327.768 2.268 5 50 EEBA CCCNc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(=O)CC1CC1 888099303 GHCIWXAXXLNVTK-UHFFFAOYSA-N 341.389 2.022 5 50 EEBA O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)c1n[nH]cc1[N+](=O)[O-] 192459811 YDUHWMUJJHTKOE-UHFFFAOYSA-N 340.299 2.498 5 50 EEBA CCOC(=O)C1CCN(Cc2cc(OC)c(O)c([N+](=O)[O-])c2)CC1 4977600 PBCWZMBGDANWQZ-UHFFFAOYSA-N 338.360 2.084 5 50 EEBA CCc1nc2c(s1)[C@H](N(C)C(=O)c1nn(C)cc1[N+](=O)[O-])CCC2 253425827 RDKMYDYXUFOYOZ-SNVBAGLBSA-N 349.416 2.497 5 50 EEBA Cc1c(C(=O)NCc2ccc(O)c([N+](=O)[O-])c2)sc2nccn12 2325863021 QRONZBGKDIZCGB-UHFFFAOYSA-N 332.341 2.248 5 50 EEBA CC[C@H](C)NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 464541 LMYMRJGJGLLZGF-LBPRGKRZSA-N 333.388 2.362 5 50 EEBA CN(c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1)S(C)(=O)=O 470598 JBKFUAQXAUKTKI-UHFFFAOYSA-N 349.368 2.243 5 50 EEBA COc1ccc(CN[C@@H]2COc3ccccc3[C@H]2O)cc1[N+](=O)[O-] 288540052 KURSSSPCADETKR-CXAGYDPISA-N 330.340 2.188 5 50 EEBA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc([N+](=O)[O-])o2)c1 2742938 KUBSOOMZGHURCV-UHFFFAOYSA-N 348.267 2.013 5 50 EEBA Cc1nc(C2CCN(c3nc4sccn4c3[N+](=O)[O-])CC2)no1 225526350 DCVQJLLOOITRFO-UHFFFAOYSA-N 334.361 2.379 5 50 EEBA Cc1cc(C(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)ccc1[N+](=O)[O-] 204501 LUYFPVWIBFIAJK-ZDUSSCGKSA-N 349.240 2.324 5 50 EEBA COc1cc(CN2CCN3CCC[C@H]3[C@@H]2C)c([N+](=O)[O-])cc1OC 34829447 UQLQHGQDTZRGQL-JSGCOSHPSA-N 335.404 2.281 5 50 EEBA O=[N+]([O-])c1cnn(CSc2nnc3c(n2)[nH]c2ccccc23)c1 334160288 ADHVBMWGKYRMQL-UHFFFAOYSA-N 327.329 2.361 5 50 EEBA COC(=O)c1ccccc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 434873 GXHVZDYZDLOKRI-UHFFFAOYSA-N 326.264 2.182 5 50 EEBA CCN1C(=O)S[C@H]([C@H](O)c2ccc(Cl)c([N+](=O)[O-])c2)C1=O 1395160 KWTOLMPVXVECLY-NXEZZACHSA-N 330.749 2.366 5 50 EEBA O=[N+]([O-])c1cccc(N2CCN(C[C@H](O)Cc3ccccc3)CC2)c1 193661364 XOKPMPUZJJMFSE-LJQANCHMSA-N 341.411 2.320 5 50 EEBA CC1(C)CC(NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC(C)(C)N1 318717 RHMZJJRRRNQICW-UHFFFAOYSA-N 341.433 2.182 5 50 EEBA O=C(NCCOc1ccc(Cl)cn1)c1ccc([N+](=O)[O-])c(O)c1 134309293 FSQOWXDXUSUKCI-UHFFFAOYSA-N 337.719 2.158 5 50 EEBA CCCn1c(=N)c(C(=O)OCC)cc2c(=O)n3cccc(C)c3nc21 100627764 UCGIHIJBLPQGTO-UHFFFAOYSA-N 340.383 2.024 5 50 EEBA CNC(=O)CN1CCC(Nc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 225543947 HSLGQVKABXRPSM-UHFFFAOYSA-N 340.811 2.179 5 50 EEBA COc1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c(OC)cc1Cl 4869965 JNJNUGZPBQHIGI-UHFFFAOYSA-N 340.723 2.101 5 50 EEBA CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 26735576 HKAYXRLMYDVZQM-UHFFFAOYSA-N 349.387 2.217 5 50 EEBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@](F)(c2cc(F)cc(F)c2)C1 328586931 ZGFBVMRSXVOWII-CQSZACIVSA-N 340.261 2.307 5 50 EEBA Cc1nn(Cc2nn3c(-c4cccs4)nnc3s2)cc1[N+](=O)[O-] 20606983 ZQAQKKDNGCRTDR-UHFFFAOYSA-N 347.385 2.376 5 50 EEBA COC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 456982 VOSWYDPRKRKCPI-UHFFFAOYSA-N 326.736 2.273 5 50 EEBA Cc1c(NC(=O)N(CCOCCO)C(C)C)cccc1[N+](=O)[O-] 282610343 HHLWMLRPECGQIZ-UHFFFAOYSA-N 325.365 2.154 5 50 EEBA O=C(c1ccccc1)c1ccc(N[C@]2(CO)CCOC2)c([N+](=O)[O-])c1 170594631 TVFQELLUCNBGGD-SFHVURJKSA-N 342.351 2.389 5 50 EEBA O=C(O)[C@H]1CC=C(Cl)C[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O 4873560 QDVIDIGAHUWGSY-UWVGGRQHSA-N 340.719 2.472 5 50 EEBA CN(C)CC[C@H]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1455637998 YOVOZHAYLWDQQQ-LBPRGKRZSA-N 330.388 2.490 5 50 EEBA CC(=O)N(C)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 456677 DPKCTEPBAWNZPK-UHFFFAOYSA-N 349.368 2.378 5 50 EEBA Cn1cc(C(=O)O[C@H]2CCCN(c3ccc(F)cc3[N+](=O)[O-])C2)cn1 170605084 WFGJIAFAMATDCR-ZDUSSCGKSA-N 348.334 2.293 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)OCCO2 1781063 UGRRAYUUDIICFA-UHFFFAOYSA-N 330.296 2.384 5 50 EEBA NC(=O)N1CC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 408516860 YBKIBPGXPMZQQJ-QMMMGPOBSA-N 332.282 2.426 5 50 EEBA O=[N+]([O-])c1ccc(N2CCOC[C@H]2C[C@H](O)c2ccccc2)nc1 153950006 SYBZUXYBSYSFPO-CVEARBPZSA-N 