smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@]12CC(C(F)(F)F)=NN1C(=O)N(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C2=O 40584474 PKSJTBLLAZZQMG-GFCCVEGCSA-N 410.230 3.463 5 1 HGBF CC(=O)N[C@H](CSCc1ccccc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 586974584 VRMBVHYRBSJKNW-OAHLLOKOSA-N 415.431 3.490 5 1 HGBF O=[N+]([O-])c1cccc(-n2cc(-c3nc4ccc(Br)c(O)c4[nH]3)nn2)c1 587269276 KCDGKBPHQCTFNE-UHFFFAOYSA-N 401.180 3.187 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1ccc(OCn4cc([N+](=O)[O-])cn4)cc1)[C@@H](C2)C3=O 587434061 QGEIHKAYCSPSRX-UWJYYQICSA-N 407.382 3.325 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCn1ccc([N+](=O)[O-])n1 587863066 PJNMFPJCLDBNEM-UHFFFAOYSA-N 409.324 3.413 5 1 HGBF O=C(CN1CCCC1)Nc1ccc(Nc2cc(=O)oc3ccc([N+](=O)[O-])cc23)cc1 1857549080 LERQIOFDEHOWOY-UHFFFAOYSA-N 408.414 3.479 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)N(C(=O)NC(C)C)C(=O)N1 13820413 OAKKHOGCUWAIRH-INIZCTEOSA-N 404.423 3.005 5 1 HGBF COc1cc2c3c(c1)OC1(CCN(c4ccc([N+](=O)[O-])c(OC)c4)CC1)[C@@H](C2)C3=O 587434653 XVOSTMJKHUQRGE-INIZCTEOSA-N 410.426 3.399 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738367 NONOKKUTWWLIOH-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF O=[N+]([O-])c1ccc(NCCNc2ncc(-n3ccnc3)c(-c3ccccc3)n2)nc1 1772573668 DXRJCUZGWRWQRC-UHFFFAOYSA-N 402.418 3.157 5 1 HGBF O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CC[C@@H]1C2 29547682 PGWIMMBBCMXICM-CUVALRGFSA-N 422.503 3.489 5 1 HGBF COc1ccc2c(c1)CC[C@]2(Cc1cc([N+](=O)[O-])ccc1OC)c1cn(C)c(N)n1 96168403 LOABEFJEEMGKBS-JOCHJYFZSA-N 408.458 3.403 5 1 HGBF CCCc1c(O)ccc2c1O[C@H](c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])CC2=O 587489547 VFARZUBOOHSYDM-SFHVURJKSA-N 405.428 3.363 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@H](c2ccccc2)[N@+](C)([O-])C1 299804665 SDIAALDEQNWSDC-YADARESESA-N 405.495 3.252 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587753395 VQPBUQWRPLNGAX-CQLKUDPESA-N 406.211 3.226 5 1 HGBF O=[N+]([O-])c1cc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2cc1F 587112158 JRARIWCMQVYWTN-UHFFFAOYSA-N 407.287 3.331 5 1 HGBF O=[N+]([O-])c1ccc(F)cc1OCc1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 587158721 GEXZQDJOVUXZFJ-UHFFFAOYSA-N 410.365 3.249 5 1 HGBF CN(CC(=O)n1nc2cc1Oc1ccc(F)cc1-2)c1ccc([N+](=O)[O-])c2nonc12 587876144 ZVCIEBFDSKNJFD-UHFFFAOYSA-N 410.321 3.016 5 1 HGBF O=C(Nc1nc2cc(CO)ccc2n1[C@H]1CC[C@H](O)CC1)c1cccc([N+](=O)[O-])c1 653749378 VIOJCLCNONPCDS-JCNLHEQBSA-N 410.430 3.165 5 1 HGBF C[C@]1(COc2ccc(Oc3ccccc3)cc2)Cn2cc([N+](=O)[O-])nc2S1(=O)=O 1772647567 UNGUIPJLKBKHJJ-LJQANCHMSA-N 415.427 3.209 5 1 HGBF COc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)ccc1-n1cnc(Cl)c1 103235399 KGCIDPNPHWVMBM-UHFFFAOYSA-N 408.823 3.243 5 1 HGBF COCCNC(=O)c1cnc(NCC2CCCCC2)nc1-c1cccc([N+](=O)[O-])c1 82135936 ZZFGXXUZNGCABU-UHFFFAOYSA-N 413.478 3.420 5 1 HGBF Cc1cc(C)c2c(c1)c(=O)c1ccccc1n2CCCCN1CCN(CCO)CC1 1772632167 RNYPUSBEZJDGOI-UHFFFAOYSA-N 407.558 3.162 5 1 HGBF COC(=O)c1cccc2[nH]c(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)nc12 587080436 VFSXPVWSUXYYQN-UHFFFAOYSA-N 416.781 3.119 5 1 HGBF NC(=O)c1ccc(NNC(=S)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 13805551 MKNNVXBMTPOSRN-UHFFFAOYSA-N 421.482 3.274 5 1 HGBF Cc1cc2[nH]c(-c3cc(S(=O)(=O)N4CCC4)ccc3Cl)nc2cc1[N+](=O)[O-] 586956038 YUQRIAKYQAVUMT-UHFFFAOYSA-N 406.851 3.494 5 1 HGBF C[C@@]1(CCn2cnc([N+](=O)[O-])n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587341600 KABQGGXHDRLISS-PXNSSMCTSA-N 412.377 3.239 5 1 HGBF C[C@]1(COc2ccc(-c3ccc(F)nc3F)nc2)CCn2cc([N+](=O)[O-])nc2O1 1772637332 OJXJGKAFQPXUFF-GOSISDBHSA-N 403.345 3.147 5 1 HGBF COc1ccc([C@@H]2CC(c3cc(OC)c(OC)c(OC)c3)=NN2C)cc1[N+](=O)[O-] 49112089 CZAGAXXSQXXGOC-HNNXBMFYSA-N 401.419 3.410 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587735888 VQANNCHOTKBAQK-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF CSCC[C@H](NS(=O)(=O)c1ccccc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 586938038 UHPBBIAPVIBIGD-HNNXBMFYSA-N 406.489 3.244 5 1 HGBF C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc(OCCN(C)C)cc2[nH]1 587264280 FIGWFXGVELUCHS-LBPRGKRZSA-N 414.422 3.493 5 1 HGBF Cc1ccn2nc(SCc3nnc(SCc4ccc([N+](=O)[O-])cc4)o3)nc2n1 40918713 YJYGZPBKALUKRB-UHFFFAOYSA-N 415.460 3.309 5 1 HGBF COc1ccccc1OCCNC(=O)c1cc2c(ccc3c(C)cc(=O)oc32)oc1=N 653782731 JBAJEOIIKJZOMX-UHFFFAOYSA-N 420.421 3.144 5 1 HGBF CN(C)CCNc1cc2c(c3oc4ccccc4c(=O)c13)C[C@@H]([N+](=O)[O-])C(C)(C)O2 28705810 JCPZTNSGKPXFMC-GOSISDBHSA-N 411.458 3.279 5 1 HGBF O=C(O)[C@@H]1Cc2c(cnc3ccccc23)[C@](c2cccc([N+](=O)[O-])c2)(c2ncco2)N1 963229433 WFWCOECTIXUXRD-SIKLNZKXSA-N 416.393 3.022 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ccc(-c3ccc(C(F)(F)F)nc3)nc1)C2 72122924 TZHONJCBECIRIU-LBPRGKRZSA-N 407.308 3.107 5 1 HGBF C[C@@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc2ccccc2c1 13863144 KBNKKMDLORFSRW-AWEZNQCLSA-N 414.439 3.412 5 1 HGBF O=C(Oc1ccccc1N1C(=O)[C@H]2[C@@H]3C=C[C@H](C3)[C@@H]2C1=O)c1ccc([N+](=O)[O-])cc1 141657903 FXUAGKWMODMEET-QZCPTFHJSA-N 404.378 3.126 5 1 HGBF CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 586985690 ZUJFNXSEDPFUEO-ZDUSSCGKSA-N 404.224 3.049 5 1 HGBF COc1ccc2c(=O)c3cc(N)c(N4CCN(c5ccccn5)CC4)cc3n(C)c2c1 40952326 SCJQSWXZHVQKIT-UHFFFAOYSA-N 415.497 3.004 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cccc(OC(F)(F)F)c3[nH]2)cc1 586919631 CSISVYSLBQMQPH-UHFFFAOYSA-N 401.322 3.344 5 1 HGBF COc1cc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2cc1F 587264329 LQZZBQGMVGTJAK-VPTHRUTESA-N 405.342 3.061 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738242 LTZRSHVHDRYORD-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF O=c1c2cnc3ccccc3c2ncn1CCN1CCN(c2ccccc2Cl)CC1 72108681 OIPZNVOSFYZJON-UHFFFAOYSA-N 419.916 3.420 5 1 HGBF CN1CCN(CCO[C@H]2Cn3cc(C=O)c4ccc5c6ccccc6n(c5c43)C2)CC1 473153328 AJSYAAJWTNZAAX-IBGZPJMESA-N 416.525 3.208 5 1 HGBF C[C@](N)(c1ccc(S(=O)(=O)O)cc1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 586957561 BGXOIWIZRLHYTN-NRFANRHFSA-N 419.466 3.128 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(Cc1ccccc1[N+](=O)[O-])C(=O)O 587574966 HLEKOFLDRFWWMP-GCJKJVERSA-N 421.361 3.328 5 1 HGBF COc1cc2c(cc1OC)-c1n[nH]c(/C=C3\C(=O)Nc4cc([N+](=O)[O-])ccc43)c1C2 1857770167 WXZQPOCNWORKJW-ZSOIEALJSA-N 404.382 3.399 5 1 HGBF CN(C)CCNc1ccc2cc3ccccc3c3c2c1C(=O)N(CCN(C)C)C3=O 27555280 AAQXIJATYSGBKH-UHFFFAOYSA-N 404.514 3.124 5 1 HGBF O=c1n(-c2ccc([N+](=O)[O-])cc2)nc(-c2nc3ccccc3[nH]2)c2nc3ccccc3n12 40392744 FFGHJPDTFXOOHX-UHFFFAOYSA-N 423.392 3.485 5 1 HGBF CCc1nnc(CS(=O)(=O)c2cccc(-c3nc4ccc([N+](=O)[O-])cc4[nH]3)c2)o1 586923368 JKFUAUJKSIJTKF-UHFFFAOYSA-N 413.415 3.057 5 1 HGBF O=C([C@@H]1CCCN1C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)N1CCCCC1 82085381 VAPDWNBNOICTHH-KRWDZBQOSA-N 414.487 3.335 5 1 HGBF O=[N+]([O-])c1cn2c(n1)[S@](=O)C[C@H](OCc1ccc(OCc3ccccc3)cc1)C2 40933985 SZJFIYHXCJWTAT-LBEKAKSKSA-N 413.455 3.077 5 1 HGBF C[N+](C)(C)CCO[P@@](=O)(O)OC[C@H](COCc1ccccc1)Oc1ccccc1 40875324 XXFYMVMKLFUROC-NRFANRHFSA-O 424.454 3.491 5 1 HGBF O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccc(-c4cncnc4)cc3)CC2)cc1 95563202 ALWLQBZGDYONNV-UHFFFAOYSA-N 417.513 3.455 5 1 HGBF CNS(=O)(=O)c1ccc(CCc2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 586946088 GJAVSAJQPBUBLU-UHFFFAOYSA-N 417.494 3.353 5 1 HGBF N[C@@H](Cc1ccc(I)cc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 587186278 UJUDYHXTQDFEEY-NSHDSACASA-N 408.199 3.318 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(C(=O)OC)ncc2[nH]1 587263900 OYDWDSDQQPHNPD-SNVBAGLBSA-N 414.374 3.004 5 1 HGBF O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1c2c2ccccc2n1CCOCCO 73195991 REDDZUCSBDOQNW-UHFFFAOYSA-N 413.433 3.322 5 1 HGBF COc1cc2c3c(c1)O[C@](c1ccc([N+](=O)[O-])cc1)(c1cc(C=O)n(C)c1)[C@@H](C2)C3=O 587434160 RPEXQEYFSCAXMI-WMZHIEFXSA-N 418.405 3.446 5 1 HGBF O=C(O)CCC[C@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccc([N+](=O)[O-])c1)[C@@H]23 72182396 BWAFRCKQFHTKLV-KRQVXIAISA-N 415.490 3.165 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@@H](c2ccccc2)[N@@+](C)([O-])C1 299804663 SDIAALDEQNWSDC-DVECYGJZSA-N 405.495 3.252 5 1 HGBF COc1cc2c(c3c1c(=O)c1c4ccccc4ccc1n3C)[C@@H](O)[C@@H](O)C(C)(C)O2 38268381 CDRRPLDAWDEYGS-DHIUTWEWSA-N 405.450 3.419 5 1 HGBF CN1CCN(c2cc(/C=C/c3cc([N+](=O)[O-])ccc3O)[n+](C)c3ccccc23)CC1 299844662 OXTHOJHVMXOOBO-UHFFFAOYSA-O 405.478 3.200 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4c(F)cnc(Cl)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263244 PBXQDZPKJNSSAT-UHFFFAOYSA-N 418.816 3.142 5 1 HGBF O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CC[C@@H]1C2 101220649 PGWIMMBBCMXICM-AFHBECGJSA-N 422.503 3.489 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CN(CCO)CCN1C3 72112483 YJONCVYCNODBDC-INIZCTEOSA-N 422.525 3.053 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 84757834 JWKBLLMXSAXUKZ-UHFFFAOYSA-N 405.310 3.000 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4079810 AYLDPEIBDUYUCZ-IEBWSBKVSA-N 416.865 3.494 5 1 HGBF CCOC(=O)c1ccc(CCN2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 95560019 HXQUUYKDCWCSTP-UHFFFAOYSA-N 411.502 3.174 5 1 HGBF O=c1c2sccc2n(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1cc(F)ccc1F 2466760 YPYLXXWGCIOACF-UHFFFAOYSA-N 415.377 3.449 5 1 HGBF O=C(Oc1ccccc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O)c1ccc([N+](=O)[O-])cc1 4845635 FXUAGKWMODMEET-FTUNRGFVSA-N 404.378 3.126 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3cc(C)cc(F)c3[nH]2)cc1[N+](=O)[O-] 586940779 FVDQFCVZWALMMB-UHFFFAOYSA-N 410.452 3.119 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1cccc(Cl)c1)[C@H]([N+](=O)[O-])[C@H]1CSCN12 221599455 VPJKSHAKFFWUBV-YWTNHNAXSA-N 401.875 3.305 5 1 HGBF CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 586935074 DTKJHALWQSCCCZ-UHFFFAOYSA-N 406.471 3.341 5 1 HGBF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@H](c2cc(F)c([N+](=O)[O-])cc2Br)N1 962900483 IQLFWYCHKLVTPU-DZGCQCFKSA-N 413.174 3.324 5 1 HGBF Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 586945658 KTBZMJRMJHANHB-UHFFFAOYSA-N 407.455 3.277 5 1 HGBF CC(C)(C)OC(=O)c1cnc2ccn(S(=O)(=O)c3ccccc3[N+](=O)[O-])c2c1 72139952 SWKCTKIIXLBPFT-UHFFFAOYSA-N 403.416 3.137 5 1 HGBF O=C1C(=O)N(Cc2ccco2)[C@H](c2cccs2)[C@H]1C(=O)c1cccc([N+](=O)[O-])c1 169690295 ZRMNIEZDAHTATG-DLBZAZTESA-N 410.407 3.401 5 1 HGBF CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cc(N)c(N)cc2[nH]1 587054866 MMPAEKYABOGIFC-MRXNPFEDSA-N 402.842 3.416 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)n1ccc(-c2cnn3ccc(Cl)nc23)c1 473125780 YIMGMFZUFRVXJG-UHFFFAOYSA-N 417.834 3.305 5 1 HGBF O=C(c1cc(Br)cc([N+](=O)[O-])c1)n1ncc2ccc(Cl)cc2c1=O 587651162 MKHOBSLSRIKFIA-UHFFFAOYSA-N 408.595 3.409 5 1 HGBF Cc1csc([C@](O)(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)C(F)(F)F)n1 587093885 HVWXPOMKKQVKMI-CYBMUJFWSA-N 417.325 3.137 5 1 HGBF O=[N+]([O-])c1ccc(CCNc2ncnc3c2nnn3Cc2ccccc2Cl)cc1 13778575 WWXKBJGNARCINN-UHFFFAOYSA-N 409.837 3.486 5 1 HGBF O=[N+]([O-])c1cncc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c12 587119527 XPPZRVQYUGUVMC-UHFFFAOYSA-N 405.134 3.087 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c([N+](=O)[O-])cccc12 587577731 UHQUVHASNDWRLT-IERDGZPVSA-N 404.334 3.110 5 1 HGBF CNC(=O)NCCOCC[n+]1ccc2c(C)c3[nH]c4ccc(O)cc4c3c(C)c2c1 169349745 ZMXGSTFOIKLRIS-UHFFFAOYSA-O 407.494 3.030 5 1 HGBF O=C(COc1ccccc1[N+](=O)[O-])c1c(CO)oc2cc(Br)cnc12 587274019 RIAWAPPJPLPQEV-UHFFFAOYSA-N 407.176 3.253 5 1 HGBF CSc1ccc2nc(CNS(=O)(=O)c3ccc(SC)c([N+](=O)[O-])c3)[nH]c2c1 586942691 ZPWXIAOYGYQUFF-UHFFFAOYSA-N 424.529 3.393 5 1 HGBF O=C1[C@@H]2CC=CC[C@H]2C(=O)N1c1ccc(NCCc2ccc(O)cc2)c([N+](=O)[O-])c1 100513698 BJRYZTDRHVYPTC-QZTJIDSGSA-N 407.426 3.411 5 3 HGBF O=[N+]([O-])c1c(OCc2ccccc2)ccc(-c2ccc3c(O)nc(O)nc3n2)c1O 587555775 RUVDKPRWIJLCEY-UHFFFAOYSA-N 406.354 3.296 5 1 HGBF Cc1ccc(CNc2ncc(C(=O)N3CCOCC3)c(-c3ccc([N+](=O)[O-])cc3)n2)o1 82147796 UOZQEJQFIUDFSY-UHFFFAOYSA-N 423.429 3.038 5 1 HGBF COc1cc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c(OC)c([N+](=O)[O-])c1 587261183 XPQXNXPSWZHPBP-UHFFFAOYSA-N 422.401 3.215 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1cccc(OCn4ccc([N+](=O)[O-])n4)c1)[C@@H](C2)C3=O 587431597 PJTAHNWSKQXFFZ-HRAATJIYSA-N 407.382 3.325 5 1 HGBF COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCOCC4)c([N+](=O)[O-])c1)[C@@H](C2)C3=O 587432689 KTPVUFXACGFLCA-KSFYIVLOSA-N 410.426 3.103 5 1 HGBF COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c2[nH]c(C)c(CN(C)C)c2c1 587621120 PJOCAKPBAHYROO-UHFFFAOYSA-N 418.475 3.256 5 1 HGBF O=[N+]([O-])c1ccc(CNC[C@](O)(Cn2cncn2)c2ccc(Cl)cc2Cl)cc1 29040341 LADHIZJQZAYMPT-SFHVURJKSA-N 422.272 3.171 5 1 HGBF Cc1csc([C@@](O)(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)C(F)(F)F)n1 587093888 HVWXPOMKKQVKMI-ZDUSSCGKSA-N 417.325 3.137 5 1 HGBF Cc1ncc([N+](=O)[O-])n1CCOc1ccc(O)n1-c1cccc(Br)c1N 587936999 ZOSNERNQAMUXAH-UHFFFAOYSA-N 422.239 3.020 5 1 HGBF CCOC(=O)C1=CC[C@H](c2ccccc2)N(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 72139349 GGBRNUQFBBUEQF-QGZVFWFLSA-N 416.455 3.220 5 3 HGBF Cn1cc(C2=C(c3cn(C)c4ccc([N+](=O)[O-])cc34)C(=O)NC2=O)c2ccccc21 13447759 LNBSCVOUTJSEPP-UHFFFAOYSA-N 400.394 3.145 5 1 HGBF O=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1cccc([C@H]2CN3CCSC3=N2)c1 29395000 IUVOLXDWWJDXMQ-OAHLLOKOSA-N 411.443 3.016 5 1 HGBF CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(C(N)=O)cc2[nH]1 587058020 ZJKREVBPHDTZDC-MRXNPFEDSA-N 415.837 3.351 5 1 HGBF O=[N+]([O-])c1ccc2nc(-c3ccc4ncc(I)n4c3)[nH]c2c1 587188933 YRZSXDLDXOICSZ-UHFFFAOYSA-N 405.155 3.390 5 1 HGBF CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1nn(C)cc1[N+](=O)[O-] 587865762 IBMUKYPMOHSXCZ-UHFFFAOYSA-N 409.324 3.298 5 1 HGBF O=c1c2cnc3ccccc3c2ncn1CCCN1CCN(c2ccccc2F)CC1 72107311 IXZFNJLAFOEMOB-UHFFFAOYSA-N 417.488 3.296 5 1 HGBF CCN(CC)CCNc1nc2ccc([N+](=O)[O-])cc2nc1NCCN(CC)CC 72141428 NVFARVYPPUKEKU-UHFFFAOYSA-N 403.531 3.045 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4c(Cl)ccnc4[nH]3)CC2)ccc1[N+](=O)[O-] 587263337 RSFYZMYQOOMDGX-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 587578294 VVUCEJUNZYUTMW-UWJYYQICSA-N 404.334 3.110 5 1 HGBF COc1cc(OC[C@H](O)COC(C)=O)cc2c1c(=O)c1cc3ccccc3cc1n2C 45289831 IIXRYHSOAWKPEX-QGZVFWFLSA-N 421.449 3.156 5 1 HGBF CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 586974583 VRMBVHYRBSJKNW-HNNXBMFYSA-N 415.431 3.490 5 1 HGBF C[C@@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)n1cc([N+](=O)[O-])cn1 587660713 JGQGTCTVKUKTRJ-LBPRGKRZSA-N 407.361 3.209 5 1 HGBF COC(=O)/C(=C\c1ccc([N+](=O)[O-])cc1)CNCCc1ccc(OC)c(OC)c1 98082529 ZRHWNLYUQWNMSM-ATVHPVEESA-N 400.431 3.001 5 1 HGBF O=C1N=C2/C(=C/c3cccc([N+](=O)[O-])c3)CNC[C@H]2[C@@H](c2cccc([N+](=O)[O-])c2)N1 169730008 ZKLUDMIJZMEMSE-XQMGMDATSA-N 407.386 3.011 5 1 HGBF Cc1nn(C)c2c1c(C(F)(F)F)cc(=O)n2Cc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587120988 MRKDYAVMJIINRE-UHFFFAOYSA-N 424.314 3.034 5 1 HGBF N[C@@H](CCc1nc2c(Cl)c(Cl)cnc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587270540 MPXPPEHYMQMNHC-NSHDSACASA-N 409.233 3.072 5 1 HGBF CNC(=O)CSc1nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2s1 66074298 GJAKDMMWRLDWNG-UHFFFAOYSA-N 402.457 3.295 5 1 HGBF Cn1c2cc(N3CCN(c4ccccc4)CC3)c(N)cc2c(=O)c2c(O)cc(O)cc21 40952033 MFFSCHAYWJOACT-UHFFFAOYSA-N 416.481 3.012 5 1 HGBF O=[N+]([O-])c1cccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c12 586952825 IGPBAKVDQOGHIF-UHFFFAOYSA-N 401.429 3.395 5 1 HGBF CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 586939394 NWZWKHNWWKZNEA-JTQLQIEISA-N 419.419 3.123 5 1 HGBF CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1cc([N+](=O)[O-])c(OC)n1 587871601 KYABWYICEVXACC-LLVKDONJSA-N 403.370 3.103 5 1 HGBF NCC1CCC(CNc2nc(NCc3cccc(F)c3F)ncc2[N+](=O)[O-])CC1 28898491 VHQULGJLLIBSPH-UHFFFAOYSA-N 406.437 3.452 5 1 HGBF CC1(C)CCN(S(=O)(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CC1 198454533 YIVPYLUGTBZUBI-UHFFFAOYSA-N 407.448 3.251 5 3 HGBF COc1ccc(Cn2cnc3c(cc(N4CCOCC4)c4ccccc43)c2=O)cc1 1857567312 RZCQMGPRXLQJIE-UHFFFAOYSA-N 401.466 3.443 5 1 HGBF COCCCNC(=O)c1cnc(N2CCC(C)CC2)nc1-c1ccc([N+](=O)[O-])cc1 82147999 LTBHSCHPXBNRPH-UHFFFAOYSA-N 413.478 3.054 5 1 HGBF CCCC[C@@H](CC)C(=O)OC[C@@]1(CO)C/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O1 45498274 AQWODVHYXIDBMB-PZCCAKEJSA-N 405.447 3.416 5 1 HGBF N[C@@H](CCc1nc2cc(Cl)c(Cl)nc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587269552 FEDCHSZJJWTZMW-NSHDSACASA-N 409.233 3.072 5 1 HGBF CCCc1c(O)ccc2c1O[C@](C)(/C(=C/N(C)C)n1cc([N+](=O)[O-])cn1)CC2=O 587471810 VLEFDPYISGVRRJ-SQWSFHKJSA-N 400.435 3.234 5 1 HGBF C[C@]1(CN2CCc3sc(-c4ccc(F)cc4)nc3C2)Cn2cc([N+](=O)[O-])nc2O1 1857557192 QWMDZZHWYQOGPD-IBGZPJMESA-N 415.450 3.263 5 1 HGBF O=C([C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCOCC1 4051922 MGOSVBYFBSSCIF-MJGOQNOKSA-N 415.833 3.199 5 1 HGBF C[C@H]1C[C@@H](C)CN(C(=O)c2ccc(N3CCN(c4ccccn4)CC3)c([N+](=O)[O-])c2)C1 4660419 RJTRUMKWEAYQOL-HDICACEKSA-N 423.517 3.435 5 1 HGBF CC(C)(C)N(CCC(=O)c1ccccc1)C(=O)COC(=O)c1ccc([N+](=O)[O-])o1 66251844 AOKHXCAPZKVHAM-UHFFFAOYSA-N 402.403 3.245 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3ccc(C)c(C)c3[nH]2)cc1[N+](=O)[O-] 586940879 IWZVMCMBQAIXSP-UHFFFAOYSA-N 406.489 3.288 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc(I)cc2[nH]1 587265919 SIDQPSBMDAALGD-JTQLQIEISA-N 424.198 3.024 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@@H](c2ccccc2)[N+](C)([O-])C1 26268796 SDIAALDEQNWSDC-PHSANKKPSA-N 405.495 3.252 5 1 HGBF CCN(CC)S(=O)(=O)c1ccc2[nH]c(COc3cc(F)ccc3[N+](=O)[O-])nc2c1 27031973 JSYHRKMDWVLDDR-UHFFFAOYSA-N 422.438 3.220 5 1 HGBF Cc1nc(-c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)sc1C(=O)N1CCCCC1 84690551 ZZBJVVMXMMDHEW-UHFFFAOYSA-N 409.489 3.056 5 1 HGBF CCn1c(-c2cccc([N+](=O)[O-])c2)cs/c1=N/c1ccc(S(N)(=O)=O)cc1 1911576246 FTIMQKGVTQAVFZ-HTXNQAPBSA-N 404.473 3.025 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3cccn4c(Br)cnc34)[nH]c2cc1[N+](=O)[O-] 587008835 YXNARKIIZBLKFV-UHFFFAOYSA-N 403.152 3.457 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc2ccccc2c1 26381579 KBNKKMDLORFSRW-CQSZACIVSA-N 414.439 3.412 5 1 HGBF COc1ccc(OC)c(C2=C[C@H](c3ccc(OC)c([N+](=O)[O-])c3)NC(=S)N2)c1 40848567 SQYNXBPEYFZJSC-CQSZACIVSA-N 401.444 3.181 5 1 HGBF O=C(c1cnc(NCc2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCOCC1 82148343 KYGSJKZUUQYJGE-UHFFFAOYSA-N 419.441 3.136 5 1 HGBF O=C1C[C@@H](Cc2nc3cncc([N+](=O)[O-])c3[nH]2)c2c(Br)cccc2O1 587004231 RUYWMEFITVYOEZ-MRVPVSSYSA-N 403.192 3.264 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(OC(F)(F)F)c2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 962626297 GSSWQTDGRUBHSP-BONVTDFDSA-N 400.284 3.321 5 1 HGBF O=C(NCCO)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4206725 OGKUEFYHDIYRHU-NVXWUHKLSA-N 424.240 3.102 5 1 HGBF O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 82195441 ZYNKEQVFGWOKHR-ZDUSSCGKSA-N 400.382 3.366 5 1 HGBF COC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)CN1C(=O)C(=O)c2cc(Cl)ccc21 96930098 FQRUBHNQCSZJMW-XYOKQWHBSA-N 400.774 3.034 5 1 HGBF C/C(=C\CC[C@@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@@H](O)C(C)(C)O 66104213 CAJMFLABBNVXCD-BMGPEXAXSA-N 402.919 3.462 5 1 HGBF CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1F 1857606857 SOFCAVDJCCLIOJ-UHFFFAOYSA-N 401.803 3.401 5 1 HGBF O=C(N[C@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 28572663 VNTSYMJKMVSSSN-HXUWFJFHSA-N 400.394 3.140 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c2cc1F 586945750 LQMOCFRTPQAFPJ-UHFFFAOYSA-N 422.419 3.410 5 1 HGBF COc1cc([C@@H]2NCCc3cc(C)c(F)cc32)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 962303870 XQPXPPHUOQDBGN-ZMZPIMSZSA-N 404.394 3.138 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c([C@@H](C)Cn3cc([N+](=O)[O-])cn3)nc2c1 587277273 RUKPUDJQNPUDOO-QMMMGPOBSA-N 408.212 3.020 5 1 HGBF O=c1c2cnc3ccccc3c2ncn1CCN1CCN(c2ccc(Cl)cc2)CC1 72106654 LWZXXKMQMWJWEI-UHFFFAOYSA-N 419.916 3.420 5 1 HGBF CC(C)c1ccccc1OC[C@@H](O)COc1ccc2c(O)c([N+](=O)[O-])c(=O)oc2c1 169337591 BBPITHUUIKNMEZ-ZDUSSCGKSA-N 415.398 3.349 5 1 HGBF C[C@@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cnc3ccccc3c2[nH]1 587266396 LHKAMQSIJVABDE-BMLIUANNSA-N 408.374 3.462 5 1 HGBF C[C@]1(CN2CCc3nc(-c4cccc(F)c4)ccc3C2)Cn2cc([N+](=O)[O-])nc2O1 1857618922 QNMBOPPRTCCOBW-NRFANRHFSA-N 409.421 3.202 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OC(C)C)=C(N)O1 96272043 CJAYJOPOFLZZNK-INIZCTEOSA-N 404.419 3.056 5 1 HGBF CCCCCCOC(=O)[C@H](C(=O)O[C@H]1C[C@H]2[C@@H]3O[C@@H]3[C@@H](C1)[N+]2(C)C)c1ccccc1 103227265 YZSQAUILEKBORC-MCSHHISBSA-N 416.538 3.194 5 1 HGBF Nc1cc2[nH]c(-c3ccc(Cn4cc([N+](=O)[O-])c(C(F)(F)F)n4)cc3)nc2cn1 587119033 UIPJOBBKXCFLJZ-UHFFFAOYSA-N 403.324 3.379 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)[C@@H]1C[N+](=O)[O-] 587263400 MIOJWGNUGJKZPJ-HRDYMLBCSA-N 406.311 3.273 5 1 HGBF Cc1cc2c(cc1F)[C@]1(NCC2)c2c(cccc2[N+](=O)[O-])C(=O)c2c(N)ccc(N)c21 962095417 WZRYDARPFXKQBG-QHCPKHFHSA-N 418.428 3.189 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587570484 LAGAXUAZFKGVPH-UWJYYQICSA-N 422.324 3.249 5 1 HGBF CCCCOCCOC(=O)[C@H](C)NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82083984 YIJBEFFSOZEJFM-ZDUSSCGKSA-N 421.475 3.197 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3cc(C)c(C)cc3[nH]2)cc1[N+](=O)[O-] 586940785 FZTJURNBPAMKTJ-UHFFFAOYSA-N 406.489 3.288 5 1 HGBF Cc1c([N+](=O)[O-])cnn1CCC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587660603 HTGIOWFFUNALFN-UHFFFAOYSA-N 421.388 3.346 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc(N)cc([N+](=O)[O-])c1 587867849 COTSGARRMYZYGC-UHFFFAOYSA-N 407.308 3.151 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CN(N(C)C)CN1C3 72111342 LEOZDJDUQQCSBQ-HNNXBMFYSA-N 407.514 3.495 5 1 HGBF COCCOC(=O)C1=C(C)N=C(C)[C@@H](C(=O)OC(C)C)[C@H]1c1cccc([N+](=O)[O-])c1 101235404 SVMHYHIZWOJKDL-MOPGFXCFSA-N 418.446 3.184 5 1 HGBF CCc1cnc(-c2cnc(NCCNC(C)=O)nc2-c2ccc([N+](=O)[O-])cc2)s1 82221441 VVDGTSYYOFEJKH-UHFFFAOYSA-N 412.475 3.286 5 1 HGBF N[C@H](CCc1ccc([N+](=O)[O-])cc1)[P@](=O)(O)C[C@@H](Cc1ccccc1)C(=O)O 299841237 YSYQXQQIKOEBNN-AEFFLSMTSA-N 406.375 3.026 5 1 HGBF in-vitro Cc1cc2[nH]c(C3CCN(c4ccc([N+](=O)[O-])c(C(N)=O)c4)CC3)nc2cc1[N+](=O)[O-] 587263461 URHOKFZJEGONJV-UHFFFAOYSA-N 424.417 3.171 5 1 HGBF CC(C)CNC(=O)[C@H](Cc1c[nH]cn1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 82192164 JCSFSJCXFXXIAG-INIZCTEOSA-N 414.491 3.237 5 1 HGBF CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cncc([N+](=O)[O-])c2[nH]1 586984391 KXJJTXSFDDDUQO-LBPRGKRZSA-N 404.224 3.049 5 1 HGBF COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 587391351 VVGPEAXRUAWKNI-QFYYESIMSA-N 416.386 3.052 5 1 HGBF Cc1cc([N+](=O)[O-])nn1Cc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 587652221 ABRHCSHKCAMYJP-UHFFFAOYSA-N 423.816 3.200 5 1 HGBF C[C@]1(c2cccc([N+](=O)[O-])c2Br)N[C@H](C(=O)O)Cc2cc(F)ccc21 962909463 XNUJEIWLUYDDBQ-GUYCJALGSA-N 409.211 3.359 5 1 HGBF O=[N+]([O-])c1ccc(N2CCN(C[C@H](O)c3ccc(Br)cc3)CC2)cc1 209582088 XJMAXELUJLRZJX-SFHVURJKSA-N 406.280 3.213 5 1 HGBF COc1cc2c(cc1OC)-c1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N+](C)([O-])CC3 14639541 VNBHQEBDHVUTGL-NGMICRHFSA-N 401.459 3.494 5 1 HGBF O=C1C[C@H](Cc2nc3cncc([N+](=O)[O-])c3[nH]2)c2c(Br)cccc2O1 587004232 RUYWMEFITVYOEZ-QMMMGPOBSA-N 403.192 3.264 5 1 HGBF CN(C)CCNc1cc2c(c3oc4ccccc4c(=O)c13)C[C@H]([N+](=O)[O-])C(C)(C)O2 28705807 JCPZTNSGKPXFMC-SFHVURJKSA-N 411.458 3.279 5 1 HGBF CCOC(=O)Nc1ccc(C(=O)NCc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc1 587228949 UPFZISWNLKJVJA-UHFFFAOYSA-N 401.354 3.109 5 1 HGBF Cn1nc([N+](=O)[O-])cc1-c1nc2c(Br)ccc(Br)c2[nH]1 587274724 KMFCDZVTPDJMNN-UHFFFAOYSA-N 401.018 3.397 5 1 HGBF CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 587037938 AUKOCMLBOCSEHR-UHFFFAOYSA-N 407.368 3.245 5 1 HGBF C[N+]12CCC(CC1)[C@@H](Cc1nc(-c3cccc(I)c3)no1)C2 1857556014 JGFJPQCMIMKWEB-BJJGWYPJSA-N 410.279 3.370 5 1 HGBF COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2oc(=O)ccc12 40380401 UMPRVWNMWWYHAJ-UHFFFAOYSA-N 411.439 3.465 5 1 HGBF C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 586961119 FUBDAJLIUDUKLS-YFKPBYRVSA-N 411.241 3.165 5 1 HGBF C/C(=C\[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)[N+](=O)[O-] 1772625806 UKMQUUMHKOPROJ-GPCYYHMHSA-N 411.458 3.209 5 1 HGBF Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc2c3ccccc3nc-2c1O 100705217 GTXKMQJKOGDXGD-UHFFFAOYSA-N 409.427 3.418 5 1 HGBF O=C(NCCC1=CCCCC1)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 201459334 WWRFWBWJUIORDI-UHFFFAOYSA-N 421.519 3.002 5 3 HGBF COCCCNC(=O)c1cnc(N2CCC(C)CC2)nc1-c1cccc([N+](=O)[O-])c1 82134577 BSZSQZHYYBBCJI-UHFFFAOYSA-N 413.478 3.054 5 1 HGBF CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2c(O)nc(S)nc2[nH]1 587053381 DPAFFAFQVDNVRJ-JTQLQIEISA-N 422.854 3.036 5 1 HGBF C[C@@]1(COc2ccc(-c3ccc(F)nc3F)cn2)CCn2cc([N+](=O)[O-])nc2O1 1772599003 ZITJTYCKPMAMOZ-SFHVURJKSA-N 403.345 3.147 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccc(Br)nc2[nH]1 587116533 GKWWEJOZZHDQQM-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF O=[N+]([O-])c1cccc(-n2cc(-c3nc4c(F)cnc(Br)c4[nH]3)nn2)c1 587270695 YTEMGHVUVXUHHZ-UHFFFAOYSA-N 404.159 3.015 5 1 HGBF O=C(NC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc([C@@H]2CN3CCSC3=N2)c1 29390021 