329.356 2.319 5 50 EEBA CCc1nsc(N2CCCN(c3ncc([N+](=O)[O-])s3)CC2)n1 192472770 IZWFSUFPIQKNCD-UHFFFAOYSA-N 340.434 2.182 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1 83896 QVCRZZHRIYFRIS-UHFFFAOYSA-N 336.325 2.167 5 50 EEBA Cc1ccc(-n2cnn(-c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2=O)cc1 5617982 RDRIUZJRBGTMLK-UHFFFAOYSA-N 341.283 2.148 5 50 EEBA O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC1(C(=O)O)CCCC1 238086531 YNJKPHREQPOJCT-UHFFFAOYSA-N 326.736 2.304 5 50 EEBA COc1ccc([N+](=O)[O-])cc1CNc1ncncc1Br 343557817 WOJISJDMSSHVOM-UHFFFAOYSA-N 339.149 2.768 5 50 EEBA Cc1cc(C(=O)N(CCS(C)(=O)=O)C(C)(C)C)ccc1[N+](=O)[O-] 185121108 BVILFKNNFQLIOQ-UHFFFAOYSA-N 342.417 2.189 5 50 EEBA CN1C(=O)[C@](O)(CC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 73308 XCRDLYFXFXYOEY-KRWDZBQOSA-N 326.308 2.032 5 50 EEBA O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1NCc1ccccn1 4757731 AIDLCHFBZBDMJV-UHFFFAOYSA-N 346.734 2.074 5 50 EEBA CCC[C@H](NC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1)c1nnn[nH]1 183068852 JENZPLFEVRAYHY-LXKVQUBZSA-N 330.348 2.169 5 50 EEBA Cc1nn([C@@H](C)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1[N+](=O)[O-] 2778357 DPXIMDOMLKOQTC-NSHDSACASA-N 337.424 2.086 5 50 EEBA CCCN(Cc1csc([N+](=O)[O-])c1)[C@@H](COC)C(=O)OCC 170611904 IAZRSTRXYHGIPR-LBPRGKRZSA-N 330.406 2.446 5 50 EEBA Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)ccc1[N+](=O)[O-] 316968 OGLDHXJIOZYGII-UHFFFAOYSA-N 326.356 2.261 5 50 EEBA O=c1cccc2n1C[C@H]1C[C@H]2CN(Cc2ccc([N+](=O)[O-])cc2)C1 100504264 GQXGWBNRGPDMNO-GJZGRUSLSA-N 325.368 2.376 5 50 EEBA Cc1ccc([N+](=O)[O-])c(OCCOCCN2C[C@H](C)O[C@@H](C)C2)c1 20653592 VUMZMWOKZQZPFX-GJZGRUSLSA-N 338.404 2.408 5 50 EEBA O=C1NCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 131917865 KGQXVZLWTZTYIQ-HNNXBMFYSA-N 340.339 2.300 5 50 EEBA CCOC(=O)C1(O)CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 253415552 VQDREOVLKPNYFJ-UHFFFAOYSA-N 328.752 2.143 5 50 EEBA Cc1c(C(=O)O)cccc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 434483 PFHZXTCMANWJET-UHFFFAOYSA-N 326.264 2.402 5 50 EEBA O=C(O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 1561694 FJQZNYGOAAJBIS-UHFFFAOYSA-N 331.240 2.454 5 50 EEBA Cc1nc(C)n(C[C@@H]2CCCN(c3ccc(N)cc3[N+](=O)[O-])C2)n1 225819932 FASMRCLKQHFFNR-CYBMUJFWSA-N 330.392 2.302 5 50 EEBA CCn1nnc(NC(=O)c2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 557374 NGBZPNQHEYFRAX-UHFFFAOYSA-N 328.288 2.114 5 50 EEBA COC(=O)/C=C\c1ccc(N[C@H](C)[C@H](C)n2cncn2)c([N+](=O)[O-])c1 252475317 YFLGBUPBPJHPIU-OXTPZFROSA-N 345.359 2.434 5 50 EEBA Cc1cc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(C)C=C[C@H]3O2)c([N+](=O)[O-])cc1C 243892530 AIHLFYMHGAYKML-VMUDFCTBSA-N 328.324 2.045 5 50 EEBA COc1ccccc1CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 408513833 VBEGEWPYCJMRIR-UHFFFAOYSA-N 327.340 2.126 5 50 EEBA C[C@@H](C[N+]1(C)CCOCC1)OC[C@@H]1CCC[N@+]2(C)CCCC[C@H]12 252441436 VNZYHBOMJJKSJY-HUUJSLGLSA-N 326.525 2.277 5 50 EEBA biogenic COc1ccc(CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 168397 QCOVAPJIFGOZQP-UHFFFAOYSA-N 336.369 2.124 5 50 EEBA CN(c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1)S(C)(=O)=O 617081 LIEVERYAPZTHDG-UHFFFAOYSA-N 349.368 2.243 5 50 EEBA CC(=O)c1ccc(N2CCC(N3CCCOCC3)CC2)c([N+](=O)[O-])c1 408523454 KFCUTTNHTYATIY-UHFFFAOYSA-N 347.415 2.489 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)NCc1cc(C)n(C)n1 5041502 YQGINPTVDYIKFG-UHFFFAOYSA-N 335.389 2.132 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 3884914 VTEHYMBPYYIEDL-UHFFFAOYSA-N 336.325 2.402 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2nc(C)cs2)CC1 192489217 KDJVFHBWURNUHO-UHFFFAOYSA-N 336.421 2.211 5 50 EEBA Cc1ccccc1OCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 4573275 YPKYNPJXZOEZNR-UHFFFAOYSA-N 336.369 2.261 5 50 EEBA C[C@H]1C[C@@H](C(=O)O)CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 263367558 UGZIHEKQRGFYGX-WCBMZHEXSA-N 326.736 2.431 5 50 EEBA O=C(NC(=S)NCCc1ccccc1)c1cccc([N+](=O)[O-])c1 302115 YIVXWCGOGXHJMU-UHFFFAOYSA-N 329.381 2.442 