KGHKBCOLWWSKGF-INIZCTEOSA-N 411.443 3.016 5 1 HGBF O=C(N[C@@H](Cc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)C(=O)O)OCc1ccccc1 587201880 CRNJAEADJXXLCU-AWEZNQCLSA-N 418.793 3.047 5 1 HGBF O=C(O)C[C@@H](NC(=O)OCc1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587202837 LSUNVGQTTPJEEC-CQSZACIVSA-N 402.338 3.052 5 1 HGBF CS(=O)(=O)C[C@@]1(c2ccc([N+](=O)[O-])cc2)NCCc2c(Cl)cc(Cl)cc21 963102751 FLAFPPGGLJASGV-KRWDZBQOSA-N 415.298 3.336 5 1 HGBF COc1cc(C2=C[C@@H](c3ccc([N+](=O)[O-])cc3)NC(=S)N2)cc(OC)c1OC 40848345 IQRGLWJUVRRTHS-AWEZNQCLSA-N 401.444 3.181 5 1 HGBF Cc1nc(-c2cnc(N3CCC[C@@H](C(N)=O)C3)nc2-c2cccc([N+](=O)[O-])c2)oc1C 82163658 KELCCRPWPATRRP-OAHLLOKOSA-N 422.445 3.025 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3cc(F)cc(C(=O)O)c3[nH]2)cc([N+](=O)[O-])c1Cl 586925891 KDLDZGBRIVXHFA-UHFFFAOYSA-N 413.770 3.032 5 1 HGBF Cc1onc(-c2nc3cc(F)c([N+](=O)[O-])cc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587078827 BWRZAIVJKAHQIL-UHFFFAOYSA-N 421.732 3.380 5 1 HGBF Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])[C@H](C)C(=O)O)c(C)c1 26377216 HPSAUYZMBXCLSF-OAHLLOKOSA-N 406.460 3.184 5 1 HGBF COc1cc2c(cc1OC)C(=O)[C@@H]([C@@H](O)C1CC[N+](C)(Cc3ccccc3)CC1)C2 38142507 IBATXZHEHNSLNL-LURNQLGZSA-N 410.534 3.477 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(F)c2[C@@H](c2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)N1 962923446 QYGOPSWCURRKNN-XHDPSFHLSA-N 400.284 3.321 5 1 HGBF O=C([C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCOCC1 4051921 MGOSVBYFBSSCIF-IEBWSBKVSA-N 415.833 3.199 5 1 HGBF C[C@@]1(c2ccc(N)c([N+](=O)[O-])c2)N[C@@H](C(=O)O)Cc2c(C(F)(F)F)cc(F)cc21 962697023 BAKFSMSOABDHQE-PBHICJAKSA-N 413.327 3.197 5 1 HGBF CCOC(=O)c1c(Cc2ccccc2[N+](=O)[O-])[nH]c2ccc(S(C)(=O)=O)cc12 587650563 NSTZNLSYSOJNTB-UHFFFAOYSA-N 402.428 3.247 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cncc([N+](=O)[O-])c3[nH]2)[C@@H]2CCCO[C@@H]2C1(C)C 587238340 CFAYBSMDFIVZAQ-SZELWCTASA-N 417.466 3.421 5 1 HGBF Cn1cc(-n2cc(C(=O)O)c(=O)c3cc(F)c(N4CCCCC4)cc32)c([N+](=O)[O-])c1 27094848 JWKRADOQEJMMII-UHFFFAOYSA-N 414.393 3.065 5 1 HGBF NS(=O)(=O)c1cc2nc(-c3cccc([N+](=O)[O-])c3)n3c4ccccc4oc(c1)c23 95591030 FTNYIODROSTPTE-UHFFFAOYSA-N 408.395 3.456 5 1 HGBF COC(=O)c1cnn2c1N=C(C)/C(=C(\O)OC(C)C)[C@@H]2c1cccc([N+](=O)[O-])c1 101268707 VDGLFIWHGYKXDR-JQSQVVPISA-N 400.391 3.468 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 772622 GRNGRADFUBMVFX-SJLPKXTDSA-N 417.805 3.157 5 1 HGBF CCCCCN(CCCCC)c1c([N+](=O)[O-])cc(S(N)(=O)=O)cc1[N+](=O)[O-] 13648898 SOFKYVBHTUGCCM-UHFFFAOYSA-N 402.473 3.337 5 1 HGBF N[C@H]1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn4c5cc(Cl)ccc5oc2c34)C1 101743259 QZLWPNJLWXKAPO-JTQLQIEISA-N 415.808 3.227 5 1 HGBF COc1cc(Nc2nccc(-n3ncc4cc([N+](=O)[O-])ccc43)n2)cc(OC)c1OC 653876493 ADYFIOXNXDZKTN-UHFFFAOYSA-N 422.401 3.493 5 1 HGBF COc1ccc(CNc2ncnc3cc(NCCN)c([N+](=O)[O-])cc23)cc1Cl 40915404 RFOKHUPLFHKDCR-UHFFFAOYSA-N 402.842 3.183 5 1 HGBF Cc1cc2c(cc1F)[C@@]1(NCC2)c2c(cccc2[N+](=O)[O-])C(=O)c2c(N)ccc(N)c21 962095398 WZRYDARPFXKQBG-HSZRJFAPSA-N 418.428 3.189 5 1 HGBF O=C(COC(=O)c1ccccc1)c1ccc(I)c([N+](=O)[O-])c1 68584213 ICNRCXWXJJOLPY-UHFFFAOYSA-N 411.151 3.239 5 1 HGBF biogenic CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)N=C(SCCN(C)C)N1 299858983 UTWUFSNHYLOFDE-QGZVFWFLSA-N 406.508 3.116 5 1 HGBF Cc1onc(-c2nc3c([N+](=O)[O-])cccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587080196 SEPPOBAVATUFBX-UHFFFAOYSA-N 403.742 3.241 5 1 HGBF COc1ccccc1NC(=O)c1cn(CCO)c2c(cc(Cl)c3ncccc32)c1=O 103293441 LSNSUGRHDIJVLH-UHFFFAOYSA-N 423.856 3.456 5 1 HGBF O=C(N[C@@H](CO)COCc1ccccc1)c1csc(-c2ccccc2[N+](=O)[O-])n1 82085941 WHRWWAOCKONYHF-HNNXBMFYSA-N 413.455 3.026 5 1 HGBF O=C(NCCO)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4055231 LKWJZXYMLVGINO-WBVHZDCISA-N 424.240 3.102 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 587271066 YZUGQNMRVUOFOA-LBPRGKRZSA-N 405.208 3.174 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587735882 VQANNCHOTKBAQK-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF COCCOc1ccc(-c2nc3ccc(OCCN(C)C)cc3[nH]2)cc1[N+](=O)[O-] 587265359 PGTURFMWMBFUAP-UHFFFAOYSA-N 400.435 3.104 5 1 HGBF O=C1CCc2ccc(OCCCCN3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2N1 27727798 TZUWZHMEUHMEQQ-UHFFFAOYSA-N 424.501 3.461 5 1 HGBF CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4211387 GRNGRADFUBMVFX-WMZOPIPTSA-N 417.805 3.157 5 1 HGBF C[C@H]1CC2(C[C@@H](C)N1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N2Cc1ccccc1 28971284 RVAVECVILHMNIE-NWMVZANLSA-N 422.485 3.458 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(C(=O)OC)nc2[nH]1 587261863 DJRXESOSBYAOQV-JTQLQIEISA-N 414.374 3.004 5 1 HGBF CN1CCc2cn(C)nc2[C@]1(C[C@H]1CCCC[C@H]1C(=O)O)c1ccccc1[N+](=O)[O-] 963953770 DFJONPZVPXMWIZ-JLDZCNIISA-N 412.490 3.341 5 1 HGBF COc1cccc(-n2nnc(-c3ccccc3NC(=O)c3cccc([N+](=O)[O-])c3)n2)c1 1772643177 GAEVXDNVGRCDCS-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF Cc1nn(C)c(C)c1Nc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)cc1[N+](=O)[O-] 4684245 VHPKSXBBZWUYIL-WVMBZCLNSA-N 407.430 3.000 5 1 HGBF CCOC(=O)[C@H]1[C@H](C(=O)c2ccc([N+](=O)[O-])cc2)[C@@]12C(=O)Nc1ccc(Cl)cc12 473150560 MKDRDSVGOWVPAT-JXXFODFXSA-N 414.801 3.130 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(CCC[S@@](=O)c3ccc(Br)cc3)nc2c1 586958642 GYZDQBNNDPXLLK-XMMPIXPASA-N 409.265 3.369 5 1 HGBF O=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1CC(CO)(CO)C3 28819476 DBYROLWMWGUFKF-UHFFFAOYSA-N 411.461 3.130 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 769152 OIELNGLIOPIRQE-AEFFLSMTSA-N 417.805 3.157 5 1 HGBF C[C@](O)(C[S@](=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28015923 SMQYNPMQOPFYTJ-DEXQXJORSA-N 416.377 3.111 5 1 HGBF CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 586965433 WNMSEJAGULFILX-UHFFFAOYSA-N 416.442 3.067 5 1 HGBF COc1cc2ncc3c(N)nc(-c4cncc(OC[C@H](C)N)c4)cc3c2cc1OC 49072566 CFWZNCTWCNPULR-LBPRGKRZSA-N 405.458 3.170 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c([N+](=O)[O-])cccc12 587577869 UHQUVHASNDWRLT-IIBYNOLFSA-N 404.334 3.110 5 1 HGBF Cc1nnc(SC[C@@](C)(O)C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 28094088 MPCNDLVBUWRIHK-CYBMUJFWSA-N 422.410 3.255 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2cc1[N+](=O)[O-] 587160763 GNUIIAMHKJCQGP-UHFFFAOYSA-N 417.744 3.479 5 1 HGBF O=C(CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)NCC1CCCCC1 82084754 ZAARVOHGEQSQHV-UHFFFAOYSA-N 402.476 3.145 5 1 HGBF O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2ccc(S(=O)(=O)O)cc2[nH]1 587110238 XDQIASCZTAZUJX-UHFFFAOYSA-N 401.322 3.327 5 1 HGBF O=C(c1ccc([N+](=O)[O-])o1)N1CCC2(CC1)C[C@@H](Cc1nc(C3CC3)no1)CCO2 1857612547 CHFSOZOFKOHEAF-CYBMUJFWSA-N 416.434 3.092 5 1 HGBF O=C(NCCO)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4206729 OGKUEFYHDIYRHU-DOTOQJQBSA-N 424.240 3.102 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@H](c2ccccc2)[N+](C)([O-])C1 26268803 SDIAALDEQNWSDC-XGLRFROISA-N 405.495 3.252 5 1 HGBF CCCCNS(=O)(=O)c1ccc2nc(CCc3cccc([N+](=O)[O-])c3)[nH]c2c1 587269856 HWNBWUSCZTWEEX-UHFFFAOYSA-N 402.476 3.335 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cc(Cl)cnc4[nH]3)CC2)ccc1[N+](=O)[O-] 587262941 JHZMQYNBJBUDSQ-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc([N+](=O)[O-])ccc1N1CCC(CO)CC1)O2 587388681 GFYQCBCYLMFAPH-NRFANRHFSA-N 411.458 3.401 5 1 HGBF O=[N+]([O-])c1cn2c(n1)O[C@@H](COc1ccc(-c3ccc(C(F)(F)F)nc3)cn1)CC2 1772616973 RCUJHSDDIRIWGO-CYBMUJFWSA-N 421.335 3.497 5 1 HGBF COc1cccc2c1CCC(=O)N2CCCN1CCN(c2cccc([N+](=O)[O-])c2)CC1 605839 IPKDKVLEWIJDKE-UHFFFAOYSA-N 424.501 3.095 5 1 HGBF C[C@@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cnc3ccccc3c2[nH]1 587266593 LHKAMQSIJVABDE-QGHHPUGFSA-N 408.374 3.462 5 1 HGBF COc1cc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2cc1F 587264327 LQZZBQGMVGTJAK-BCTVWOGZSA-N 405.342 3.061 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cc([N+](=O)[O-])cnc3[nH]2)[C@@H]2CCCO[C@H]2C1(C)C 587238177 BEZUTWHKCNJHBD-ZGLRSVDFSA-N 417.466 3.421 5 1 HGBF CN1C(=O)C[C@H]2CN[C@](C)(c3cc([N+](=O)[O-])c(SCCO)s3)c3cccc1c32 963037489 VOTPFFWIEJJYQI-WLRWDXFRSA-N 419.528 3.058 5 1 HGBF Cc1nn(CC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c(C)c1[N+](=O)[O-] 587661032 LENFSIQFABKWIJ-UHFFFAOYSA-N 421.388 3.265 5 1 HGBF CCCCNC(=O)[C@H](NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)C(C)C 82082388 WKHSYTLMDKUICG-MRXNPFEDSA-N 404.492 3.389 5 1 HGBF Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 84730130 YJSPMDMKCKGPTH-UHFFFAOYSA-N 405.414 3.480 5 1 HGBF C[C@]1(CN2CCc3nc(-c4ccc(F)cc4)sc3C2)Cn2cc([N+](=O)[O-])nc2O1 1857619488 NVVACMWWZGXZIR-IBGZPJMESA-N 415.450 3.263 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587730374 IOSGWAJFFKOXDX-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF CCCc1cc(=O)c2c(OC)c(OC)c3cc(OS(=O)(=O)O)cc(OC)c3c2o1 13406183 LCYYGMSVWVFMLB-UHFFFAOYSA-N 424.427 3.106 5 1 HGBF biogenic CCOC(=O)c1cc(Br)c2[nH]c([C@H](C)Cn3cc([N+](=O)[O-])cn3)nc2c1 587276305 KIHWGZQZRFJNEP-SECBINFHSA-N 422.239 3.411 5 1 HGBF CCCc1c(O)ccc2c1O[C@](CS(C)(=O)=O)(c1ccc([N+](=O)[O-])cc1)CC2=O 587488913 SNWMBFPFJULQOE-HXUWFJFHSA-N 419.455 3.158 5 1 HGBF COc1cc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2cc1C 587266774 OQMOTDYBXBCREI-BTDLBPIBSA-N 401.379 3.230 5 1 HGBF COc1cc(O)c2c(=O)c3ccc(O)c(C(C)=O)c(=O)c3n(C)c2c1CC=C(C)C 13398259 GBAAKPNKBNCFBH-UHFFFAOYSA-N 409.438 3.183 5 1 HGBF biogenic CN(C)CCCNC(=O)c1ccc(NCCCN(C)C)c2c(O)c3ccccc3nc12 13652288 QTQCFNZAERUTLB-UHFFFAOYSA-N 423.561 3.139 5 1 HGBF N[C@H](Cc1ccc(I)cc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 587184356 AYFVROPVNQIQFJ-GFCCVEGCSA-N 408.199 3.318 5 1 HGBF O=C(NCCO)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4055230 LKWJZXYMLVGINO-NVXWUHKLSA-N 424.240 3.102 5 1 HGBF CCCCOc1ccc2[nH]c3c([N+](=O)[O-])ccc4c3c(nn4CCNCCO)c2c1 27108990 WZKNDZUXRWOSFS-UHFFFAOYSA-N 411.462 3.340 5 1 HGBF CCS(=O)(=O)c1ccc2nc(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])[nH]c2c1 587136998 NWEBPXPLIZAFNG-UHFFFAOYSA-N 406.439 3.349 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4ccnc(Cl)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263441 UKHYGPZZURISMP-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF CC(=O)Oc1ccccc1CN(C(=O)COC(=O)c1ccc([N+](=O)[O-])o1)C(C)(C)C 66252022 BNGKFCDOCNBJMA-UHFFFAOYSA-N 418.402 3.097 5 1 HGBF CCc1ccc2nc(CNS(=O)(=O)c3ccc(SC)c([N+](=O)[O-])c3)[nH]c2c1 586940774 FUXOIXGOHJGTSX-UHFFFAOYSA-N 406.489 3.234 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc3nc(O)[nH]c3cc2[nH]1 587263053 JTOIUUZONQBYSC-VIFPVBQESA-N 411.374 3.404 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587271049 YFPIRJGTLUFUII-NSHDSACASA-N 406.196 3.384 5 1 HGBF CCOC(=O)C[C@]1(Cc2ccccc2[N+](=O)[O-])Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587433137 OUMBMNYYZVLMFV-ZHRRBRCNSA-N 411.410 3.286 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(Cn4ccc([N+](=O)[O-])n4)c1)[C@@H](C2)C3=O 587432045 TZROWAMYAQAEGM-KSFYIVLOSA-N 421.409 3.346 5 1 HGBF C[C@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)OC(C)(C)[C@H](O)C5 299836037 XYWJIADIOMLDJB-RFAUZJTJSA-N 412.438 3.490 5 1 HGBF O=[N+]([O-])c1ccc2nc(CCNS(=O)(=O)c3c(Cl)cccc3Cl)[nH]c2c1 586941908 DFQRNKNDBSFSMH-UHFFFAOYSA-N 415.258 3.299 5 1 HGBF COCCNc1ncc(C(=O)N[C@H]2CCCC[C@H]2C)c(-c2ccc([N+](=O)[O-])cc2)n1 82148350 BZIGGPIHLGZCCD-KDOFPFPSSA-N 413.478 3.419 5 1 HGBF COCCNc1ncc(C(=O)NCC2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 82148446 JPQQOQCSIJXNFN-UHFFFAOYSA-N 413.478 3.420 5 1 HGBF CC[C@H](C(=O)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC)n1cc([N+](=O)[O-])cn1 587868465 LVRQWUGTYAMCSM-CYBMUJFWSA-N 424.339 3.369 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3cc(C(=O)O)c(F)cc3[nH]2)cc([N+](=O)[O-])c1Cl 586927213 UHRGCCCTHITZOC-UHFFFAOYSA-N 413.770 3.032 5 1 HGBF O=C(N[C@H](Cc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)C(=O)O)OCc1ccccc1 587201881 CRNJAEADJXXLCU-CQSZACIVSA-N 418.793 3.047 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587571701 OWTVZDLESKGPLZ-KKSFZXQISA-N 422.324 3.249 5 1 HGBF COc1cc(Cn2c3ccccc3c(=O)c3cc(NC(=O)CN)ccc32)cc(OC)c1 64512989 PVICUQXPSOOLCP-UHFFFAOYSA-N 417.465 3.117 5 1 HGBF CN1c2ccccc2N(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](CC(=O)O)c2cccn21 5811165 CVXRUIOICMNZGV-LJQANCHMSA-N 406.398 3.472 5 1 HGBF O=C(c1cccn2c(=O)c3cc(Cl)ccc3nc12)N1CCN(c2ccccc2)CC1 2957352 KIRSBXXNLCCLMG-UHFFFAOYSA-N 418.884 3.464 5 1 HGBF O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1cc([N+](=O)[O-])ccn1 13587603 LIOKFTMUGRDMBH-UHFFFAOYSA-N 423.337 3.431 5 1 HGBF Nc1ncnc2c1N=C(c1ccc([N+](=O)[O-])cc1)C[C@@H](c1ccc3c(c1)OCO3)N2 40423785 