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@]1(O)CCc2ccccc21 159432425 XTYHPKLGOWYWFY-IBGZPJMESA-N 340.379 2.478 5 50 EEBA Cc1nn(CCC(=O)O[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c(C)c1[N+](=O)[O-] 241897336 TXSVTWFRSNCQLF-NILFDRSVSA-N 337.376 2.155 5 50 EEBA CCOC(=O)[C@H]1CCCN(Cc2cc(OC)c(O)c([N+](=O)[O-])c2)C1 5326319 AZOOUCHJTXIGDU-LBPRGKRZSA-N 338.360 2.084 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1 19498386 SUQLDIGMLLWLIT-IRXDYDNUSA-N 328.372 2.338 5 50 EEBA CC(=O)Nc1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 3129821 PTJUJQQBOQNQFN-UHFFFAOYSA-N 336.325 2.321 5 50 EEBA O=C(O)C[C@H](c1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 4342875 DTKRLTRFQBPDBG-CQSZACIVSA-N 340.291 2.407 5 50 EEBA COc1ccccc1N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1=O 268239949 NDAGEQGWIZSMQV-GFCCVEGCSA-N 328.328 2.216 5 50 EEBA COc1ccccc1OCCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 2873359 SNBOMJVTULPWLE-UHFFFAOYSA-N 346.339 2.421 5 50 EEBA Cc1cc([N+](=O)[O-])cnc1NCCc1nc[nH]c1Br 1775985364 CEUQCGQBICXFJE-UHFFFAOYSA-N 326.154 2.438 5 50 EEBA COc1ccc(C(=O)NC(=S)Nc2cccnc2)cc1[N+](=O)[O-] 328638 FGOJHMDFUSTTDJ-UHFFFAOYSA-N 332.341 2.125 5 50 EEBA COc1ccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 7214324 CIWVLAKRFMWUJK-UHFFFAOYSA-N 336.369 2.424 5 50 EEBA O=C1c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[S@@](=O)N1Cc1ccccc1 245236172 QLSAUETWQATGKK-XMMPIXPASA-N 347.308 2.182 5 50 EEBA C[C@@H]1C[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@@H](C)O1 412655521 OPNOSAYRQNNJNM-YRGRVCCFSA-N 344.371 2.324 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(=O)O 3884773 HTZHIPSYUAFAFE-UHFFFAOYSA-N 336.325 2.402 5 50 EEBA O=[N+]([O-])c1ccc(-c2ncn(CN3CCO[C@@H]4CCCC[C@H]43)n2)cc1 230118809 FLCJJXOAGAQLIH-HZPDHXFCSA-N 343.387 2.454 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(Cn2ccnn2)CC1 163147245 TWADPTODBASMRL-UHFFFAOYSA-N 344.375 2.439 5 50 EEBA Cc1cc(O)nc(N2CCC[C@@H](Nc3nccc(C)c3[N+](=O)[O-])C2)n1 1333203768 NQLZXHBXWGIYDK-GFCCVEGCSA-N 344.375 2.183 5 50 EEBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N1CCCC[C@@H]1C 181499 KVOMVUPZOQDTLD-QMMMGPOBSA-N 345.197 2.263 5 50 EEBA O=C(Oc1ccccc1N1C(=O)CCC1=O)c1ccc([N+](=O)[O-])cc1 306506 YAMMVMOTCAFVLT-UHFFFAOYSA-N 340.291 2.467 5 50 EEBA COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 458094 AVOVJSBLLBKBRO-LLVKDONJSA-N 325.708 2.049 5 50 EEBA COc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2)cc1[N+](=O)[O-] 2868594 BUVVCVXTDKNPNK-UHFFFAOYSA-N 346.295 2.319 5 50 EEBA O=[N+]([O-])c1cnc(N2CCN(Cc3cncs3)CC2)c(Cl)c1 863948723 KSDFPFCKNDZNFR-UHFFFAOYSA-N 339.808 2.422 5 50 EEBA O=C(NC[C@H]1COC2(CCCCC2)O1)c1ccc([N+](=O)[O-])c(O)c1 271839321 QJTBTFZFVRFTGA-LBPRGKRZSA-N 336.344 2.106 5 50 EEBA Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCNC(=O)[C@@H]1CC(C)C 408521648 BVPDAGHYIQFGPY-AWEZNQCLSA-N 337.351 2.029 5 50 EEBA Cc1cccc(C)c1OC[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 194149850 XYXCOZPCRZWQGD-LBPRGKRZSA-N 346.387 2.451 5 50 EEBA O=C(O)C[C@@H](NC(=O)COc1ccccc1)c1cccc([N+](=O)[O-])c1 3627024 JGHQYBLASGWIQP-OAHLLOKOSA-N 344.323 2.306 5 50 EEBA NC(=O)c1cc([N+](=O)[O-])cnc1NCc1nc2ccccc2s1 253425740 MNWYGAWQMZPTKH-UHFFFAOYSA-N 329.341 2.311 5 50 EEBA COc1ccc2c(c1)OC[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C2 362407887 OIYJYDBHFFEAMA-LBPRGKRZSA-N 346.314 2.476 5 50 EEBA CC(=O)N1c2ccccc2C[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c(C)n1 133802649 XBROUMZCBZLCAM-HNNXBMFYSA-N 340.339 2.215 5 50 EEBA Cc1n[nH]c(SCC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 177869916 WGVMEKNFSONYLE-SECBINFHSA-N 335.389 2.299 5 50 EEBA CC(C)OC[C@@H]1C[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1 4132649 YMYGJWMPPJSIFG-RISCZKNCSA-N 336.344 2.280 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(OC(F)(F)F)cc1 215031 CRJZDPQVALNDFC-UHFFFAOYSA-N 330.222 2.329 5 50 EEBA O=C(NC1CCCCC1)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 291462 PLPCOXIDAVHBMM-LBPRGKRZSA-N 331.372 2.397 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 248130584 