GLVNTUNXRSQYEB-HNNXBMFYSA-N 404.386 3.373 5 1 HGBF CCCCNC(=O)[C@@H]1CCCN1C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82085368 UDCDPOYWZBHTLQ-INIZCTEOSA-N 402.476 3.239 5 1 HGBF CCOC(=O)C1=C(C)N(CCCCCC(=O)O)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 13125828 ULESHOZTGJCHGU-GOSISDBHSA-N 419.434 3.143 5 3 HGBF C[C@@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 36177247 VPGSWVUHTFUCKH-JTQLQIEISA-N 422.375 3.394 5 1 HGBF CC(=O)OCCOc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1O 101474021 KDOYKFCDQDBXGQ-UHFFFAOYSA-O 406.414 3.347 5 1 HGBF CCCCOCCOC(=O)CN(C)C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82085835 TVHONZQKKRQGJG-UHFFFAOYSA-N 421.475 3.150 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587754376 YGSOVYONHSDUQE-QPFGOUBPSA-N 406.211 3.226 5 1 HGBF C[C@@H]1COC2(CCN(c3cc(=O)c4cc(C(F)(F)F)cc([N+](=O)[O-])c4o3)CC2)O1 1857546668 RYDCGMGCUFPPSQ-SNVBAGLBSA-N 414.336 3.452 5 1 HGBF O=c1c2cc(Br)ccc2oc2cc(OCCCO[N+](=O)[O-])cc(O)c12 1857644155 IIKLKXVYZXBAPO-UHFFFAOYSA-N 410.176 3.392 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738365 NONOKKUTWWLIOH-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF CC1(C)C=Cc2c(cc(O)c3c(=O)c4c(C[C@H](O)C(C)(C)O)c(O)ccc4oc23)O1 13412004 BKIZQFZDTGMFFX-KRWDZBQOSA-N 412.438 3.216 5 1 HGBF biogenic C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738241 LTZRSHVHDRYORD-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF COCCCNc1ncc(C(=O)N(C)CC(C)C)c(-c2cccc([N+](=O)[O-])c2)n1 82134450 WAROWSACZULEST-UHFFFAOYSA-N 401.467 3.228 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)[nH]c2cc1[N+](=O)[O-] 587120128 SRJXOLPYYRRIKR-UHFFFAOYSA-N 423.267 3.298 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)n2c(CCc3ccccn3)nc3ccccc32)cc1 26501547 BAZFHTFKXGGOEW-UHFFFAOYSA-N 408.439 3.362 5 1 HGBF Nc1cc(S(=O)(=O)c2ccccc2Br)c([N+](=O)[O-])c2cccnc12 29480756 ZSOSHFABBNJQDE-UHFFFAOYSA-N 408.233 3.321 5 1 HGBF N=c1c(C(=O)Nc2ccccc2)cc2c(=O)n3ccccc3nc2n1Cc1ccccc1 1857639502 NOILSRBPGIDCOF-UHFFFAOYSA-N 421.460 3.429 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587733405 OHJWRXLDAUZEBP-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF CCCCNC[C@H](O)COc1cc(OCC)c2c(=O)c3cccc(OC)c3oc2c1 1772629241 RNICDTQUSFDRAL-HNNXBMFYSA-N 415.486 3.483 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@@H]1CN(N(C)C)CN1C3 72112665 LEOZDJDUQQCSBQ-OAHLLOKOSA-N 407.514 3.495 5 1 HGBF CN(C)C[C@@H](O)COc1ccc(Nc2cc(Nc3ccccc3[N+](=O)[O-])ncn2)cc1 13537892 WWCTWZWHBBXROW-MRXNPFEDSA-N 424.461 3.173 5 1 HGBF COc1cc([C@H]2CC(c3ccc([N+](=O)[O-])cc3)=NC(=S)N2)cc(OC)c1OC 103165068 KUKPWZQNSJMXEI-OAHLLOKOSA-N 401.444 3.429 5 1 HGBF CCOC(=O)C1=C(C)N(CCCCCC(=O)O)C(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 13125829 ULESHOZTGJCHGU-SFHVURJKSA-N 419.434 3.143 5 3 HGBF COCCNc1ncc(C(=O)N[C@@H]2CCCC[C@H]2C)c(-c2ccc([N+](=O)[O-])cc2)n1 82148356 BZIGGPIHLGZCCD-RDTXWAMCSA-N 413.478 3.419 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)N=C(SCCN(C)C)N1 299858982 UTWUFSNHYLOFDE-KRWDZBQOSA-N 406.508 3.116 5 1 HGBF C[C@@H](Oc1ccccc1)C(=O)NCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587225285 PDTNRXXKQIECPA-SNVBAGLBSA-N 419.235 3.317 5 1 HGBF Cn1nc(-c2ccc(C(F)(F)F)cc2)cc1CO[C@@H]1COc2nc([N+](=O)[O-])cn2C1 45256403 OHQUKWPLOJNPMU-AWEZNQCLSA-N 423.351 3.188 5 1 HGBF O=C(CCn1cc([N+](=O)[O-])cn1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587660976 JYHOIESHMJMLNC-UHFFFAOYSA-N 407.361 3.038 5 1 HGBF C[C@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cnc3ccccc3c2[nH]1 587266592 LHKAMQSIJVABDE-DYZYQPBXSA-N 408.374 3.462 5 1 HGBF CN1CCN(c2ccc(Nc3ncc([N+](=O)[O-])c(Nc4ccccc4O)n3)cc2)CC1 52996270 KXFBOEMTWGUZQP-UHFFFAOYSA-N 421.461 3.329 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cc(Cl)ncc4[nH]3)CC2)ccc1[N+](=O)[O-] 587262920 IGQLGPPKPGNLJB-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c([C@@H](C)Cn3cc([N+](=O)[O-])cn3)nc2c1 587276306 KIHWGZQZRFJNEP-VIFPVBQESA-N 422.239 3.411 5 1 HGBF C[C@@]1(COc2ccc(Oc3ccccc3)cc2)Cn2cc([N+](=O)[O-])nc2S1(=O)=O 1772647566 UNGUIPJLKBKHJJ-IBGZPJMESA-N 415.427 3.209 5 1 HGBF O=C1CCc2ccc(c([N+](=O)[O-])c2)Oc2cc(cc(Br)c2O)CCN1 36473343 QXKBFCFPQCDZHM-UHFFFAOYSA-N 407.220 3.460 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2c(S)nc(S)nc2[nH]1 587261303 AQGLMHUBOCECCG-ZETCQYMHSA-N 421.460 3.190 5 1 HGBF CC[C@@H](C(=O)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC)n1cc([N+](=O)[O-])cn1 587868466 LVRQWUGTYAMCSM-ZDUSSCGKSA-N 424.339 3.369 5 1 HGBF C[C@@](N)(c1ccc(S(=O)(=O)O)cc1)c1nc2c3cccnc3c3ncccc3c2[nH]1 586960578 ZXLVBNAICJOXCI-OAQYLSRUSA-N 419.466 3.128 5 1 HGBF N[C@H]1CN(c2cc(-c3cccc([N+](=O)[O-])c3)ncn2)C[C@@H]1c1cc(F)c(F)cc1F 28823846 ROBSCBIJPYHSLD-KDOFPFPSSA-N 415.375 3.400 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc2ccccc12 26381583 CZZNHPRNNMNVIE-CQSZACIVSA-N 414.439 3.412 5 1 HGBF COc1cc2c3c(c1)O[C@](CNC(=O)c1ccc([N+](=O)[O-])cc1)(C(C)C)[C@@H](C2)C3=O 587434706 YVMOIPBCPUWVPR-HTAPYJJXSA-N 410.426 3.176 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587570479 LAGAXUAZFKGVPH-LAUBAEHRSA-N 422.324 3.249 5 1 HGBF CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4081368 OIELNGLIOPIRQE-WMZOPIPTSA-N 417.805 3.157 5 1 HGBF CN1CCN(Cc2c3ccccc3c(CN3CCN(C)CC3)c3ccccc23)CC1 28761902 PACJPSJBGSWVKB-UHFFFAOYSA-N 402.586 3.488 5 1 HGBF CCCc1n[nH]c2c(=O)n(NC(=O)c3ccccc3)c(-c3cccc([N+](=O)[O-])c3)nc12 49035137 KMJNSIORMJVKPS-UHFFFAOYSA-N 418.413 3.031 5 1 HGBF O=C([C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCOCC1 767220 MGOSVBYFBSSCIF-HKUYNNGSSA-N 415.833 3.199 5 1 HGBF C[C@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3ncccc3c2[nH]1 587267306 WVFJBPPEDVVBFI-BTDLBPIBSA-N 408.374 3.462 5 1 HGBF Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)sc(=O)n1Cc1ccc(F)cc1 61904556 ABIZYUOMQLAWMB-UHFFFAOYSA-N 401.419 3.244 5 3 HGBF O=C([C@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCCC1 82085274 CFNWVLSZCTVKJE-QGZVFWFLSA-N 414.487 3.335 5 1 HGBF COc1ccc(NS(=O)(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] 96908643 VTJRPSLMPCFHIO-BQYQJAHWSA-N 424.431 3.042 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1ccc(OCn4ccc([N+](=O)[O-])n4)cc1)[C@@H](C2)C3=O 587431985 SLWRJJWLJUJFBL-KKSFZXQISA-N 407.382 3.325 5 1 HGBF CCCc1c(O)ccc2c1O[C@H](c1ccc(OCC(=O)O)c([N+](=O)[O-])c1)CC2=O 587473207 RCHXVXCDUINIOL-SFHVURJKSA-N 401.371 3.423 5 1 HGBF CCOC(=O)C1=CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(C)cc1 72136560 OTJVYQDACVYQGB-LJQANCHMSA-N 416.455 3.138 5 3 HGBF COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OCC(F)(F)F)[C@@H]1c1cccc([N+](=O)[O-])c1 169723490 SBQMUDOWNMWGOH-UKRRQHHQSA-N 414.336 3.322 5 1 HGBF O=C1/C(=C\c2ccc([N+](=O)[O-])o2)S[C@H]2NC(COc3ccc(Cl)cc3)=NN12 1660320 OTSACXQINMHLAT-MZTACXPWSA-N 406.807 3.037 5 1 HGBF CC(=O)N[C@@H](Cc1nc2cncc([N+](=O)[O-])c2[nH]1)c1ccc(Br)cc1 586985197 LJTKMPFJKRQNMC-LBPRGKRZSA-N 404.224 3.049 5 1 HGBF COc1ccc(-n2nnc(-c3ccccc3NC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1 1772608336 JGHJCDQUKDDVKV-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF Cc1c(C2=C[C@@H](c3ccc([N+](=O)[O-])cc3)NC(=S)N2)nnn1Cc1ccccc1 95580517 IGUOPWBYTXDZSR-KRWDZBQOSA-N 406.471 3.103 5 1 HGBF CC[C@@H](O)CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4049368 FTYIKVXJJHYRDT-BJZITVGISA-N 417.849 3.227 5 1 HGBF COC(=O)C1=C(C)NC(C)=C(C(=O)OCc2ccco2)[C@@H]1c1cccc([N+](=O)[O-])c1 49785578 VKOCSWJPDGDWGJ-LJQANCHMSA-N 412.398 3.339 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Br)cnc2[nH]1 587116976 OAQODTWNDLYUII-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF O=C1[C@H]2CC=CC[C@H]2C(=O)N1c1ccc(NCCc2ccc(O)cc2)c([N+](=O)[O-])c1 100513686 BJRYZTDRHVYPTC-HDICACEKSA-N 407.426 3.411 5 3 HGBF O=C(NCCO)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4206727 OGKUEFYHDIYRHU-WBVHZDCISA-N 424.240 3.102 5 1 HGBF CC(C)[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N1CCCCC1 82082259 SLWIXCUYUSPCNQ-QGZVFWFLSA-N 416.503 3.485 5 1 HGBF O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1c(CO)oc2cc(Br)cnc12 587276677 QVVAMYBVFAMKLV-UHFFFAOYSA-N 422.147 3.130 5 1 HGBF CCCCNC[C@@H](O)COc1cc(OCC)c2c(=O)c3cccc(OC)c3oc2c1 1772629242 RNICDTQUSFDRAL-OAHLLOKOSA-N 415.486 3.483 5 1 HGBF O=C(O)[C@H]1Cc2c(Cl)cc(F)c(F)c2[C@@H](c2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)N1 962956094 BISHORNUJQABKO-MEBBXXQBSA-N 413.720 3.123 5 1 HGBF COc1cc2c3cnc4cc5c(cc4c3c(=O)n(CCN(C)C)c2cc1OC)OCO5 28456242 SHMDFWDMFPPDCM-UHFFFAOYSA-N 421.453 3.010 5 1 HGBF COc1cc(OC)c(/C=C/S(=O)(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 96908642 ZIPLYDKKQIIAAM-BQYQJAHWSA-N 424.431 3.042 5 1 HGBF Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(I)cnc3[nH]2)c1 587262800 XYGPFLCWDQBTIQ-UHFFFAOYSA-N 424.198 3.401 5 1 HGBF Cc1ccc(S(=O)(=O)n2c3ccc([N+](=O)[O-])cc3c(=O)n2Cc2ccccc2)cc1 653708521 WFUUTFQTKHXIAH-UHFFFAOYSA-N 423.450 3.305 5 1 HGBF COc1cccc(OC)c1-c1ccc(CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cc1 45283916 LZFQKAXLEKFAID-INIZCTEOSA-N 411.414 3.453 5 1 HGBF COc1ccc(/C=C(/Cc2cc(OC)c(OC)c(OC)c2)[N+](=O)[O-])cc1[N+](=O)[O-] 84714332 PVSOLVJXSASWHQ-AUWJEWJLSA-N 404.375 3.490 5 1 HGBF O=[N+]([O-])c1ccc(OCc2nc3cc(I)cnc3[nH]2)cc1F 587149339 QXIZIRPVGZMZKQ-UHFFFAOYSA-N 414.134 3.189 5 1 HGBF Cc1c(I)cnn1[C@@H](C)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587182719 RHYNKDLCBDICSW-ZETCQYMHSA-N 415.166 3.329 5 1 HGBF CCOC(=O)[C@@]1(c2ccc([N+](=O)[O-])cc2)N[C@H](C(=O)C(F)(F)F)Cc2ccccc21 962727935 BGVHTDIGYAMTAT-LPHOPBHVSA-N 422.359 3.047 5 1 HGBF CC(=O)OCCOc1ccc2c3ccc4cc5c(cc4c3n(C)cc-2c1=O)OCO5 26381008 KDOYKFCDQDBXGQ-UHFFFAOYSA-N 405.406 3.467 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)N(C(=O)NC(C)C)C(=O)N1 13820415 OAKKHOGCUWAIRH-MRXNPFEDSA-N 404.423 3.005 5 1 HGBF COc1cc(OC[C@@H](O)COC(C)=O)cc2c1c(=O)c1cc3ccccc3cc1n2C 45289828 IIXRYHSOAWKPEX-KRWDZBQOSA-N 421.449 3.156 5 1 HGBF O=[N+]([O-])c1cc(CSc2nnn(Cc3ccc(Cl)cc3)n2)cc([N+](=O)[O-])c1 473135973 MCYSYOZUPHPXMI-UHFFFAOYSA-N 406.811 3.484 5 1 HGBF COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1cc([N+](=O)[O-])cn1 587388799 GNJRGMDDCXQQQB-HXUWFJFHSA-N 408.414 3.445 5 1 HGBF O=C1COc2cc(Br)ccc2N1CCc1nc2ccc([N+](=O)[O-])cc2[nH]1 587002827 ORWLKUWTMNTUSY-UHFFFAOYSA-N 417.219 3.202 5 1 HGBF COc1cc(Br)c([C@H](N)c2nc3cccc([N+](=O)[O-])c3[nH]2)cc1OC 586976020 RTXKXGPTBJVWDI-AWEZNQCLSA-N 407.224 3.299 5 1 HGBF CC(C)(C)OC(=O)N1C[C@H](c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)C(F)(F)C1 587131961 GUQSOYBXDHWDAE-MRVPVSSYSA-N 413.337 3.349 5 1 HGBF COc1cc(Br)cc(C=O)c1OCc1nc2cc([N+](=O)[O-])cnc2[nH]1 586980487 SXKXGOWZHNTOGD-UHFFFAOYSA-N 407.180 3.029 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c(CCCn3ccc([N+](=O)[O-])n3)nc2c1 587273486 BRDCOGAJYKVLSM-UHFFFAOYSA-N 422.239 3.240 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(-n3cccn3)c(F)cc2[nH]1 587116740 CNVHEYDUTFJMMA-UHFFFAOYSA-N 409.303 3.368 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1cccc(OCn4cc([N+](=O)[O-])cn4)c1)[C@@H](C2)C3=O 587434418 UXNPGXWDGYGILK-LAUBAEHRSA-N 407.382 3.325 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3cc(C)c(F)cc3[nH]2)cc1[N+](=O)[O-] 586940599 AXGDNQXQNBNMFG-UHFFFAOYSA-N 410.452 3.119 5 1 HGBF COc1cc2nc(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)[nH]c2cc1OC 587079054 FQLSGDRPSPJWGM-UHFFFAOYSA-N 418.797 3.350 5 1 HGBF Cn1nc([N+](=O)[O-])cc1-c1nc2cc(Br)c(Br)cc2[nH]1 587273546 DQQQFAKVRNNMMB-UHFFFAOYSA-N 401.018 3.397 5 1 HGBF CC(C)(C)OC(=O)Nc1nnc(Cc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)s1 587024351 WTSLUQFGHAYCCT-UHFFFAOYSA-N 410.843 3.914 5 1 HGBF CCOC(=O)Oc1ccc2c(c1)c(=O)c1c(NCCN(CC)CC)ccc3nnn2c31 5582496 ZISQCARNIVGPNG-UHFFFAOYSA-N 423.473 3.123 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3cncc(I)c3)[nH]c2cc1[N+](=O)[O-] 587185300 RMBDTCWOQIBGTF-UHFFFAOYSA-N 411.115 3.046 5 1 HGBF COc1cc([C@@H]2NCCc3cc(C)c(F)cc32)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 962303869 XQPXPPHUOQDBGN-VOJFVSQTSA-N 404.394 3.138 5 1 HGBF CCN(CC)CCn1nc2c3ccc(O)cc3sc3c(NC(=O)CN)ccc1c32 29323079 WYBLACXYHUVXKW-UHFFFAOYSA-N 411.531 3.349 5 1 HGBF Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])[C@@H](C)C(=O)O)c(C)c1 13863138 HPSAUYZMBXCLSF-HNNXBMFYSA-N 406.460 3.184 5 1 HGBF CN(C)C(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 770359 AYLDPEIBDUYUCZ-HKUYNNGSSA-N 416.865 3.494 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)[C@@H]1C[N+](=O)[O-] 587263402 MIOJWGNUGJKZPJ-IWSPIJDZSA-N 406.311 3.273 5 1 HGBF CC1CCN(c2ccc(C(=O)O)cc2NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 201489999 ZGUNZSXMOAZEBW-UHFFFAOYSA-N 419.459 3.330 5 3 HGBF O=C(c1ccccc1)N1CCN(c2nnc(-c3ccc([N+](=O)[O-])s3)s2)CC1 28522474 MJHXQESTGCRKPL-UHFFFAOYSA-N 