JNHXLWWYDPFNKR-LBLXLQPISA-N 332.312 2.065 5 50 EEBA COc1ccc(CNc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)cc1 225815612 NEZFEPAGMNIHFE-UHFFFAOYSA-N 342.355 2.406 5 50 EEBA O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H]1COc2ccccc2O1 354114578 JGLRMZLVGIFUEB-HNNXBMFYSA-N 342.351 2.484 5 50 EEBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](CO)c2ccccc21 292503126 GCMLTLKZCIIZGB-GFCCVEGCSA-N 348.380 2.188 5 50 EEBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@@H](C)[C@@H]1CCCO1 5041741 FYXQGRHDFNMIGI-CABZTGNLSA-N 325.390 2.457 5 50 EEBA CCOC(=O)[C@H]1CCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 274377146 FOQNQYQLNCKRRC-LLVKDONJSA-N 338.385 2.484 5 50 EEBA Cc1ccc([N+](=O)[O-])c(NCc2cccnc2N2CCN(C)CC2)n1 122575680 MFUJCTNMSYHUFX-UHFFFAOYSA-N 342.403 2.057 5 50 EEBA COC(=O)c1nnn(-c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C 54283 GWUFYLKNFGEXHJ-UHFFFAOYSA-N 330.222 2.289 5 50 EEBA O=[N+]([O-])c1cnc(NCC2(CN3CCOCC3)CCCCC2)nc1 273949783 MSHSKBXTHXBTPC-UHFFFAOYSA-N 335.408 2.079 5 50 EEBA O=C(CSC(=S)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 439293 SKNCXZLBDVZUIM-UHFFFAOYSA-N 326.399 2.128 5 50 EEBA CNS(=O)(=O)c1c(N2CCc3ccccc3C2)cccc1[N+](=O)[O-] 328593874 UAWUZVXISJNRDT-UHFFFAOYSA-N 347.396 2.066 5 50 EEBA Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN(c2cccnn2)C1 194721081 LFVBLYYUBVJXKC-CYBMUJFWSA-N 341.371 2.092 5 50 EEBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](c2ccccn2)C1 798476428 GIIOGUFPRMDSFL-ZDUSSCGKSA-N 347.396 2.476 5 50 EEBA O=C(c1ccccc1)c1ccc(N2CCOC[C@H]2CO)c([N+](=O)[O-])c1 895935421 IDHAFPINLBTLFO-OAHLLOKOSA-N 342.351 2.023 5 50 EEBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)NC1CCCCC1 196057 YUTJCKWTVMQUJX-UHFFFAOYSA-N 345.197 2.311 5 50 EEBA CCOC(=O)Cc1csc(NC(=O)Cc2ccccc2[N+](=O)[O-])n1 457007 SGHMQVRRYDAYRX-UHFFFAOYSA-N 349.368 2.338 5 50 EEBA Cc1nc(N2CCN(C[C@H](O)c3ccccc3)CC2)ccc1[N+](=O)[O-] 150767153 NVPUKCQJZMQZMC-KRWDZBQOSA-N 342.399 2.154 5 50 EEBA CC(=O)[C@@H]1[C@@H](c2cccc([N+](=O)[O-])c2)c2c(n[nH]c2C)C[C@]1(C)O 239432856 WQMILBNFFUVBET-BBWFWOEESA-N 329.356 2.271 5 50 EEBA CC(C)[C@@](C)(NCc1ccc(Br)cc1[N+](=O)[O-])C(N)=O 312808688 RQEPQUZYCOAJES-CYBMUJFWSA-N 344.209 2.347 5 50 EEBA O=C(COc1ccccc1)NC(=S)Nc1cccc([N+](=O)[O-])c1 358863 FFJXNBUWSZVOJO-UHFFFAOYSA-N 331.353 2.487 5 50 EEBA O=[N+]([O-])c1ccc(S(=O)(=O)c2cc(C(F)(F)F)ncn2)cc1 261494864 NOERLJQCWNTPNF-UHFFFAOYSA-N 333.247 2.236 5 50 EEBA O=C(O)C[C@@H](c1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 4342873 DTKRLTRFQBPDBG-AWEZNQCLSA-N 340.291 2.407 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@H]2[C@H]1c1ccc([N+](=O)[O-])cc1 19498389 SUQLDIGMLLWLIT-IAGOWNOFSA-N 328.372 2.338 5 50 EEBA CC1(C)C[C@@]2(CCO1)OC(=O)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1 4872636 VUCQBYFAJRXTHE-SUMWQHHRSA-N 348.355 2.424 5 50 EEBA COc1cc(CN2CCN3CCC[C@H]3[C@H]2C)c([N+](=O)[O-])cc1OC 34829446 UQLQHGQDTZRGQL-OCCSQVGLSA-N 335.404 2.281 5 50 EEBA O=C(Nc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCNCC1 4983411 GWUDMNSRUMMKMT-UHFFFAOYSA-N 326.356 2.257 5 50 EEBA CN1CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N)cc21 188221396 HQWLWEPFNSKUOT-UHFFFAOYSA-N 328.328 2.258 5 50 EEBA COC(=O)c1cc(C(=O)NCc2ccccc2OC)cc([N+](=O)[O-])c1 60821 DBMYZTFBSHXGJB-UHFFFAOYSA-N 344.323 2.320 5 50 EEBA COc1ccc(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-])c1 239309177 HFYNOSFWMNJZHB-YRWVIOBZSA-N 340.335 2.161 5 50 EEBA COCCn1ccnc1[C@H]1N(c2ncc([N+](=O)[O-])c(C)n2)CC1(C)C 952895234 SJKUPSMXZFTEGT-CYBMUJFWSA-N 346.391 2.124 5 50 EEBA COc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 4985687 BNPDTKMTDKBUKD-UHFFFAOYSA-N 336.369 2.390 5 50 EEBA O=C1[C@@H]2CC=C(Cl)C[C@H]2C(=O)N1CNc1cccc([N+](=O)[O-])c1 100590820 JQXAVCCXLFHOSU-CHWSQXEVSA-N 335.747 2.482 5 50 EEBA O=C(NCc1ccccc1[N+](=O)[O-])N1CCC(Cn2cccn2)CC1 172350785 SROOTUJEYMULAF-UHFFFAOYSA-N 343.387 2.413 5 50 EEBA O=C1[C@H]2CC(Cl)=CC[C@H]2C(=O)N1CNc1cccc([N+](=O)[O-])c1 100590811 JQXAVCCXLFHOSU-OLZOCXBDSA-N 335.747 2.482 5 50 EEBA COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ccccc1[N+](=O)[O-] 