401.473 3.137 5 1 HGBF CN(C)CCCNC(=O)c1ccc2[nH]c(=O)c3sc4cc([N+](=O)[O-])ccc4c3c2c1 84687619 CNJGXUUBNOHYJK-UHFFFAOYSA-N 424.482 3.486 5 1 HGBF CN(c1ccc([N+](=O)[O-])cc1OCc1ccc(Br)cc1)S(C)(=O)=O 35324013 GOKPQTZLGOFRSS-UHFFFAOYSA-N 415.265 3.332 5 1 HGBF COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](C2)C3=O 587431400 DXARCWWUVMSKGL-LHSJRXKWSA-N 412.398 3.147 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587752857 TWDGQSRUKMPDAG-WNWIJWBNSA-N 406.211 3.226 5 1 HGBF CC(=O)O[C@@H]1c2c(ccc3c(=O)c4ccccc4n(C)c23)OC(C)(C)[C@@H]1OC(C)=O 27546830 HDCLPBWVXYVEFE-FGZHOGPDSA-N 409.438 3.399 5 1 HGBF Nc1ncc(-c2nc3c(Br)cnc(Br)c3[nH]2)cc1[N+](=O)[O-] 587267577 ADPNFLMVJNNVLK-UHFFFAOYSA-N 414.017 3.035 5 1 HGBF COc1cc(OC)c2c(=O)cc(N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)oc2c1 653813193 TWOKPOAQVVUPSY-UHFFFAOYSA-N 411.414 3.045 5 1 HGBF Cc1cc2nc3ccc(C(=O)NCCCCc4ccc[n+](C)c4)cn3c(=O)c2cc1C 27524722 LSGMAVUKHAGTEI-UHFFFAOYSA-O 415.517 3.042 5 1 HGBF C[C@H](Sc1nc(N)cc(O)n1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 586961583 KERHIJZJHQUOTQ-YFKPBYRVSA-N 411.241 3.165 5 1 HGBF O=[N+]([O-])c1ccc2[nH]cc(S(=O)(=O)N3CCN(c4cccc(Cl)c4)CC3)c2c1 15935597 RJERXRUALHYQQU-UHFFFAOYSA-N 420.878 3.240 5 3 HGBF C[C@@H](Cn1cc([N+](=O)[O-])cn1)C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587662260 XVDALRGXBJGREO-ZDUSSCGKSA-N 421.388 3.284 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587752854 TWDGQSRUKMPDAG-CQLKUDPESA-N 406.211 3.226 5 1 HGBF COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OCC(F)(F)F)[C@@H]1c1cccc([N+](=O)[O-])c1 169723491 SBQMUDOWNMWGOH-DZGCQCFKSA-N 414.336 3.322 5 1 HGBF O=[N+]([O-])c1ccc(OCc2cn([C@@H](CO)c3ccccc3)nn2)c(Br)c1 13479056 WYUCFYDHCDGNJM-INIZCTEOSA-N 419.235 3.110 5 3 HGBF O=C(CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)NCCC1=CCCCC1 82084748 GRDGPTQOWIOJND-UHFFFAOYSA-N 414.487 3.455 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(-c3cccc(S(=O)(=O)Nc4ccccc4F)c3)nc2c1 587155739 GEDLVTXPNHVFGR-UHFFFAOYSA-N 413.390 3.473 5 1 HGBF Cc1cc2[nH]c([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)nc2cc1[N+](=O)[O-] 587266615 LSRGTZMFASNSOQ-XXFAHNHDSA-N 416.350 3.130 5 1 HGBF O=C(CCN1CCN2Cc3[nH]c4ccccc4c3C[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] 26749765 QXYZVNBLMDBTOZ-MRXNPFEDSA-N 419.485 3.147 5 1 HGBF O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2nc(-c3ccccc3)ns2)CC1 34837410 QEGUQEWDSPAOAV-UHFFFAOYSA-N 410.459 3.467 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc([N+](=O)[O-])cnc2[nH]1 587263458 MXSVLMGSGDNJDK-VIFPVBQESA-N 401.335 3.126 5 1 HGBF C[C@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(F)cnc(Cl)c2[nH]1 587266939 QOTDPOASIFDYGN-KGFZYKRKSA-N 410.749 3.101 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1cc(OCCCC(=O)O)ccc1[N+](=O)[O-])[C@@H](C2)C3=O 587432281 JCMPYZANTWLTHI-BTYIYWSLSA-N 413.382 3.336 5 1 HGBF O=C(O)[C@H]1Cc2cccc(OC(F)(F)F)c2[C@]2(CCNc3ccc([N+](=O)[O-])cc32)N1 962625477 CLXIOVSYPKIJLY-RDTXWAMCSA-N 423.347 3.152 5 1 HGBF O=C(CSc1nnnn1-c1cc(F)ccc1Cl)Nc1ccccc1[N+](=O)[O-] 34817566 JVEOTAZTQCLXGS-UHFFFAOYSA-N 408.802 3.094 5 1 HGBF O=[N+]([O-])c1ccc(Cc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c([N+](=O)[O-])c1 587265060 RVZQDIPDTRBQKV-UHFFFAOYSA-N 402.676 3.384 5 1 HGBF Cc1ccccc1N1CCN(CCCn2cnc3c(cnc4ccccc43)c2=O)CC1 72108658 UJOHOHUNLAKRNE-UHFFFAOYSA-N 413.525 3.465 5 1 HGBF O=[N+]([O-])c1cccc2nc(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)[nH]c12 586950136 AGWKRZJRWWMGJJ-UHFFFAOYSA-N 415.475 3.403 5 1 HGBF COc1cc([N+](=O)[O-])cc(OC)c1[C@H]1N[C@H](C(=O)C(F)(F)F)Cc2ccccc21 962715020 SQOPEWDZIMLHQX-GUYCJALGSA-N 410.348 3.347 5 1 HGBF CNC(=O)NCCC[n+]1ccc2c(C(=O)OC)c3[nH]c4ccccc4c3c(C)c2c1 169350011 HTSFZIXTNKDGCS-UHFFFAOYSA-O 405.478 3.176 5 1 HGBF O=C(Oc1ccccc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccc([N+](=O)[O-])cc1 1160920 FXUAGKWMODMEET-BZUPMSHVSA-N 404.378 3.126 5 1 HGBF CCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4049549 KUCYLUSPYUOIDA-AZUAARDMSA-N 411.414 3.332 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1cc(-c3ccc(C(F)(F)F)nc3)ccn1)C2 72124383 ZMFISXCFFDSXPI-LBPRGKRZSA-N 407.308 3.107 5 1 HGBF O=[N+]([O-])c1cn2c(n1)[S@@](=O)C[C@H](OCc1ccc(OCc3ccccc3)cc1)C2 40933983 SZJFIYHXCJWTAT-LDLUVENISA-N 413.455 3.077 5 1 HGBF O=C(NCCO)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4055233 LKWJZXYMLVGINO-RDJZCZTQSA-N 424.240 3.102 5 1 HGBF Cc1onc(-c2nc3cc(F)c(C(=O)O)cc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079098 HFIVORZNCLWZKH-UHFFFAOYSA-N 420.744 3.170 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1nn(C)c(C)c1[N+](=O)[O-] 587862975 NTLADHMMSCXNAU-UHFFFAOYSA-N 409.324 3.216 5 1 HGBF O=C(NCc1ccc2c(c1)OCO2)c1cccn2c(=O)c3ccc(Cl)cc3nc12 2957314 WXVFWJDYAPSNEH-UHFFFAOYSA-N 407.813 3.160 5 1 HGBF COC(=O)C1=C(C)NC(C)=C(C(=O)OCc2ccco2)[C@H]1c1cccc([N+](=O)[O-])c1 49785577 VKOCSWJPDGDWGJ-IBGZPJMESA-N 412.398 3.339 5 1 HGBF CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1[nH]nc([N+](=O)[O-])c1Br 587869473 KNHFTMNIGUBRBI-UHFFFAOYSA-N 424.186 3.170 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3c(Cl)c(Br)cnc3[nH]2)[C@H]1C[N+](=O)[O-] 587264749 SMMAJHXMMXZHGZ-CSMHCCOUSA-N 401.648 3.034 5 1 HGBF O=C(O)C[C@@](O)(CSCCCCCCc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O 13758310 YLGDVICWNSZSHH-QGZVFWFLSA-N 419.883 3.375 5 1 HGBF O=C(c1cccc(Cl)c1)N1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)s2)CC1 40864632 CONKNLVBKVEKDC-UHFFFAOYSA-N 419.850 3.322 5 1 HGBF COc1cccc2c1c(=O)c1cc(N)c(N3CCN(c4ccccn4)CC3)cc1n2C 40952328 LSNYNRVGAYRLCP-UHFFFAOYSA-N 415.497 3.004 5 1 HGBF COc1cccc2cc3c(nc12)[C@@](c1cccc([N+](=O)[O-])c1)(c1nccn1C)NCC3 963047371 OJKVSZIGQDNNDT-QHCPKHFHSA-N 415.453 3.323 5 1 HGBF COc1ccc(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)cc1 28898419 FWLJLVJHLRCNGN-UHFFFAOYSA-N 400.483 3.183 5 1 HGBF Cc1cc2nc3ccc(C(=O)NCCCCc4cncnc4)cn3c(=O)c2cc1C 27524464 GAXHRSHQGJGGRV-UHFFFAOYSA-N 401.470 3.007 5 1 HGBF O=C1C[C@@H](c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CN1Cc1ccc(F)cc1F 587149613 NTVOJXSVEWHTDH-SNVBAGLBSA-N 417.328 3.174 5 1 HGBF COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(CCCCCC[N+](C)(C)C)C2 14947224 GHZVENSMPZIZCE-XTJBDQBJSA-N 415.598 3.487 5 1 HGBF NCC1CCC(CNc2nc(NCc3ccccc3[N+](=O)[O-])ncc2[N+](=O)[O-])CC1 28898486 IQMIYYLFUPVURX-UHFFFAOYSA-N 415.454 3.082 5 1 HGBF NC(=O)O[C@H](CCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 95573760 KHHAPFDKHFOVNP-LJQANCHMSA-N 402.426 3.083 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2c(C(=O)OC)ccnc2[nH]1 587266322 ZZJUQMUNHYKCFD-JTQLQIEISA-N 414.374 3.004 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cncc(Br)c2[nH]1 587117017 PWASHUBIKPQTHE-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF CN(c1ccc(-c2csc(-c3ccc(N)c([N+](=O)[O-])c3)n2)cc1)S(C)(=O)=O 587924009 YLYHCXNZZXBGMV-UHFFFAOYSA-N 404.473 3.363 5 1 HGBF C[C@H]1[C@H]2Cc3cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c3[C@]1(C)CCN2C(=O)C1CCCC1 201104946 LRSFEYPXSGIFDS-GZNWPSJOSA-N 403.435 3.450 5 1 HGBF CC(C)(C)N(Cc1cccc([N+](=O)[O-])c1)C(=O)COC(=O)c1ccc([N+](=O)[O-])o1 66252020 ZTHHPLBLYKCGJN-UHFFFAOYSA-N 405.363 3.080 5 1 HGBF NS(=O)(=O)c1ccc(CCc2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1 586930484 URZBNFCSMOBZDU-UHFFFAOYSA-N 403.467 3.092 5 1 HGBF Cc1onc(-c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079782 NMJHJWSMCXZBGD-UHFFFAOYSA-N 403.742 3.241 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c([C@@H](C)n3cc([N+](=O)[O-])cn3)nc2c1 587275323 BWMXKVXGDLDYMU-MRVPVSSYSA-N 408.212 3.216 5 1 HGBF O=[N+]([O-])c1cccnc1N1CCN(CCNc2ccnc3cc(Cl)ccc23)CC1 64560397 FXVBNNZFJGHWAY-UHFFFAOYSA-N 412.881 3.426 5 1 HGBF O=C(CN1C(=O)[C@H]2CC[C@@H](c3ccccc3)C[C@H]2C1=O)Nc1cccc([N+](=O)[O-])c1 17988821 RPHSVRKAPNYPTL-AYOQOUSVSA-N 407.426 3.102 5 1 HGBF CC(=O)Oc1ccc2c(c1)c1cc3c(C(=O)NCCN(C)C)nccc3c(C)c1n2C 2004578 JRUJYMRLANXJNF-UHFFFAOYSA-N 418.497 3.405 5 1 HGBF COc1cc(-c2nnc3ccc(-c4cccc([N+](=O)[O-])c4)nn23)cc(OC)c1OC 1772589170 NZGUGGSRQZPOPF-UHFFFAOYSA-N 407.386 3.392 5 1 HGBF COc1cc(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc(I)c1O 1857646208 LYAFGVATNVYOPY-UHFFFAOYSA-N 411.155 3.457 5 1 HGBF COc1cc2oc3c(oc(=O)c4c(OC)c(OC)ccc43)c(=O)c2c(OC)c1OC 15122222 ABAGAVJIMUKGAJ-UHFFFAOYSA-N 414.366 3.096 5 1 HGBF biogenic COc1cc2c(=O)n(CCN(C)C)c3c4ccc([N+](=O)[O-])cc4ncc3c2cc1OC 27076717 JQMQTPWJWDDUOC-UHFFFAOYSA-N 422.441 3.190 5 1 HGBF O=C(NC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc([C@@H]2CN3CCSC3=N2)c1 29398473 DORQOHYPWLGYTC-INIZCTEOSA-N 411.443 3.016 5 1 HGBF COc1ccc(C2=NO[C@@H](COCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)cc1 45299564 BAFDGNFCMJUYSL-QGZVFWFLSA-N 410.386 3.363 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1cccc(OCn4ccc([N+](=O)[O-])n4)c1)[C@@H](C2)C3=O 587431600 PJTAHNWSKQXFFZ-KKSFZXQISA-N 407.382 3.325 5 1 HGBF CC[C@H](O)CNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4049366 FTYIKVXJJHYRDT-FNHZYXHNSA-N 417.849 3.227 5 1 HGBF COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(F)c([N+](=O)[O-])c2)c(OC)c1 84614514 YPXOYFCFTQWLNU-VOTSOKGWSA-N 411.407 3.345 5 1 HGBF CCOC(=O)C[C@@]1(Cc2ccccc2[N+](=O)[O-])Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587433136 OUMBMNYYZVLMFV-OPAMFIHVSA-N 411.410 3.286 5 1 HGBF COc1ccccc1CNC[C@H](O)COc1cccc2c(=O)c3ccccc3oc12 1857538205 TYLTZWFESLGJOS-KRWDZBQOSA-N 405.450 3.484 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(Br)c(F)c(F)c3[nH]2)[C@@H]1C[N+](=O)[O-] 587263669 NLLVYLPAHLDBSL-GJMOJQLCSA-N 402.195 3.264 5 1 HGBF C[C@@]1(c2ccc(N)c([N+](=O)[O-])c2)N[C@H](C(=O)O)Cc2c(C(F)(F)F)cc(F)cc21 962697026 BAKFSMSOABDHQE-YOEHRIQHSA-N 413.327 3.197 5 1 HGBF COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 84602327 RXDHTZXDHNUQFO-BQYQJAHWSA-N 423.443 3.215 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1cccc(Cl)c1)[C@@H]([N+](=O)[O-])[C@@H]1CSCN12 169322129 VPJKSHAKFFWUBV-MJQMVNBJSA-N 401.875 3.305 5 1 HGBF COc1cc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2cc1C 587266773 OQMOTDYBXBCREI-BMLIUANNSA-N 401.379 3.230 5 1 HGBF CCOC(=O)[C@@H]1C(=O)C[C@@](O)(c2cccc([N+](=O)[O-])c2)C[C@@H]1C=C(Cl)Cl 4011799 BXMYJRYHDYQCFE-GLZQIGESSA-N 402.230 3.260 5 1 HGBF O=C(Nc1cccc(Cl)c1)c1cn(CCO)c2c(cc(O)c3ncccc32)c1=O 103293517 UIHTYGAPMHGATP-UHFFFAOYSA-N 409.829 3.153 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ncc(-c3ccc(C(F)(F)F)cc3)cn1)C2 72125889 RGYAUGBUFXBDAJ-ZDUSSCGKSA-N 407.308 3.107 5 1 HGBF COCCNc1ncc(C(=O)N[C@H]2CCCC[C@@H]2C)c(-c2cccc([N+](=O)[O-])c2)n1 82134882 RYFDGUIYRVMDEA-KSSFIOAISA-N 413.478 3.419 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)N(C(=O)OC(C)C)C(=O)N1 96272040 MSKZFZOPRWQKKK-MRXNPFEDSA-N 405.407 3.432 5 1 HGBF CN1CCc2cn(C)nc2[C@@]1(C[C@H]1CCCC[C@H]1C(=O)O)c1ccccc1[N+](=O)[O-] 963953778 DFJONPZVPXMWIZ-ZDPZECHZSA-N 412.490 3.341 5 1 HGBF CN(C)CCOc1ccc2c3c(c4ccccc4cc13)C(=O)N(CCN(C)C)C2=O 29388380 FVXAPSUTPGIHSL-UHFFFAOYSA-N 405.498 3.091 5 1 HGBF CNS(=O)(=O)c1ccc(CCc2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1 586945676 ABYMFCAOVASWHA-UHFFFAOYSA-N 417.494 3.353 5 1 HGBF CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1cc([N+](=O)[O-])c(OC)n1 587871605 KYABWYICEVXACC-NSHDSACASA-N 403.370 3.103 5 1 HGBF Cc1ccc([N+](=O)[O-])c(OCCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c1 587261895 JOISDPIHKVYEEG-UHFFFAOYSA-N 420.429 3.460 5 1 HGBF O=C1c2cccc3cccc(c23)C(=O)N1CCNCCOc1ccc([N+](=O)[O-])cc1 96928004 CQLRSQNDZWKHPE-UHFFFAOYSA-N 405.410 3.013 5 1 HGBF CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2cc([N+](=O)[O-])c(C)cc2[nH]1 586964996 HGKBXPWDTMIFFC-UHFFFAOYSA-N 412.479 3.236 5 1 HGBF CCOC(=O)C1=CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(C)cc1 199358371 OOVUBHXAJUWUMN-IBGZPJMESA-N 416.455 3.138 5 3 HGBF CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2c(O)nc(S)nc2[nH]1 587053382 DPAFFAFQVDNVRJ-SNVBAGLBSA-N 422.854 3.036 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(C(=O)OC)ncc2[nH]1 587263898 OYDWDSDQQPHNPD-JTQLQIEISA-N 414.374 3.004 5 1 HGBF O=C(N[C@@H](c1ccccc1)[C@@H](O)C(=O)OCc1ccc([N+](=O)[O-])cc1)c1ccccc1 1857546 PVLXPSMDRGNBGA-LEWJYISDSA-N 420.421 3.170 5 1 HGBF CC[C@H](C)n1ncc(I)c1-c1nc2ncc([N+](=O)[O-])cc2[nH]1 587181543 UTRVPBJSKQWODN-ZETCQYMHSA-N 412.191 3.305 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc2c1 587119535 XTMUEUBYYWRAMH-UHFFFAOYSA-N 405.134 3.087 5 1 HGBF CCN(CC)S(=O)(=O)c1ccc2nc(CCc3cccc([N+](=O)[O-])c3)[nH]c2c1 587270275 KZVHVJHBSNPSKW-UHFFFAOYSA-N 402.476 3.287 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1cccc(Cl)c1)[C@H]([N+](=O)[O-])[C@@H]1CSCN12 169322134 VPJKSHAKFFWUBV-DODZYUBVSA-N 401.875 3.305 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 