85205448 HYIMSNHJOBLJNT-UHFFFAOYSA-N 346.339 2.176 5 50 EEBA biogenic,fda Cc1cc(C)c(NC(=O)CSc2nc(C)cc(=O)[nH]2)c([N+](=O)[O-])c1 16393494 MHYMBEJTDJRNFW-UHFFFAOYSA-N 348.384 2.334 5 50 EEBA O=[N+]([O-])c1ccc([C@]2(O)C[C@@H](C(Cl)(Cl)Cl)NO2)cc1 500037 UFXRKGGEIQEOMD-IUCAKERBSA-N 327.551 2.404 5 50 EEBA CCOC(=O)c1coc(NC(=O)CCNc2ccccc2[N+](=O)[O-])n1 253431671 SSSCKAPCGYAFCA-UHFFFAOYSA-N 348.315 2.200 5 50 EEBA CNS(=O)(=O)c1c(NCC2CCSCC2)cccc1[N+](=O)[O-] 408523561 LDPGEOQITZXIKV-UHFFFAOYSA-N 345.446 2.058 5 50 EEBA Cc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3ccccc32)cc1[N+](=O)[O-] 85347 FDGRTGMXKWYHQA-KRWDZBQOSA-N 326.308 2.316 5 50 EEBA CN(C(=O)[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 253430330 KPKTXFSUKPMGML-ZDUSSCGKSA-N 326.356 2.479 5 50 EEBA C[C@H]1CCCN(c2ccc(C(=O)O[C@H]3CCOC3=O)cc2[N+](=O)[O-])C1 241776817 RSWVMSGMOJGKAJ-NHYWBVRUSA-N 348.355 2.303 5 50 EEBA CCOc1ccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 1066311 PHOPPXFOFZAFSZ-UHFFFAOYSA-N 343.339 2.362 5 50 EEBA COc1ccc(OC)c(NC(=O)CCCn2cc([N+](=O)[O-])cn2)c1 4686636 QJIXROFZXHMTAW-UHFFFAOYSA-N 334.332 2.227 5 50 EEBA CCO[C@@H]1C[C@@H](NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)[C@H]1OC 273938170 CWLAHBJLKLZCBP-XJKCOSOUSA-N 336.388 2.442 5 50 EEBA COC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1Br 4592859 WFKIKAVVXXMEMG-UHFFFAOYSA-N 331.122 2.249 5 50 EEBA COC(=O)c1cc(NS(=O)(=O)c2ccccc2)cc([N+](=O)[O-])c1 408513023 SEWKPDXLROEDDA-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA COC(=O)c1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 47701 SQXMDFFAYDVTMG-UHFFFAOYSA-N 336.325 2.182 5 50 EEBA Cc1ccc2c(c1)[C@@](O)(CC(=O)c1ccccc1[N+](=O)[O-])C(=O)N2 528462 ZYHQZWQRFZASJE-KRWDZBQOSA-N 326.308 2.316 5 50 EEBA CCc1nc2c(s1)[C@@H](N(C)C(=O)c1nn(C)cc1[N+](=O)[O-])CCC2 253425820 RDKMYDYXUFOYOZ-JTQLQIEISA-N 349.416 2.497 5 50 EEBA Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCO[C@@H]1c1ccccc1 188229813 PRCLDKAVDZVPJW-HZPDHXFCSA-N 327.340 2.437 5 50 EEBA C[C@H](c1nn2c(-c3ccco3)nnc2s1)n1cc([N+](=O)[O-])cn1 20606311 IAVPKUBTFHDSPT-SSDOTTSWSA-N 331.317 2.160 5 50 EEBA CCNc1cc(OC)c(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 5312169 REQZWQFXIKQZOB-UHFFFAOYSA-N 328.268 2.329 5 50 EEBA O=C(O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cc(C(=O)O)c1 192968 COAGJUQVQMRPPY-UHFFFAOYSA-N 330.252 2.244 5 50 EEBA C[C@@H](c1nn2c(-c3ccco3)nnc2s1)n1cc([N+](=O)[O-])cn1 20606310 IAVPKUBTFHDSPT-ZETCQYMHSA-N 331.317 2.160 5 50 EEBA CN(CCOCc1ccccc1)c1c(C(N)=O)cccc1[N+](=O)[O-] 2325874407 LNPVGSJUUQBKJX-UHFFFAOYSA-N 329.356 2.347 5 50 EEBA Cc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)cc1[N+](=O)[O-] 230318434 MAVQGQJZTWZOMB-BQGCOEIASA-N 328.324 2.126 5 50 EEBA O=C(c1cc([N+](=O)[O-])ccc1NCc1cccnc1)N1CCOCC1 4998446 PYHJFNSKKBPARD-UHFFFAOYSA-N 342.355 2.074 5 50 EEBA O=C(C1CC1)[C@H]1CN(c2ccc([N+](=O)[O-])c3cnccc23)CCO1 170598743 KTNRVDUOHOMCMV-MRXNPFEDSA-N 327.340 2.327 5 50 EEBA O=c1ccc([N+](=O)[O-])cn1CCN[C@@H]1CCCC[C@@H]1C(F)(F)F 124628847 BMXLNAVPZZHFFF-NWDGAFQWSA-N 333.310 2.467 5 50 EEBA Cc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1[N+](=O)[O-] 4573140 YEFHWFHPKNXGHY-UHFFFAOYSA-N 336.369 2.261 5 50 EEBA N=C1NC(=O)/C(=C\c2cc([N+](=O)[O-])cc(Br)c2O)S1 4953700 VQHDGDIZGFPOHZ-FARCUNLSSA-N 344.146 2.202 5 50 EEBA CNC(=O)c1ccc(N2C[C@@H](O)C[C@H]2C2CCCCC2)c([N+](=O)[O-])c1 247932741 GFOVAEYDNONLFQ-HOCLYGCPSA-N 347.415 2.474 5 50 EEBA C[C@H](C[N+]1(C)CCOCC1)OC[C@@H]1CCC[N@@+]2(C)CCCC[C@H]12 247664466 VNZYHBOMJJKSJY-RCLSDMTESA-N 326.525 2.277 5 50 EEBA biogenic CN(Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1S(C)(=O)=O 245444052 XSPOKHFBLGGCSL-LSDHHAIUSA-N 326.418 2.382 5 50 EEBA Cn1cccc1[C@H]1COCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 131613917 SKCVWCDOOAYPHF-SJORKVTESA-N 331.372 2.040 5 50 EEBA O=C(Oc1ccccc1N1C(=O)CCC1=O)c1cccc([N+](=O)[O-])c1 306505 STRMKYVBJHNHPH-UHFFFAOYSA-N 340.291 2.467 5 50 EEBA Cc1nonc1OCCNc1cc(N2CCCC2)ccc1[N+](=O)[O-] 4151238 JOLVOANIHFVPAW-UHFFFAOYSA-N 333.348 2.377 5 50 EEBA COc1ccccc1N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1=O 