587578292 VVUCEJUNZYUTMW-LAUBAEHRSA-N 404.334 3.110 5 1 HGBF COc1cccc2cc3c(nc12)[C@H](c1coc2ccc([N+](=O)[O-])cc2c1=O)NCC3 963056784 MVAOPVRCKRQJCP-NRFANRHFSA-N 403.394 3.493 5 1 HGBF CCOC(=O)N1CCN(c2ccc([C@H]3CC(c4ccc([N+](=O)[O-])o4)=NO3)cc2)CC1 28961946 RYXHUSLFBJCZEG-GOSISDBHSA-N 414.418 3.332 5 1 HGBF Cc1cc2c(cc1O)[C@](c1c[nH]c3ccc([N+](=O)[O-])cc13)(C1CC1)N[C@H](C(=O)O)C2 963494253 YXVBRJQPEMWPDU-UGKGYDQZSA-N 407.426 3.343 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2cccc([N+](=O)[O-])c2)n1 82135815 BTVBTRPTCKLGBV-HUUCEWRRSA-N 413.478 3.228 5 1 HGBF COc1ccc2c(c1)CC[C@@]2(Cc1cc([N+](=O)[O-])ccc1OC)c1cn(C)c(N)n1 96168402 LOABEFJEEMGKBS-QFIPXVFZSA-N 408.458 3.403 5 1 HGBF CCOc1cc([C@H](C)[N+](=O)[O-])c(OCC)n1-c1c[nH]cc(Br)c1=O 587940746 MHBJOEFNOFWYIJ-VIFPVBQESA-N 400.229 3.063 5 1 HGBF Cc1c(Br)cnc2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc12 587093299 ZNWOWAOHWQXXRY-UHFFFAOYSA-N 405.134 3.363 5 1 HGBF CCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4049548 KUCYLUSPYUOIDA-QUCCMNQESA-N 411.414 3.332 5 1 HGBF Cc1ccc(S(=O)(=O)Nc2c(Cl)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1[N+](=O)[O-] 103194072 DASZOTSCLAWOMZ-UHFFFAOYSA-N 416.755 3.174 5 1 HGBF CC(C)(C)OC(=O)NC1(c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CCC(O)CC1 587237536 SJCHRFBWWSGDHB-UHFFFAOYSA-N 421.410 3.034 5 1 HGBF CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 587268380 UJQKYRIXVTUOLN-UHFFFAOYSA-N 417.369 3.133 5 1 HGBF COc1cc([N+](=O)[O-])cc(OC)c1[C@H]1N[C@@H](C(=O)C(F)(F)F)Cc2ccccc21 962715019 SQOPEWDZIMLHQX-DYVFJYSZSA-N 410.348 3.347 5 1 HGBF C[C@@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)O[C@@H](C(C)(C)O)C5 1772629491 UJMMSIVZESHDCI-BJOHPYRUSA-N 412.438 3.490 5 1 HGBF CCCCOCCOC(=O)[C@H](C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82083695 CFFDMJHROHSKIZ-ZDUSSCGKSA-N 421.475 3.197 5 1 HGBF COC(=O)c1ccc2nc([C@H](C)Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2c1OC 587266369 ZTRCNMIFOCMLMW-VIFPVBQESA-N 415.362 3.348 5 1 HGBF O=[N+]([O-])c1cccc(-n2cc(-c3nc4[nH]c(Cl)nc(C(F)(F)F)c-4n3)nn2)c1 587268845 BOKVCBRGBWMMHR-UHFFFAOYSA-N 410.703 3.133 5 1 HGBF COc1cc([N+](=O)[O-])cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@@H](C)C(=O)O 587390340 PTLIITIQAAIFEE-MGPLVRAMSA-N 416.386 3.052 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587571699 OWTVZDLESKGPLZ-IERDGZPVSA-N 422.324 3.249 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3cc(Br)c(F)c(F)c3[nH]2)[C@H]1C[N+](=O)[O-] 587263670 NLLVYLPAHLDBSL-PRJMDXOYSA-N 402.195 3.264 5 1 HGBF C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587225336 PXHFOTIFGUWWGB-SNVBAGLBSA-N 419.235 3.317 5 1 HGBF COc1ccccc1CNC[C@@H](O)COc1cccc2c(=O)c3ccccc3oc12 1857538206 TYLTZWFESLGJOS-QGZVFWFLSA-N 405.450 3.484 5 1 HGBF COC(=O)[C@H]1CN(Cc2cc3cc4c(cc3c3cc(OC)ccc23)OCO4)CCC1=O 53119587 IJOIEFGPGNDXHQ-FQEVSTJZSA-N 421.449 3.294 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)[C@H]1C[N+](=O)[O-] 587263404 MIOJWGNUGJKZPJ-VGMNWLOBSA-N 406.311 3.273 5 1 HGBF Cc1nc(-c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)sc1C(=O)N1CCC(C)CC1 84690708 AGTYNNFZJCDCDY-UHFFFAOYSA-N 423.516 3.302 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)F)nc3)cc1)C2 66251789 QIVHRNKJBFXYLV-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF CC[C@@H](O)CNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4049367 FTYIKVXJJHYRDT-LJHODMEESA-N 417.849 3.227 5 1 HGBF CN(CC(=O)NCC1CCCCC1)C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82089360 DJDQDCLARJFKFR-UHFFFAOYSA-N 416.503 3.487 5 1 HGBF COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4050099 AGDOXLRJNKUXCK-PKOBYXMFSA-N 417.849 3.493 5 1 HGBF N=c1ccc(-c2ccc(OCc3cccc([N+](=O)[O-])c3)cc2)nn1CCCC(=O)O 169293577 LZTHAJBUMOQDLU-UHFFFAOYSA-N 408.414 3.382 5 1 HGBF O=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1CS(=O)(=O)C3 598906 VHKHMIWKQLSJIU-UHFFFAOYSA-N 401.447 3.489 5 1 HGBF Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 14206965 QOJIBGLDPJSZIP-GOSISDBHSA-N 403.460 3.085 5 3 HGBF Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 84730127 CDYNYONYVRWBDH-UHFFFAOYSA-N 405.414 3.480 5 1 HGBF COC(=O)c1cccc2nc3cc(S(=O)(=O)c4ccccc4[N+](=O)[O-])ccc3nc12 103221378 WGYZXBUMAUCEMW-UHFFFAOYSA-N 423.406 3.311 5 1 HGBF O=[N+]([O-])c1cncc2nc(-c3cccc(S(=O)(=O)Nc4ccccc4F)c3)[nH]c12 587156515 PHZHLRRXXFOFOW-UHFFFAOYSA-N 413.390 3.473 5 1 HGBF Cn1c(=O)nc2n(-c3cc(C(F)(F)F)ccc3Cl)c3ccccc3nc-2c1=O 29484385 ACOARJZUZZTUGF-UHFFFAOYSA-N 406.751 3.256 5 1 HGBF COCCNc1ncc(C(=O)N[C@@H]2CCCC[C@H]2C)c(-c2cccc([N+](=O)[O-])c2)n1 82134885 RYFDGUIYRVMDEA-RDTXWAMCSA-N 413.478 3.419 5 1 HGBF COc1cc([N+](=O)[O-])cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@H](C)C(=O)O 587390337 PTLIITIQAAIFEE-HWPZZCPQSA-N 416.386 3.052 5 1 HGBF O=C1NC(=O)c2c1c1c3ccccc3n3c1c1c2c2ccccc2n1CN(CCO)C3 28763375 WRBLIIGOBVNXSR-UHFFFAOYSA-N 410.433 3.009 5 1 HGBF NCC1CCC(CNc2nc(NCCc3ccc(F)cc3)ncc2[N+](=O)[O-])CC1 28898804 AEZKSDQQNDEHNH-UHFFFAOYSA-N 402.474 3.356 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1-c1nc2ccnc(N)c2[nH]1 586949498 XMNFAXRMXAQXQA-UHFFFAOYSA-N 424.442 3.225 5 1 HGBF CCOC(=O)C1=C(C)N(CCCCCC(=O)O)C(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 13125813 NGVKNCGLGLDVMD-GOSISDBHSA-N 419.434 3.143 5 3 HGBF NS(=O)(=O)c1ccc(CCc2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 586929793 JTSCGIJRARYTIP-UHFFFAOYSA-N 403.467 3.092 5 1 HGBF CC(C)(C)OC(=O)N(Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)C[C@H]1CCCO1 587197486 PPTSUFOHJUOCAP-LLVKDONJSA-N 421.410 3.295 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cc([N+](=O)[O-])cnc3[nH]2)[C@@H]2CCCO[C@@H]2C1(C)C 587238176 BEZUTWHKCNJHBD-VQZRKKFQSA-N 417.466 3.421 5 1 HGBF O=C(O)CCC/C=C\C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[C@H]1F 28229136 TVVCTPSWFFXXSI-NKMVUHFMSA-N 414.455 3.191 5 1 HGBF NC(=O)c1cccc(Nc2ccc(C(=O)c3ccccc3C(=O)O)cc2[N+](=O)[O-])c1 1911575945 SZHOFEQNMYNRNY-UHFFFAOYSA-N 405.366 3.367 5 1 HGBF CN1CCN(c2ccc(C(=O)c3ccc(Br)cc3)cc2[N+](=O)[O-])CC1 4846142 QYJSXKKODPSROV-UHFFFAOYSA-N 404.264 3.340 5 3 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3c(Br)cnc(Cl)c3[nH]2)[C@@H]1C[N+](=O)[O-] 587264040 QNDDZLRZVIHBGH-BWZBUEFSSA-N 401.648 3.034 5 1 HGBF CCOC(=O)C1=C(C)N(CCCCCC(=O)O)C(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 13125814 NGVKNCGLGLDVMD-SFHVURJKSA-N 419.434 3.143 5 3 HGBF O=C(Oc1ccccc1N1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O)c1ccc([N+](=O)[O-])cc1 4845634 FXUAGKWMODMEET-SLDRDFCHSA-N 404.378 3.126 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)F)cn3)cc1)C2 66263480 NJRUJQJTZIKCIN-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF Cc1ccc(C)c(NC(=O)c2cn(CCO)c3c(cc(O)c4ncccc43)c2=O)c1 103288362 HXRYHNMTKBQZKD-UHFFFAOYSA-N 403.438 3.117 5 1 HGBF C[C@]1(COC(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@]2(C)[C@@H]3COC(=O)C3=C[C@@H](O)[C@H]12 2356827485 OJYDAIRJVVQDEZ-XPFWREHLSA-N 415.442 3.038 5 1 HGBF CN(CC(=O)NCC1CCCCC1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085616 ZYKZMYJYBNFALW-UHFFFAOYSA-N 416.503 3.487 5 1 HGBF CCOC(=O)C(=O)c1c(-c2cc(C)cc([N+](=O)[O-])c2O)[nH]c2c(C(=O)O)cccc12 587638448 PXYOYBXVTDJJRJ-UHFFFAOYSA-N 412.354 3.201 5 1 HGBF O=c1cccc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)n1CCOc1ccccc1Cl 587064837 VYKVSAGVNRJPJT-UHFFFAOYSA-N 411.805 3.427 5 1 HGBF COc1cccc(-n2nnc(-c3ccccc3NC(=O)c3ccccc3[N+](=O)[O-])n2)c1 1772583735 GSBCGJUHQGCIQK-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1ccc([N+](=O)[O-])n1 587390874 SDIYQKBOCVUTDQ-LJQANCHMSA-N 408.414 3.445 5 1 HGBF O=C(O)CSc1ncccc1-c1nc2c([N+](=O)[O-])c(Br)ccc2[nH]1 586967356 VDOOKTAVFIRNSR-UHFFFAOYSA-N 409.221 3.472 5 1 HGBF Cc1ccc(S(=O)(=O)N2CCC(c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)CC2)cc1 586954791 ISDXIOALAAHDPW-UHFFFAOYSA-N 418.450 3.487 5 1 HGBF O=C1CC(Nc2ccccc2Nc2ccc(Nc3cccc([N+](=O)[O-])c3)nn2)=NN1 169310460 MCGGBYVPIGXQES-UHFFFAOYSA-N 404.390 3.117 5 1 HGBF COc1cc2nc(C3CCN(c4ccc([N+](=O)[O-])c(C(N)=O)c4)CC3)[nH]c2cc1C 587263333 RPKSREUVAHTWCZ-UHFFFAOYSA-N 409.446 3.271 5 1 HGBF CCOC(=O)c1[nH]c2cccc([N+](=O)[O-])c2c1C(=O)c1cc(C)cc([N+](=O)[O-])c1O 587647628 KTORSWJFNOAHQW-UHFFFAOYSA-N 413.342 3.406 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c([C@@H](C)n3ncc([N+](=O)[O-])c3C)nc2c1 587267368 JNHWLXBCAIVDKR-MRVPVSSYSA-N 408.212 3.134 5 1 HGBF Nc1ccnc2nc(-c3ccc(Cn4cc([N+](=O)[O-])c(C(F)(F)F)n4)cc3)[nH]c12 587119497 XEKLNHKNFYKLIQ-UHFFFAOYSA-N 403.324 3.379 5 1 HGBF O=[N+]([O-])c1c(Br)ccc2nc(-c3cnc4ncnn4c3C(F)F)[nH]c12 587127999 FCMZFEKALFMIHJ-UHFFFAOYSA-N 410.138 3.276 5 1 HGBF CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cccc(I)c2[nH]1 587267830 GOEKFJFCGDRUMP-UHFFFAOYSA-N 411.203 3.444 5 1 HGBF COC(=O)c1cc2[nH]c([C@H](C)Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])nc2cc1OC 587264237 DKIYYSYGKJZPMC-VIFPVBQESA-N 415.362 3.348 5 1 HGBF CC1=C(c2ccc3nc(-c4cc([N+](=O)[O-])ccc4N4CCCC4)[nH]c3c2)NNC(=O)C1 587269348 LSDIBDJDMPREEK-UHFFFAOYSA-N 418.457 3.494 5 1 HGBF O=[N+]([O-])c1c(Cl)c(Cl)c(-c2ccc3c(O)nc(O)nc3n2)c2c1OCCO2 587368447 KFOWFCVINRCGEU-UHFFFAOYSA-N 411.157 3.089 5 1 HGBF COc1ccc([C@H]2CC(c3cc(OC)c(OC)c(OC)c3)=NN2C)cc1[N+](=O)[O-] 49112090 CZAGAXXSQXXGOC-OAHLLOKOSA-N 401.419 3.410 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cncc([N+](=O)[O-])c3[nH]2)[C@@H]2CCCO[C@H]2C1(C)C 587238338 CFAYBSMDFIVZAQ-PLTJGGDTSA-N 417.466 3.421 5 1 HGBF CCOc1cc([C@@H](C)[N+](=O)[O-])c(OCC)n1-c1c[nH]cc(Br)c1=O 587940744 MHBJOEFNOFWYIJ-SECBINFHSA-N 400.229 3.063 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(OC(F)(F)F)c2[C@]2(CCNc3ccc([N+](=O)[O-])cc32)N1 962625469 CLXIOVSYPKIJLY-KBXCAEBGSA-N 423.347 3.152 5 1 HGBF COCCNC(=O)c1cnc(NCC2CCCCC2)nc1-c1ccc([N+](=O)[O-])cc1 82224948 YEVHJFNDEIHKHA-UHFFFAOYSA-N 413.478 3.420 5 1 HGBF Cc1onc(-c2nc3cc([C@H](N)N=O)ccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587078712 AEBZALMPZAJEIJ-CQSZACIVSA-N 416.785 3.056 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3c(Cl)c(Br)cnc3[nH]2)[C@@H]1C[N+](=O)[O-] 587264748 SMMAJHXMMXZHGZ-BWZBUEFSSA-N 401.648 3.034 5 1 HGBF O=C(N[C@@H]1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 13601548 YQXMAJCEFRAMNB-FQEVSTJZSA-N 418.384 3.280 5 1 HGBF O=C(c1cccs1)N1CCN(c2nnc(-c3ccc([N+](=O)[O-])s3)s2)CC1 40873814 HRBMQGWUBWLWLR-UHFFFAOYSA-N 407.502 3.199 5 1 HGBF COc1cccc(-c2nc(O)c3cnn(-c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])c3n2)c1 45334601 VHMBHDSTZJMODJ-UHFFFAOYSA-N 408.330 3.013 5 1 HGBF CS(=O)(=O)c1ccc(Oc2ccc(OCCN3CCCC3)cc2)c([N+](=O)[O-])c1 71297036 FEFBYPFLQSSWCD-UHFFFAOYSA-N 406.460 3.265 5 1 HGBF Cc1oc(CNS(C)(=O)=O)cc1-c1nc2c3cccnc3c3ncccc3c2[nH]1 586945264 CHDWZMCTYNTIJN-UHFFFAOYSA-N 407.455 3.277 5 1 HGBF COCCCNc1ncc(C(=O)N(C)CC(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 82147791 JZKQVNOQCLCKGN-UHFFFAOYSA-N 401.467 3.228 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCCOc1ccc(OCc3ccccc3)cc1)C2 72126001 MBAKDBBFTOLGPJ-IBGZPJMESA-N 411.414 3.227 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc([N+](=O)[O-])ccc1N1CCC(CO)CC1)O2 587388682 GFYQCBCYLMFAPH-OAQYLSRUSA-N 411.458 3.401 5 1 HGBF CCOC(=O)Oc1cc2c(=O)oc3c(OC)c(OC)cc4c(=O)oc(c1OC)c2c34 2356756726 HDQVHVJKBZRASA-UHFFFAOYSA-N 416.338 3.052 5 1 HGBF CC[C@@H](O)CNC(=O)c1c(C(C)(C)C)noc1-c1cc(OC)c(OC)cc1[N+](=O)[O-] 775701 WEIQQHBORCLXEO-LLVKDONJSA-N 421.450 3.065 5 1 HGBF COC(=O)c1ccc2[nH]c(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)nc2c1 587080749 YHHBDCLQCGOTRD-UHFFFAOYSA-N 416.781 3.119 5 1 HGBF CC(C)Nc1ccc([C@@H](CC(N)=O)NC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 13878844 NURVLBKXIYRCTJ-QGZVFWFLSA-N 418.881 3.344 5 3 HGBF O=C1NC(=O)c2ccc([N+](=O)[O-])cc2/C1=C/Nc1ccc(CN2CCCCC2)cc1 42878917 KHUGAARGCBVRQY-MOSHPQCFSA-N 406.442 3.304 5 1 HGBF CS(=O)(=O)C[C@@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 587530655 GIFAQPYMGBPYOJ-OAQYLSRUSA-N 415.467 3.379 5 1 HGBF Nc1ncnc2c1N=C(c1ccc3c(c1)OCO3)C[C@@H](c1ccc([N+](=O)[O-])cc1)N2 45498348 HEZNLJMOBUEHHH-AWEZNQCLSA-N 404.386 3.373 5 1 HGBF Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)c2cc(O)ccc2n1 653850972 GOFZOAAPMINZQL-UHFFFAOYSA-N 421.457 3.161 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4ccc(Cl)nc4[nH]3)CC2)ccc1[N+](=O)[O-] 587263432 UFGWYRYJLTXUJP-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF Cc1cc([N+](=O)[O-])nn1CCC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587661571 QPPOZHREJJXLGR-UHFFFAOYSA-N 421.388 3.346 5 1 HGBF COc1cc2cc(Cn3cc(CCO)nn3)c3cc(OC)c(OC)cc3c2cc1OC 1772642981 TXCXAPWHDVHFPO-UHFFFAOYSA-N 423.469 3.202 5 1 HGBF C[C@@](O)(CSc1ccncc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28022270 QRTIZJPHGRAFQW-OAHLLOKOSA-N 