268239950 NDAGEQGWIZSMQV-LBPRGKRZSA-N 328.328 2.216 5 50 EEBA Cc1ccc2c(c1C)OC[C@@H]2NS(=O)(=O)c1cccnc1[N+](=O)[O-] 170642426 HYOZCPBUVSYMSZ-LBPRGKRZSA-N 349.368 2.019 5 50 EEBA CCn1ncc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1C(=O)N(C)C 2805358 CUIXJDIXXDJEJZ-UHFFFAOYSA-N 345.359 2.074 5 50 EEBA Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@@](C)(O4)[C@@H]3C2=O)c([N+](=O)[O-])cc1C 222240841 AIHLFYMHGAYKML-XJIUQZFPSA-N 328.324 2.045 5 50 EEBA O=C(Nc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2780038 DFRTUMLTBXPLQI-UHFFFAOYSA-N 331.240 2.484 5 50 EEBA CO[C@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 230237341 XTIGDKASHUQGLK-JTQLQIEISA-N 334.781 2.048 5 50 EEBA O=C(NCc1cccs1)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 2767037 ZNEQGVXLHQQQPP-UHFFFAOYSA-N 332.341 2.424 5 50 EEBA O=C(NCC1CCOCC1)[C@H]1CCCN1c1ccccc1[N+](=O)[O-] 239667825 BRNUDVTVCSJYSI-MRXNPFEDSA-N 333.388 2.106 5 50 EEBA Cc1cc(N2C(=O)[C@H]3[C@@H](C2=O)[C@H]2C=C[C@@]3(C)O2)c([N+](=O)[O-])cc1C 243892529 AIHLFYMHGAYKML-UMPJEAMMSA-N 328.324 2.045 5 50 EEBA CCC(=O)N1N=C2C3CCN(CC3)[C@@H]2[C@H]1c1ccc([N+](=O)[O-])cc1 19498388 SUQLDIGMLLWLIT-SJORKVTESA-N 328.372 2.338 5 50 EEBA CNC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccc([N+](=O)[O-])cc1 5353364 YUBHBCIASUVZCF-XNTDXEJSSA-N 343.314 2.251 5 50 EEBA CCOCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-] 17072351 DFIXNPMJDGXDQG-CYBMUJFWSA-N 348.355 2.052 5 50 EEBA CCCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1 298976100 INNHLGLYOSRAJD-OAHLLOKOSA-N 333.388 2.392 5 50 EEBA C[C@@H](CN(C)c1ncc([N+](=O)[O-])cc1-c1ccccc1)c1nn[nH]n1 1875349026 KJPCNIDPDOKHCZ-NSHDSACASA-N 339.359 2.410 5 50 EEBA Cn1c(=O)c([N+](=O)[O-])c(N2CCN3CCCC[C@@H]3C2)c2ccccc21 685940434 LMYXPWOAMJGXJR-CYBMUJFWSA-N 342.399 2.121 5 50 EEBA CC(=O)Nc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 3876741 FJBXHRHYSUMPBX-UHFFFAOYSA-N 335.341 2.354 5 50 EEBA O=C(c1ccccc1)N1CCCN(c2ncc([N+](=O)[O-])s2)CC1 195507732 WFUYFKJPCCQFHB-UHFFFAOYSA-N 332.385 2.404 5 50 EEBA Cc1cc(N[C@@H](Cc2ccccc2)C(=O)N(C)C)ncc1[N+](=O)[O-] 270257602 TYULWAZXCACUQN-AWEZNQCLSA-N 328.372 2.410 5 50 EEBA C[C@@H](NC(=O)Cn1ncc([N+](=O)[O-])c1N)c1ccc2c(c1)CCCC2 193673545 JNIDBHLSJJSLQK-LLVKDONJSA-N 343.387 2.130 5 50 EEBA C[C@@H](Cc1ccccc1)NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4417006 JPCSCMDJYJDNET-NSHDSACASA-N 345.380 2.265 5 50 EEBA C[C@H](NC(=O)Cn1ncc([N+](=O)[O-])c1N)c1ccc2c(c1)CCCC2 193673520 JNIDBHLSJJSLQK-NSHDSACASA-N 343.387 2.130 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](c1ccc(Cl)nc1)C1CC1 408516670 NKDWNPRRDDXNEB-AWEZNQCLSA-N 335.751 2.107 5 50 EEBA CO[C@H](C)[C@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 863948407 PHIOCUXEAGIDQH-DTWKUNHWSA-N 345.193 2.439 5 50 EEBA CC(=O)[C@@H]1[C@H](c2cccc([N+](=O)[O-])c2)[C@H]2C(C)=NN=C2C[C@@]1(C)O 239432787 WLADKGWPKZATAW-YLFCFFPRSA-N 329.356 2.485 5 50 EEBA CC(=O)c1ccc(N2CCC(CO)(NCC(C)C)CC2)c([N+](=O)[O-])c1 408522917 NIEFSRDTCDCCTL-UHFFFAOYSA-N 349.431 2.374 5 50 EEBA Cn1ncc([N+](=O)[O-])c1NC(=O)c1cccc(Br)c1F 190694917 VHACDFQNKMCWTI-UHFFFAOYSA-N 343.112 2.482 5 50 EEBA COC(=O)c1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 303165 JAOSJQPUZJGTKL-UHFFFAOYSA-N 330.296 2.399 5 50 EEBA C[C@@H]1C[C@H](c2ccccc2)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 229927698 BAPHQTBYPSUEKM-UKPHBRMFSA-N 330.388 2.030 5 50 EEBA COc1cc(CN2CCN3CCC[C@@H]3[C@H]2C)c([N+](=O)[O-])cc1OC 34829448 UQLQHGQDTZRGQL-TZMCWYRMSA-N 335.404 2.281 5 50 EEBA CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 5049687 HGYKRTJJOHMMIV-UHFFFAOYSA-N 349.368 2.097 5 50 EEBA CCN1CC[C@@H](N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1 222332876 MCKKHZISIGPUOQ-CMPLNLGQSA-N 347.462 2.007 5 50 EEBA Cc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)C(N)=O)cc1 4917989 GDUSVFJHCVKUPL-GDNBJRDFSA-N 325.324 2.159 5 50 EEBA CCN1C(=O)S[C@@H]([C@@H](O)c2ccc(Cl)c([N+](=O)[O-])c2)C1=O 1395163 KWTOLMPVXVECLY-UWVGGRQHSA-N 330.749 2.366 5 50 EEBA COc1ccc(Br)cc1[C@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 