401.366 3.490 5 1 HGBF CCCN(Cc1ccc(OC(F)(F)F)cc1)[C@@H]1COc2nc([N+](=O)[O-])cn2C1 72181623 ZGAFOIAOJRXQJK-ZDUSSCGKSA-N 400.357 3.363 5 1 HGBF O=C1C[C@H](Cc2nc3cc([N+](=O)[O-])cnc3[nH]2)c2c(Br)cccc2O1 587002458 GEECCVUIVWKFMD-QMMMGPOBSA-N 403.192 3.264 5 1 HGBF Cc1cc(N(C)Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c([N+](=O)[O-])cc1F 587137204 SZNYIWOGNSQDBL-UHFFFAOYSA-N 404.314 3.371 5 1 HGBF O=[N+]([O-])c1cc(Br)cc2nc(-c3cnc4ncnn4c3C(F)F)[nH]c12 587128073 GENVLROOSBAFIF-UHFFFAOYSA-N 410.138 3.276 5 1 HGBF O=C(CN1CCN(c2ccc(Cl)c(Cl)c2)CC1)Nc1ncc([N+](=O)[O-])s1 653905163 NGFWLNLDRNXOIJ-UHFFFAOYSA-N 416.290 3.119 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587733407 OHJWRXLDAUZEBP-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@](C)(O)[C@H]2C[C@@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 169349996 JJIVYXXDAPXFLI-XAKZCVKDSA-N 415.442 3.179 5 1 HGBF CSCC[C@H](NS(=O)(=O)c1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 586939189 YRSKZLPNEQIVOU-ZDUSSCGKSA-N 424.479 3.383 5 1 HGBF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@H](c2cc([N+](=O)[O-])c(Br)cc2F)N1 962915293 BTSUOMZWACTIPI-DZGCQCFKSA-N 413.174 3.324 5 1 HGBF COCCOC(=O)C1=C(C)N=C(C)[C@H](C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 169723652 SVMHYHIZWOJKDL-RBUKOAKNSA-N 418.446 3.184 5 1 HGBF COC(=O)C(=O)C[C@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587512942 QAGKFWQVNRLRCR-QHCPKHFHSA-N 423.421 3.467 5 1 HGBF Cn1c(=O)nc2n(-c3ccc(Cl)c(C(F)(F)F)c3)c3ccccc3nc-2c1=O 1619717 OEMJCPVZGMMFRY-UHFFFAOYSA-N 406.751 3.256 5 1 HGBF CC(C)CNC(=O)[C@H](Cc1c[nH]cn1)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 82192161 RINRRFXWDSULDA-INIZCTEOSA-N 414.491 3.237 5 1 HGBF N=C(NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Nc1ccc(Cl)cc1 473149704 KEISPKKAYRRRTM-UHFFFAOYSA-N 402.842 3.127 5 1 HGBF Cc1nn(Cc2ccccc2-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(C)c1[N+](=O)[O-] 587268060 WEDURWRBHRXXBO-UHFFFAOYSA-N 418.413 3.331 5 1 HGBF COC(=O)C(=O)C[C@@]1(c2ccccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587509690 IQEMOEWNEGRWHQ-HSZRJFAPSA-N 423.421 3.467 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(F)cc(Br)c3[nH]2)cc1 586920198 NWIYQIROEDNPMS-UHFFFAOYSA-N 414.212 3.347 5 1 HGBF CCCc1c(O)ccc2c1O[C@H](c1cc([N+](=O)[O-])ccc1S(C)(=O)=O)CC2=O 587490890 ZMLICQHEMYUHMO-KRWDZBQOSA-N 405.428 3.363 5 1 HGBF O=C1C=C[C@]2(C[C@H](OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@H](c3ccccc3)O2)O1 1772648580 FCHAFJRGIGCZMO-VQEKVMFGSA-N 407.378 3.491 5 1 HGBF O=c1c2ccccc2n(CCCCN2CCN(CCO)CC2)c2ccc(Cl)cc12 29037573 IPACPRBPEFWVEK-UHFFFAOYSA-N 413.949 3.198 5 1 HGBF O=C(O)[C@@H]1Cc2c(Cl)cc(F)c(F)c2[C@@H](c2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)N1 962956097 BISHORNUJQABKO-ZUZCIYMTSA-N 413.720 3.123 5 1 HGBF O=C(c1ccccc1)c1c(-c2ccccc2)[nH]n(-c2ccc([N+](=O)[O-])cc2)c(=O)c1=O 102957253 HGTDDTHEHFIGPI-UHFFFAOYSA-N 413.389 3.332 5 1 HGBF CCOC(=O)c1ccc2nc(-c3cc([N+](=O)[O-])c(Cl)c(S(C)(=O)=O)c3)[nH]c2c1 586925745 IMOJDOMEKIKAIH-UHFFFAOYSA-N 423.834 3.372 5 1 HGBF CSCC[C@H](NS(=O)(=O)c1ccccc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 586939157 YJECXQWCJPJIBO-AWEZNQCLSA-N 406.489 3.244 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1ccc(Sc4nncn4C)c([N+](=O)[O-])c1)[C@@H](C2)C3=O 587451591 JZIXFJAABJTFSI-ORAYPTAESA-N 424.438 3.372 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 587578293 VVUCEJUNZYUTMW-UTKZUKDTSA-N 404.334 3.110 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cn1nc(C)c([N+](=O)[O-])c1C 587868663 OCYLEJGCCIMFGG-UHFFFAOYSA-N 424.339 3.034 5 1 HGBF CN(C)CCCNCc1cccc2cc3cccc(CNCCCN(C)C)c3nc12 45283492 XLTKKQKVYROXDE-UHFFFAOYSA-N 407.606 3.471 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cc(F)cc(F)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263662 YSMPWCIYZBDEIP-UHFFFAOYSA-N 401.373 3.232 5 1 HGBF O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3cnc(C(F)(F)F)[nH]c-3n2)CC1 587269737 NLFAUEZNGLEIPD-UHFFFAOYSA-N 420.351 3.251 5 1 HGBF CCCCOCCOC(=O)CN(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085775 MPCUSKDGJVQYFH-UHFFFAOYSA-N 421.475 3.150 5 1 HGBF Cc1nn(C)c(C)c1Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H](C4)[C@@H]3C2=O)cc1[N+](=O)[O-] 104798580 VHPKSXBBZWUYIL-OSLDLMBLSA-N 407.430 3.000 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(C(F)(F)F)nc3)nc1)C2 66259372 YKNVPNUDIMOVGL-ZDUSSCGKSA-N 421.335 3.245 5 1 HGBF O=C(/C=C/C=C/c1ccc2c(c1)OCO2)OCc1cn(-c2cccc([N+](=O)[O-])c2)nn1 299857643 FSXRZRHFOJUMAG-BQJQTIKASA-N 420.381 3.217 5 1 HGBF COC(=O)[C@]1(c2ccc([N+](=O)[O-])cc2)C[C@@H]1CN1CCC(O)(c2ccccc2)CC1 28634756 BBKFUZZJHOHATF-XXBNENTESA-N 410.470 3.009 5 1 HGBF O=C(Nc1ccc(O)c(Sc2ncnc3nc[nH]c23)c1)c1ccc([N+](=O)[O-])cc1 96932740 RVXAWWNVBZLYNU-UHFFFAOYSA-N 408.399 3.370 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2c(S)nc(S)nc2[nH]1 587261302 AQGLMHUBOCECCG-SSDOTTSWSA-N 421.460 3.190 5 1 HGBF C[N+]1(CCCNC(=O)c2cnc3c4c(cccc24)-c2ccccc2C3=O)CCOCC1 43020000 XGJSXQCQULMBCN-UHFFFAOYSA-O 416.501 3.043 5 1 HGBF O=C1C(=O)N(Cc2ccco2)[C@@H](c2cccs2)[C@@H]1C(=O)c1cccc([N+](=O)[O-])c1 169690296 ZRMNIEZDAHTATG-SJORKVTESA-N 410.407 3.401 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(I)cc2[nH]1 587271071 ZFWMGPQYUSUCMJ-LBPRGKRZSA-N 408.199 3.318 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)Cn1cc([N+](=O)[O-])cn1 587868388 KAQYZQUJXXMSPG-JTQLQIEISA-N 424.339 3.054 5 1 HGBF O=C1NC(=O)c2c1c1c3ccccc3n3c1c1c2c2ccccc2n1[C@@H]1COC[C@H]3N1 27557789 MGMNDPRNDCWSMZ-IYBDPMFKSA-N 408.417 3.417 5 1 HGBF COc1ccc(C2=NO[C@H](COCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)cc1 45299562 BAFDGNFCMJUYSL-KRWDZBQOSA-N 410.386 3.363 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@@H](c2ccccc2)[N@+](C)([O-])C1 299804664 SDIAALDEQNWSDC-NTKDMRAZSA-N 405.495 3.252 5 1 HGBF CCCc1c(O)ccc2c1O[C@@](C)(/C(=C/N(C)C)n1cc([N+](=O)[O-])cn1)CC2=O 587471809 VLEFDPYISGVRRJ-JKALPCAWSA-N 400.435 3.234 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc([N+](=O)[O-])ccc1O 587868097 GLGNMQCIVNOKFM-UHFFFAOYSA-N 408.292 3.275 5 1 HGBF O=C1C[C@@H](Cc2nc3cc([N+](=O)[O-])cnc3[nH]2)c2c(Br)cccc2O1 587002457 GEECCVUIVWKFMD-MRVPVSSYSA-N 403.192 3.264 5 1 HGBF C[C@@](O)(CSc1cccnc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28022451 FXGRALPMMWXPTF-OAHLLOKOSA-N 401.366 3.490 5 1 HGBF O=C(NCc1cccc(N2CCN(Cc3ccccc3)CC2)c1)c1ccc([N+](=O)[O-])o1 95606417 BDSUHIDXJANYOY-UHFFFAOYSA-N 420.469 3.440 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3cc4c(cc3[nH]2)OCCCO4)cc([N+](=O)[O-])c1Cl 586926426 PDFMMMATIJYAIN-UHFFFAOYSA-N 423.834 3.356 5 1 HGBF COc1cc2c(cc1OC)C(=O)[C@@H]([C@H](O)C1CC[N+](C)(Cc3ccccc3)CC1)C2 38142504 IBATXZHEHNSLNL-ORNXHASESA-N 410.534 3.477 5 1 HGBF CCOC(=O)c1cc(-c2ccccc2)nn1C[C@H](O)COc1ccccc1[N+](=O)[O-] 40754062 SUCVPYVQFYCKKB-INIZCTEOSA-N 411.414 3.075 5 1 HGBF COC(=O)c1ccnc2[nH]c(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)nc12 587268284 ZZUHLSWXNSOJKC-UHFFFAOYSA-N 406.402 3.181 5 1 HGBF C[C@]1(COC(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@]2(C)[C@H]3COC(=O)C3=C[C@@H](O)[C@@H]12 1857633128 OJYDAIRJVVQDEZ-PEVTXAFISA-N 415.442 3.038 5 1 HGBF COC(=O)[C@@H]1CN(Cc2cc3cc4c(cc3c3cc(OC)ccc23)OCO4)CCC1=O 53119586 IJOIEFGPGNDXHQ-HXUWFJFHSA-N 421.449 3.294 5 1 HGBF CCOC(=O)c1[nH]c2cc([N+](=O)[O-])ccc2c1C(=O)c1cc(C)cc([N+](=O)[O-])c1O 587647654 LHECIUNDPCBYOP-UHFFFAOYSA-N 413.342 3.406 5 1 HGBF C[C@@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1cccc2ccccc12 13840047 OLYLZZQOHLJXFS-AWEZNQCLSA-N 414.439 3.412 5 1 HGBF CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4211390 GRNGRADFUBMVFX-FUHWJXTLSA-N 417.805 3.157 5 1 HGBF COC(=O)C(=O)C[C@]1(c2ccccc2[N+](=O)[O-])CC(=O)c2ccc3c(c2O1)CCCC3 587509696 IQEMOEWNEGRWHQ-QHCPKHFHSA-N 423.421 3.467 5 1 HGBF COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCOCC4)c([N+](=O)[O-])c1)[C@@H](C2)C3=O 587432688 KTPVUFXACGFLCA-AOMKIAJQSA-N 410.426 3.103 5 1 HGBF O=C(CNc1ccccc1[N+](=O)[O-])Nn1c(-c2ccccc2)nc2ccccc2c1=O 5593760 MREDQICLGDKZIF-UHFFFAOYSA-N 415.409 3.154 5 1 HGBF CC1(C)C=Cc2c(c3c(CN4CCOCC4)cc(=O)oc3c3cc([N+](=O)[O-])oc23)O1 169342963 VHWQXURHYIMWHJ-UHFFFAOYSA-N 412.398 3.464 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587271054 YLTMZJILEYOMDY-NSHDSACASA-N 406.196 3.384 5 1 HGBF O=[N+]([O-])c1cc(CSc2nnnn2Cc2ccc(Cl)cc2)cc([N+](=O)[O-])c1 473134038 BEODHKZVZSEEBM-UHFFFAOYSA-N 406.811 3.484 5 1 HGBF O=C(N[C@@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 33819163 SMVIJKKEWFATTJ-FQEVSTJZSA-N 400.394 3.140 5 1 HGBF COc1cc([N+](=O)[O-])cc(OC)c1[C@@H]1N[C@@H](C(=O)C(F)(F)F)Cc2ccccc21 962715018 SQOPEWDZIMLHQX-CXAGYDPISA-N 410.348 3.347 5 1 HGBF Cc1cc(S(N)(=O)=O)ccc1OCc1nc2c3cccnc3c3ncccc3c2[nH]1 586929609 FVPBOZMVWQTICO-UHFFFAOYSA-N 419.466 3.194 5 1 HGBF Cc1cc2c(cc1N1C(=O)c3cccc4cc([N+](=O)[O-])cc(c34)C1=O)n(C)c(=O)n2C 1772638650 XWUSNMULJMQCCC-UHFFFAOYSA-N 416.393 3.047 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)F)cc3)nc1)C2 66252281 QPDHPOAQHQWYCL-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF CCOC(=O)/C(=C/c1ccccc1)CN1C(=O)[C@@H](OC)[C@H]1c1cccc([N+](=O)[O-])c1 1772609799 BEBJETJXXTXWHG-NPJZFRQBSA-N 410.426 3.140 5 1 HGBF C[C@@](O)(C[S@](=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28015918 SMQYNPMQOPFYTJ-WVDZOPJMSA-N 416.377 3.111 5 1 HGBF CC(C)[C@@H](NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)C(=O)N1CCCCC1 82082415 NYYYFCJXPYNGMO-QGZVFWFLSA-N 416.503 3.485 5 1 HGBF O=Cc1cn2c3c1ccc1c4ccccc4n(c13)C[C@H](OCCN1CCOCC1)C2 473154745 LDNGCIKJNBLDQE-GOSISDBHSA-N 403.482 3.293 5 1 HGBF C[C@]1(COC(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@]2(C)[C@@H]3COC(=O)C3=C[C@H](O)[C@@H]12 2356827483 OJYDAIRJVVQDEZ-LIRZLWQOSA-N 415.442 3.038 5 1 HGBF CCCC[C@H](CC)C(=O)OC[C@@]1(CO)C/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O1 45498276 AQWODVHYXIDBMB-CJHJKDEHSA-N 405.447 3.416 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2c(Br)ccnc2[nH]1 587117467 SIVXORDAOSEQOI-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1cccc(-c3ccc(C(F)(F)F)nc3)n1)C2 72125884 MVROXWWRVJGHBT-NSHDSACASA-N 407.308 3.107 5 1 HGBF C[C@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cnc3ccccc3c2[nH]1 587266401 LHKAMQSIJVABDE-BTDLBPIBSA-N 408.374 3.462 5 1 HGBF COCCNc1ncc(C(=O)N[C@H]2CCCC[C@@H]2C)c(-c2ccc([N+](=O)[O-])cc2)n1 82148353 BZIGGPIHLGZCCD-KSSFIOAISA-N 413.478 3.419 5 1 HGBF CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 586935788 GLUOBQMEPGBNBA-CQSZACIVSA-N 409.855 3.195 5 1 HGBF O=C1NC(=O)c2c1c1c3ccccc3n3c1c1c2c2ccccc2n1CS(=O)(=O)C3 835649 NOMBLRXWYRUHNI-UHFFFAOYSA-N 415.430 3.129 5 1 HGBF Cc1ccc(Cl)cc1-n1nnnc1SCC(=O)Nc1ccccc1[N+](=O)[O-] 34817564 KEQZZMAHNDFXDZ-UHFFFAOYSA-N 404.839 3.263 5 1 HGBF COc1ccc(-c2nc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cs2)cc1F 45261003 OJPQOSUENDVGTE-LBPRGKRZSA-N 406.395 3.040 5 1 HGBF O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(Br)cc(C(=O)O)c2[nH]1 587270476 ZGYVQAVNLDKLBZ-UHFFFAOYSA-N 420.175 3.323 5 1 HGBF Nc1ncnc2c1N=C(c1ccc3c(c1)OCO3)C[C@H](c1ccc([N+](=O)[O-])cc1)N2 45498350 HEZNLJMOBUEHHH-CQSZACIVSA-N 404.386 3.373 5 1 HGBF Cc1ccc(OCCCOc2ccc3c(O)c([N+](=O)[O-])c(=O)oc3c2)c([N+](=O)[O-])c1 141823448 DOQAAFROJULWGE-UHFFFAOYSA-N 416.342 3.471 5 1 HGBF O=[N+]([O-])c1ccc(OCc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1F 587149510 UGWHLMHZOWADQI-UHFFFAOYSA-N 419.312 3.483 5 1 HGBF C[C@]1(COc2ccc(-c3ccc(F)nc3F)cn2)CCn2cc([N+](=O)[O-])nc2O1 1772599002 ZITJTYCKPMAMOZ-GOSISDBHSA-N 403.345 3.147 5 1 HGBF Cc1nc(NS(C)(=O)=O)sc1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 586951225 LDJZUCACAHEUFR-UHFFFAOYSA-N 410.484 3.463 5 1 HGBF C[C@](N)(c1ccc(S(=O)(=O)O)cc1)c1nc2c3cccnc3c3ncccc3c2[nH]1 586960573 ZXLVBNAICJOXCI-NRFANRHFSA-N 419.466 3.128 5 1 HGBF O=C1c2ccccc2C(=O)N1CCOC(=S)Nc1ccc([N+](=O)[O-])cc1Cl 42888671 XAHMXIYVOQCSBN-UHFFFAOYSA-N 405.819 3.258 5 1 HGBF N[C@@H](CCc1nc2cccc(OC(F)(F)F)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587271074 ZLHDFNZTKZUYAZ-LBPRGKRZSA-N 423.351 3.268 5 1 HGBF CCCCOC(=O)[C@@]1(O)Cc2c3c4c(c(O)ccc4c4ccc(O)c(c24)O1)C(=O)CC3 2356323748 NAZJNVRQXMZSIG-XMMPIXPASA-N 422.433 3.500 5 1 HGBF C[C@](O)(CSc1cccnc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28022456 FXGRALPMMWXPTF-HNNXBMFYSA-N 401.366 3.490 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 82149874 JRYDJYNMXSRUPU-GASCZTMLSA-N 413.478 3.228 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)C(C(=O)OC(C)C)=C(N)O1 96272044 CJAYJOPOFLZZNK-MRXNPFEDSA-N 404.419 3.056 5 1 HGBF Cc1c(C(=O)CSc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(=O)n(-c2ccccc2)n1C 12999104 ZMLCCAFPWXODOB-UHFFFAOYSA-N 423.454 3.244 5 1 HGBF O=[N+]([O-])c1cncc2nc(-c3sccc3S(=O)(=O)NCc3cccs3)[nH]c12 