88913 GYNLENYWMBGSAY-BXKDBHETSA-N 329.150 2.054 5 50 EEBA C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O 3958871 VPNXUQDYTJJWRN-SNVBAGLBSA-N 339.307 2.218 5 50 EEBA COc1ccccc1N1CCC[C@H](n2cc(C)c([N+](=O)[O-])n2)C1=O 328589461 HSZIWVBTRHPEHY-ZDUSSCGKSA-N 330.344 2.476 5 50 EEBA Cc1c(NC(=O)CS(=O)(=O)Cc2ccccc2)cccc1[N+](=O)[O-] 2734617 OYMQXOCEJKQABM-UHFFFAOYSA-N 348.380 2.457 5 50 EEBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC(c2ccccn2)C1 952882057 IJOOSAFRIBZOCO-UHFFFAOYSA-N 333.369 2.086 5 50 EEBA CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 147809 QXKAZVBKEYQWPQ-AWEZNQCLSA-N 343.343 2.427 5 50 EEBA Cc1c(N2C(=O)c3ccc(C(=O)O)cc3C2=O)cccc1[N+](=O)[O-] 434729 VIYCTRGYQLSIFZ-UHFFFAOYSA-N 326.264 2.402 5 50 EEBA O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(Cc2ccccc2)CC1 4810103 QSNNNGBSYATLOP-UHFFFAOYSA-N 328.372 2.273 5 50 EEBA COc1ccc(OC)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 180242 CULAOYRJHZVXNW-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA COC(=O)c1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)s1 253426593 UDRQHTSJNXXQSP-UHFFFAOYSA-N 342.354 2.244 5 50 EEBA COc1cc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N)ccc1F 170605197 HOTRLNPTQAZJQK-UHFFFAOYSA-N 333.319 2.297 5 50 EEBA C[C@@H]1COC2(CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])CC2)O1 169991441 KGSSLTSDCRFQQV-CYBMUJFWSA-N 349.387 2.151 5 50 EEBA C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@@H](O)c1ccc(F)cc1 170087773 YLLMLGZYCWOCGD-BJOHPYRUSA-N 331.307 2.311 5 50 EEBA CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN2CCCC[C@@H]12 229726576 MLAUVZFDFBSZRY-HOCLYGCPSA-N 332.404 2.017 5 50 EEBA C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)N1CCc2ncc([N+](=O)[O-])cc2C1 408149617 RFORAPMMUOHZAO-MCIONIFRSA-N 346.431 2.241 5 50 EEBA Cn1ccnc1Sc1ccc(NC(=O)c2n[nH]cc2[N+](=O)[O-])cc1 135887463 OPQQOVAHYWYKFU-UHFFFAOYSA-N 344.356 2.455 5 50 EEBA CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])[C@@H]1c1nccn1CC1CC1 952890820 JOYNLQNACWDJGF-GFCCVEGCSA-N 344.375 2.148 5 50 EEBA CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 147803 OTFVSHQMLRFUHZ-CQSZACIVSA-N 343.343 2.427 5 50 EEBA COc1ccccc1Nc1c([N+](=O)[O-])nn(-c2cccc(C)c2)[n+]1[O-] 4758055 LTAHDVNUTRPHEL-UHFFFAOYSA-N 341.327 2.475 5 50 EEBA Cc1cc(C(=O)N2N=C(C(F)F)C[C@@]2(O)C(F)F)ccc1[N+](=O)[O-] 204503 LUYFPVWIBFIAJK-CYBMUJFWSA-N 349.240 2.324 5 50 EEBA O=C(c1cccs1)N1CCCN(c2ncc([N+](=O)[O-])s2)CC1 192453868 BIPWMIMSRGDKRC-UHFFFAOYSA-N 338.414 2.465 5 50 EEBA CC(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1[N+](=O)[O-] 4531959 IAAYPLQCMKJKSM-UHFFFAOYSA-N 325.280 2.354 5 50 EEBA CC(=O)Oc1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 285186 RKYSHAZTXFHORW-UHFFFAOYSA-N 326.264 2.321 5 50 EEBA COc1ccc(C(=O)N[C@@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] 282803920 NABRHZMXGKONJK-GFCCVEGCSA-N 330.344 2.144 5 50 EEBA O=C1CN(C(=O)COc2cccc([N+](=O)[O-])c2)c2cccc(F)c2N1 253427352 YVOASLOAOJSHHS-UHFFFAOYSA-N 345.286 2.098 5 50 EEBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ccccc2)CC1 117117 YIAHGQMHZBTFMO-UHFFFAOYSA-N 325.368 2.486 5 50 EEBA COc1cccc(N2CCCN(c3ccc(C)nn3)CC2)c1[N+](=O)[O-] 253433291 VGKFWWQYHCLTMC-UHFFFAOYSA-N 343.387 2.419 5 50 EEBA COc1cc(N2CCC[C@@H]([C@H](O)c3nccn3C)C2)ccc1[N+](=O)[O-] 269351738 JUSSEXCNZBTNGB-WBMJQRKESA-N 346.387 2.287 5 50 EEBA Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)c2ccccc2C1=O 102072 GTINEZXDWPIRJS-UHFFFAOYSA-N 339.307 2.138 5 50 EEBA COC(=O)CCN(C(=O)c1cccc([N+](=O)[O-])c1)c1ccccn1 37868909 YNBGDUSOSUQWJN-UHFFFAOYSA-N 329.312 2.200 5 50 EEBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O 195380136 OJSWZGUESFPIQQ-XOSVDHCLSA-N 340.335 2.161 5 50 EEBA O=C1c2ccccc2C(=O)N1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3124464 FQMFEIJLRJXTSK-UHFFFAOYSA-N 329.224 2.093 5 50 EEBA in-vitro CC(C)N1C[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1=O 100751 KTLIPIZCWIOJPZ-VIFPVBQESA-N 325.752 2.444 5 50 EEBA O=C1O[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3c1nc(-c2ccc([N+](=O)[O-])cc2)no1 197193219 NNQNAIAOFWBWKX-XTAFZBPGSA-N 327.296 2.310 5 50 EEBA Cc1nnc2sc(-c3ccc(Cn4cc([N+](=O)[O-])cn4)cc3)nn12 20606295 DGYIZACUQKMDCA-UHFFFAOYSA-N 341.356 2.314 5 50 EEBA Cc1nc(N2CCC[C@@H](CN=S(C)(C)=O)C2)ccc1[N+](=O)[O-] 952992514 GZJJVGIOTMQULJ-LBPRGKRZSA-N 326.422 2.242 5 50 EEBA O=C(O)c1cccc(Nc2c([N+](=O)[O-])cc([N+](=O)[O-])c3nonc23)c1 16309583 FPSTWHPSUDQVKB-UHFFFAOYSA-N 345.227 2.481 5 50 EEBA CCc1nnc(NC(=O)CSc2ccc([N+](=O)[O-])cn2)s1 2882787 YXONDONQHDLPHE-UHFFFAOYSA-N 325.375 2.135 5 50 EEBA CC[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1C)c1ncc(C)[nH]1 952883564 NONATSVTDJQSFQ-NSHDSACASA-N 338.389 2.364 5 50 EEBA Cc1nc(N2CCOCC2)nc(Nc2cccc(F)c2)c1[N+](=O)[O-] 4143183 WBKDJFKJTYKGRO-UHFFFAOYSA-N 333.323 2.413 5 50 EEBA O=[N+]([O-])c1ccc(N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)nc1 153950123 SYBZUXYBSYSFPO-JKSUJKDBSA-N 329.356 2.319 5 50 EEBA COc1ccc(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-])c1 239309175 HFYNOSFWMNJZHB-GMKMDLSASA-N 340.335 2.161 5 50 EEBA Cc1ccc(C(=O)O)cc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 435093 QSQOKCFBPVAMRC-UHFFFAOYSA-N 326.264 2.402 5 50 EEBA CCOC(=O)N1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC1 4117531 OLSHQZAPNIDTLH-UHFFFAOYSA-N 338.389 2.066 5 50 EEBA O=[N+]([O-])c1ccc([C@H](O)CN2CCN(c3ccccc3)CC2)cc1 19782385 GTXQPKMVXFQXLR-GOSISDBHSA-N 327.384 2.450 5 50 EEBA CO[C@@H](C)c1nsc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 240744047 HUEKDYWGQSFUQT-NSHDSACASA-N 349.416 2.480 5 50 EEBA CCn1c(SCCn2ccc([N+](=O)[O-])n2)nc2ccccc2c1=O 178463712 OXBADEIRJUPNBU-UHFFFAOYSA-N 345.384 2.313 5 50 EEBA Cc1ccc2c(c1C)OC[C@H]2NS(=O)(=O)c1cccnc1[N+](=O)[O-] 170642428 HYOZCPBUVSYMSZ-GFCCVEGCSA-N 349.368 2.019 5 50 EEBA COc1cc([N+](=O)[O-])c(OC)cc1NS(=O)(=O)c1ccccc1 3878173 BYBATICEJOLSFR-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C(=O)c2ccccc2C1=O 3901770 DRQPXIATIRSGKD-UHFFFAOYSA-N 339.307 2.138 5 50 EEBA O=C(Nc1ccc(Cl)cn1)c1[nH]nc([N+](=O)[O-])c1Br 7077439 CSJKZTXDXCDCHD-UHFFFAOYSA-N 346.528 2.381 5 50 EEBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)cn2)n1 375883 BGDYMHYJKFPRND-UHFFFAOYSA-N 340.137 2.221 5 50 EEBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC(Cn2cncn2)CC1 188856333 RAWKVPHCBDCZPO-UHFFFAOYSA-N 344.375 2.439 5 50 EEBA Cc1ccccc1CC(=O)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 195512160 PPDWNOJSWKKSAB-UHFFFAOYSA-N 346.412 2.251 5 50 EEBA Cn1ncc(Br)c1C(=O)Nc1ccccc1[N+](=O)[O-] 6320535 UHDVKIQIUCXILG-UHFFFAOYSA-N 325.122 2.343 5 50 EEBA COc1ccc(NS(=O)(=O)c2ccc(OC)cc2[N+](=O)[O-])cc1 2849728 IYTNYFUIBBTSPR-UHFFFAOYSA-N 338.341 2.413 5 50 EEBA COc1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])c1 101360055 POQLTXUQTRSJEL-NBLIUIFLSA-N 328.324 2.305 5 50 EEBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ncc(C(F)(F)F)[nH]1 337629401 MURNLOZHODPRKH-UHFFFAOYSA-N 330.222 2.354 5 50 EEBA NCc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1 170684748 YQTJEFNHZBCCEG-UHFFFAOYSA-N 347.396 2.195 5 50 EEBA O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccc(O)c([N+](=O)[O-])c1 119111404 AMPZEHTXOICULC-OLZOCXBDSA-N 330.344 2.411 5 50 EEBA COC(=O)c1ccccc1Cn1cnc2cc([N+](=O)[O-])ccc2c1=O 253417249 SLFZQEPEQRZUDX-UHFFFAOYSA-N 339.307 2.140 5 50 EEBA Cn1cc(N2CCC[C@H](Sc3ccc([N+](=O)[O-])cn3)C2=O)cn1 159646847 ASTTVMWRIYFFLS-LBPRGKRZSA-N 333.373 2.011 5 50 EEBA Cc1cnc(OCC(=O)c2ccc3c(c2)CCC(=O)N3)c([N+](=O)[O-])c1 176706795 OYXYGPKUNCPFLO-UHFFFAOYSA-N 341.323 2.445 5 50 EEBA COC(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 302703 JLVNYYOIHIEBOT-UHFFFAOYSA-N 330.296 2.399 5 50 EEBA Cn1cnnc1Sc1c([N+](=O)[O-])cc([N+](=O)[O-])c2cccnc12 22107933 ZYAIWVMVQRTJMO-UHFFFAOYSA-N 332.301 2.331 5 50 EEBA O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1ccc(O)c([N+](=O)[O-])c1 119111211 AMPZEHTXOICULC-STQMWFEESA-N 330.344 2.411 5 50 EEBA CCN(c1ccncc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC 152637598 TWEWJGGRGOREJP-UHFFFAOYSA-N 337.357 2.214 5 50 EEBA CCn1nc(C)c([N+](=O)[O-])c1N1CCN(C(C)=O)C2(CCCCC2)C1 253428436 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