586946955 WRJSCFJJISDRCT-UHFFFAOYSA-N 421.485 3.135 5 1 HGBF N[C@@H](Cc1ccc(I)cc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 587184375 AYFVROPVNQIQFJ-LBPRGKRZSA-N 408.199 3.318 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Sc3nncn3C)c([N+](=O)[O-])c1)O2 587409063 GADJBSNHYZSIIC-INIZCTEOSA-N 411.443 3.472 5 1 HGBF O=C(NCc1ccc(Br)cc1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 35323426 GNRLVIXBURCFHL-UHFFFAOYSA-N 402.204 3.338 5 1 HGBF O=[N+]([O-])c1cc2nc(CNS(=O)(=O)c3ccc(F)c(F)c3F)[nH]c2cc1Cl 587134992 ZHOAJWRPTCHKAW-UHFFFAOYSA-N 420.756 3.020 5 1 HGBF O=[N+]([O-])c1cc2[nH]c(-c3cccnc3S(=O)(=O)C(F)(F)F)nc2cc1Cl 587127203 OJSMQZORKKFQEY-UHFFFAOYSA-N 406.729 3.480 5 1 HGBF O=C(NOCc1ccc([N+](=O)[O-])cc1)c1cc(Br)c(Br)[nH]1 71341867 OYLMBMALGFKNMH-UHFFFAOYSA-N 419.029 3.310 5 1 HGBF Cc1cc2[nH]c(-c3cc([N+](=O)[O-])c(Cl)c(S(C)(=O)=O)c3)nc2cc1[N+](=O)[O-] 586928187 YYEDOIOEZHRNOY-UHFFFAOYSA-N 410.795 3.412 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4079811 AYLDPEIBDUYUCZ-MJGOQNOKSA-N 416.865 3.494 5 1 HGBF CN(C)CCCNC(=O)c1ccc(NCCCN(C)C)c2cc3ccccc3nc12 27525367 KZLNARNIAYYNCR-UHFFFAOYSA-N 407.562 3.433 5 1 HGBF Cc1ccc2ncc3c(=O)n(CCCN4CCN(c5ccccc5)CC4)cnc3c2c1 72108002 XMRQHFQAHXHILR-UHFFFAOYSA-N 413.525 3.465 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587753397 VQPBUQWRPLNGAX-RBHXEPJQSA-N 406.211 3.226 5 1 HGBF O=[N+]([O-])c1cncc2nc(CCC[S@](=O)c3ccc(Br)cc3)[nH]c12 586961288 UFDDNKCEPRAHJF-DEOSSOPVSA-N 409.265 3.369 5 1 HGBF N[C@@H](CCc1nc2cccc(Br)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587269883 GBUAEZJSIDBNMU-ZDUSSCGKSA-N 418.251 3.132 5 1 HGBF COc1ccc(NC(=O)c2cn(CCO)c3c(cc(Cl)c4ncccc43)c2=O)cc1 103293444 DAXJHHGKVRNIMS-UHFFFAOYSA-N 423.856 3.456 5 1 HGBF O=C(O)[C@@H]1Cc2c(Cl)cc(F)c(F)c2[C@H](c2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)N1 962956092 BISHORNUJQABKO-BONVTDFDSA-N 413.720 3.123 5 1 HGBF Cc1c2c3cc(NC(=O)[C@@H]4CCCN4C(=O)CN)ccc3nc-2n(C)c2ccccc12 103031546 NPCGKSLCKZBRDF-FQEVSTJZSA-N 415.497 3.028 5 1 HGBF Cn1cc(C2=C(c3cn(C)c4c([N+](=O)[O-])cccc34)C(=O)NC2=O)c2ccccc21 13447797 SAIYYNBLXZAZSN-UHFFFAOYSA-N 400.394 3.145 5 1 HGBF CN(C)CCNc1ccc2c3c(c4ccccc4cc13)C(=O)N(CCN(C)C)C2=O 29392110 YQNKITKMOLERFY-UHFFFAOYSA-N 404.514 3.124 5 1 HGBF COc1cc2[nH]c(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)nc2cc1F 587080546 WISFMUBHPKSOBG-UHFFFAOYSA-N 406.761 3.480 5 1 HGBF CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 586935787 GLUOBQMEPGBNBA-AWEZNQCLSA-N 409.855 3.195 5 1 HGBF Cc1ncc([N+](=O)[O-])n1CCOc1ccc(O)n1-c1c(N)cccc1Br 587936673 XEBNJBODKDZIFW-UHFFFAOYSA-N 422.239 3.020 5 1 HGBF C[C@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(F)c(F)c(F)c2[nH]1 587264301 LBHXUWWZIQPQBI-MDAAJZPYSA-N 411.296 3.331 5 1 HGBF O=C(O)CCCCC[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccnc1 13730227 QQXUFJHFJYXWOJ-INIZCTEOSA-N 421.475 3.087 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cc([N+](=O)[O-])cnc3[nH]2)[C@H]2CCCO[C@H]2C1(C)C 587238172 BEZUTWHKCNJHBD-HKMRUAMVSA-N 417.466 3.421 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(C(F)(F)F)cc3)nn1)C2 66258693 NZDKAMYKPQLHJD-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF COc1cccc(C(=O)NCCCCN2CCc3ccc([N+](=O)[O-])cc3C2)c1OC 73197903 SZXBLJBNZGUFEH-UHFFFAOYSA-N 413.474 3.180 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587733410 OHJWRXLDAUZEBP-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF Cc1cc2[nH]c([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)nc2cc1[N+](=O)[O-] 587266612 LSRGTZMFASNSOQ-ABKXIKBNSA-N 416.350 3.130 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587730378 IOSGWAJFFKOXDX-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF COC(=O)c1cccc2nc3cc(S(=O)(=O)c4ccc([N+](=O)[O-])cc4)ccc3nc12 103221374 DJWISEOFVHXBBI-UHFFFAOYSA-N 423.406 3.311 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3c(Br)cnc(Cl)c3[nH]2)[C@H]1C[N+](=O)[O-] 587264043 QNDDZLRZVIHBGH-PRJMDXOYSA-N 401.648 3.034 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cc([N+](=O)[O-])cnc3[nH]2)[C@H]2CCCO[C@@H]2C1(C)C 587238174 BEZUTWHKCNJHBD-SIFORAMQSA-N 417.466 3.421 5 1 HGBF N[C@@H](CCc1nc2cc(Cl)c(F)c(F)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587270514 LHHHIHSWKLSEED-NSHDSACASA-N 409.780 3.301 5 1 HGBF CCN(CC)c1nc(=Nc2cccc([N+](=O)[O-])c2)nc(OCC(F)(F)C(F)F)[nH]1 1772610640 NOVSXRLYPRKYBY-UHFFFAOYSA-N 418.351 3.071 5 1 HGBF CCCCOC(=O)[C@]1(O)Cc2c3c4c(c(O)ccc4c4ccc(O)c(c24)O1)C(=O)CC3 2356323747 NAZJNVRQXMZSIG-DEOSSOPVSA-N 422.433 3.500 5 1 HGBF CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccc([N+](=O)[O-])cc3)O[C@H]2[C@@H]1OC 28571680 AFQRXDSLVGRGJI-ZWJPJJENSA-N 401.415 3.179 5 1 HGBF O=[N+]([O-])c1cn2c(n1)[S@](=O)C[C@@H](OCc1ccc(OCc3ccccc3)cc1)C2 40933986 SZJFIYHXCJWTAT-YRVHBCJASA-N 413.455 3.077 5 1 HGBF CCCc1c(O)ccc2c1O[C@@H](c1cc([N+](=O)[O-])ccc1OCC(=O)O)CC2=O 587472921 OMNMOICEEPFDMP-GOSISDBHSA-N 401.371 3.423 5 1 HGBF COC(=O)c1ccc2nc3n(C)c4ccc(C(=O)OC)cc4c(NCCCN)c-3c2c1 103142078 FRAJYPYBGNELQJ-UHFFFAOYSA-N 420.469 3.165 5 1 HGBF CC(=CCC[C@](C)(Cl)[C@@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@H](O)C(C)(C)O 2356828321 CAJMFLABBNVXCD-BXWFABGCSA-N 402.919 3.462 5 1 HGBF O=C(NO[C@H]1CCCCO1)c1ccc(Sc2ccc([N+](=O)[O-])c3nonc23)cc1 299828724 SQTNQISEVXUUSS-HNNXBMFYSA-N 416.415 3.470 5 1 HGBF COc1cc2c(=O)n(CC(=O)OC(C)(C)C)c3c4ccnc-4[nH]cc3c2cc1OC 1857774482 VVRSLTJSLHFPRE-UHFFFAOYSA-N 409.442 3.342 5 1 HGBF Cn1c2ccccc2c2c(=O)n(CCCC(=O)O)c3c(-c4ccccc4)nnn3c21 29054787 JJONKYDLCUIBQO-UHFFFAOYSA-N 401.426 3.068 5 1 HGBF Cc1nc2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc2cc1Br 587092032 LFJXVGYYJKBLJH-UHFFFAOYSA-N 405.134 3.363 5 1 HGBF O=C1CCc2cc3nc(C4CCN(C(=O)c5ccc([N+](=O)[O-])cc5)CC4)[nH]c3cc2N1 587271010 WOIHBZLBMDSACQ-UHFFFAOYSA-N 419.441 3.376 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCn1cc([N+](=O)[O-])cn1 587863226 VMLWEZAGTFVLRX-UHFFFAOYSA-N 409.324 3.413 5 1 HGBF COc1ccc(CNc2ccccc2C(N)=O)c2nc3cccc(C(=O)O)c3nc12 473153322 AITTUGLNHIAIHC-UHFFFAOYSA-N 402.410 3.201 5 1 HGBF COc1cc2c(cc1OC)C[N@@+](C)(CCCCCc1cccc(OC)[n+]1C)CC2 299844631 MBZYGGWJVSHAQB-SANMLTNESA-N 400.563 3.453 5 1 HGBF O=C(COc1ccccc1)N1CCCC[C@@H]1c1nc(-c2cccc([N+](=O)[O-])n2)no1 299857635 OERSEVXWFSJGPY-MRXNPFEDSA-N 409.402 3.172 5 1 HGBF Nc1ccc(-c2ccc3nc(CS(=O)(=O)c4ccc([N+](=O)[O-])cc4)[nH]c3c2)cc1N 586919815 HWZFOJPQRGOMQB-UHFFFAOYSA-N 423.454 3.276 5 1 HGBF Cc1cc2[nH]c([C@H](C)n3ncc(I)c3C)nc2cc1[N+](=O)[O-] 587181773 CLEHNPBIJCOWNV-VIFPVBQESA-N 411.203 3.498 5 1 HGBF CS(=O)(=O)Nc1ccc([N+](=O)[O-])cc1OCc1ccc(Br)cc1 35324666 ZJHDHIFNJKSKJN-UHFFFAOYSA-N 401.238 3.308 5 1 HGBF COc1cc(Br)c([C@H](N)c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc1OC 586976714 XERNEUQTECDRII-HNNXBMFYSA-N 407.224 3.299 5 1 HGBF C[C@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)O[C@@H](C(C)(C)O)C5 1772629493 UJMMSIVZESHDCI-RFAUZJTJSA-N 412.438 3.490 5 1 HGBF CC(C)(C)n1ncc(OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(Cl)c1=O 38245737 IAFDBENTUFCXMO-UHFFFAOYSA-N 405.798 3.189 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2cccc([N+](=O)[O-])c2)n1 82135814 BTVBTRPTCKLGBV-GJZGRUSLSA-N 413.478 3.228 5 1 HGBF Cc1cccn2c(=O)c3cc(C(=O)O)c(=N)n(CCc4ccc(Cl)cc4)c3nc12 1857621093 JMEIGSCVRMLNBC-UHFFFAOYSA-N 408.845 3.031 5 1 HGBF COCCCNC(=O)c1cnc(NCc2ccccc2)nc1-c1cccc([N+](=O)[O-])c1 82134813 OCOGBLZTJJLZSZ-UHFFFAOYSA-N 421.457 3.430 5 1 HGBF O=C1Nc2ccc([N+](=O)[O-])cc2/C1=C\c1ccc(CN2C(=O)C(=O)c3ccccc32)o1 95560978 ZZUNBVYVKMTVKF-LICLKQGHSA-N 415.361 3.410 5 1 HGBF COc1cc2cc(Cn3cc(CO)nn3)c3cc(OC)c(OC)cc3c2cc1OC 1772588039 MHMSVHATEQTSBM-UHFFFAOYSA-N 409.442 3.160 5 1 HGBF COc1ccc(CS(=O)(=O)/C=C/c2ccc(OC)c(OC)c2OC)cc1[N+](=O)[O-] 71416551 WBRCWMSVRVHOAL-MDZDMXLPSA-N 423.443 3.215 5 1 HGBF O=[N+]([O-])c1cccc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c12 586946456 YIMKLHTUTGKSNA-UHFFFAOYSA-N 404.429 3.271 5 1 HGBF O=C(Cc1ccccc1)NCCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587229002 XKFVNEVEZVOGOT-UHFFFAOYSA-N 403.236 3.135 5 1 HGBF COc1cc2c(c3c1c(=O)c1cc4ccccc4cc1n3C)[C@@H](O)[C@@H](O)C(C)(C)O2 26474755 ZRRQKGZERAWFAN-DHIUTWEWSA-N 405.450 3.419 5 1 HGBF CN(C)S(=O)(=O)c1cccc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 587270163 RBDSLKZKFCOVQI-UHFFFAOYSA-N 423.454 3.450 5 1 HGBF O=C(Cn1c2ccccc2c2nc3ccccc3nc21)OCCCN1CCOCC1 1772643223 IMCAUPSSRBZXQF-UHFFFAOYSA-N 404.470 3.003 5 1 HGBF O=[N+]([O-])c1cn2c(n1)O[C@H](COc1ccc(-c3ccc(C(F)(F)F)nc3)cn1)CC2 1772616974 RCUJHSDDIRIWGO-ZDUSSCGKSA-N 421.335 3.497 5 1 HGBF Cc1cc(C)c2c(=O)c3ccccc3n(CCCCN3CCN(CCO)CC3)c2c1 103273145 ZWEJQZRFHRJNTI-UHFFFAOYSA-N 407.558 3.162 5 1 HGBF O=C1NCc2c1c1c3ccccc3n3c1c1c2c2cc(CO)ccc2n1C[C@H](CO)C3 28819512 YBOHKHOOGLAEEN-CQSZACIVSA-N 411.461 3.260 5 1 HGBF O=C(c1ccccc1Cl)N1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)s2)CC1 40863587 WOJBLSKXQYGVGK-UHFFFAOYSA-N 419.850 3.322 5 1 HGBF COc1ccc(-n2nnc(-c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 299852343 QONKIYDRXVUBPV-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cncc(Cl)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263342 RUBBQUBDVJUMGF-UHFFFAOYSA-N 400.826 3.002 5 1 HGBF COc1cc(N)c(I)cc1-c1nc2cccc([N+](=O)[O-])c2[nH]1 587178846 NECXFVIAXSETEP-UHFFFAOYSA-N 410.171 3.334 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cccc(I)c2[nH]1 587265189 MGMKZCMKKLALOW-JTQLQIEISA-N 424.198 3.024 5 1 HGBF COC(=O)c1cc2nc(SCC(=O)Nc3ccc([N+](=O)[O-])cn3)[nH]c2cc1Cl 1857559547 QHJNXMRKFMHLOT-UHFFFAOYSA-N 421.822 3.037 5 1 HGBF O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 587269040 IDSMCAULIUEKIB-UHFFFAOYSA-N 401.688 3.276 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc3c(cc2[nH]1)OC(F)(F)O3 587117851 LRXLDWIVHFHQHP-UHFFFAOYSA-N 405.239 3.365 5 1 HGBF CS(=O)(=O)C[C@]1(c2ccc([N+](=O)[O-])cc2)NCCc2c(Cl)cc(Cl)cc21 963102764 FLAFPPGGLJASGV-QGZVFWFLSA-N 415.298 3.336 5 1 HGBF CCOC(=O)[C@@H]1C(=O)C[C@](O)(c2cccc([N+](=O)[O-])c2)C[C@@H]1C=C(Cl)Cl 15636003 BXMYJRYHDYQCFE-QXKQMHMISA-N 402.230 3.260 5 1 HGBF COC(=O)[C@H](Cc1c[nH]c2ccccc12)NSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 95596271 ZJEVWZDAYYUJQW-HNNXBMFYSA-N 416.415 3.365 5 1 HGBF CN1CCN(c2ccc([N+](=O)[O-])cc2NC(=O)c2ccc(O)cc2C(F)(F)F)CC1 653850710 XVWQHHIKWPLTNB-UHFFFAOYSA-N 424.379 3.323 5 1 HGBF O=C(NCCO)c1c(-c2ccc(F)cc2)noc1-c1ccc(Cl)c([N+](=O)[O-])c1 2480347 OTDUYRLDGDQVJA-UHFFFAOYSA-N 405.769 3.431 5 1 HGBF CC(=O)N[C@@H](Cc1nc2cc([N+](=O)[O-])cnc2[nH]1)c1ccc(Br)cc1 586986411 XFIREDIVAWZPCH-ZDUSSCGKSA-N 404.224 3.049 5 1 HGBF CCc1nnc(CS(=O)(=O)c2cccc(-c3nc4cccc([N+](=O)[O-])c4[nH]3)c2)o1 586923572 QMLNVZGCQZQMBN-UHFFFAOYSA-N 413.415 3.057 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc3nc(O)[nH]c3cc2[nH]1 587263052 JTOIUUZONQBYSC-SECBINFHSA-N 411.374 3.404 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccnc(-c3ccc(OC(F)F)cc3)c1)C2 66263125 BNXXSDZQYLGSSW-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF O=C(CCCn1c2ccccc2c2nc3ccccc3nc21)OCCN1CCOCC1 1772625044 PKXMLFIGODPKBW-UHFFFAOYSA-N 418.497 3.393 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 587264824 KJYZYLKUEBKWCQ-QMMMGPOBSA-N 417.294 3.468 5 1 HGBF C[C@@]1(Cn2ccc([N+](=O)[O-])n2)c2ccccc2C[C@@H]2CN(c3ccccc3)CCN21 962645780 SHJMCMUULHNCGE-NFBKMPQASA-N 403.486 3.454 5 1 HGBF O=[N+]([O-])c1ccc(NCCNc2ncc(-n3ccnc3)c(-c3ccc(F)cc3)n2)nc1 1772577775 NKETVDBEFYLTHM-UHFFFAOYSA-N 420.408 3.296 5 1 HGBF COc1cc2c(cc1OC)CN(CCCCNC(=O)c1cccc([N+](=O)[O-])c1)CC2 82154005 RVYIFYASMPMXRF-UHFFFAOYSA-N 413.474 3.180 5 1 HGBF O=C(Cn1c(=O)oc2cc(Cl)ccc21)Nc1nc2ccc([N+](=O)[O-])cc2s1 299836669 OIUHJFBEOIJHIJ-UHFFFAOYSA-N 404.791 3.405 5 1 HGBF CCOC(=O)C[C@]1(c2ccc([N+](=O)[O-])cc2)NCCc2cc3cccc(OC)c3nc21 963062529 DTRVRELHWJVEEQ-HSZRJFAPSA-N 421.453 3.494 5 1 HGBF CCCCNC(=O)[C@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085263 CEGGFUSAINCHPH-MRXNPFEDSA-N 402.476 3.239 5 1 HGBF CCOC(=O)c1cc(-c2ccccc2)nn1C[C@@H](O)COc1ccc([N+](=O)[O-])cc1 40585085 RPRFTFRXVJVARR-QGZVFWFLSA-N 411.414 3.075 5 1 HGBF O=C([C@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1)N1CCOCC1 767222 MGOSVBYFBSSCIF-PKOBYXMFSA-N 415.833 3.199 5 1 HGBF CC(C)[C@H](NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)C(=O)N1CCCCC1 82082414 NYYYFCJXPYNGMO-KRWDZBQOSA-N 416.503 3.485 5 1 HGBF COc1ccc(O[C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C2)cc1 1857579570 PLEOTNYMSJZLDL-SFHVURJKSA-N 401.375 3.195 5 1 HGBF Nc1nc(NC(=O)c2ccccc2OC(F)(F)F)c([N+](=O)[O-])c(-c2ccco2)n1 43123411 YJSHFVYHZMYBJH-UHFFFAOYSA-N 409.280 3.378 5 1 HGBF CC[C@@H](C)n1ncc(I)c1-c1nc2c([N+](=O)[O-])cncc2[nH]1 587180014 BWSWTCLKZBQSFZ-SSDOTTSWSA-N 412.191 3.305 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c([C@@H](N)Cc3ccc([N+](=O)[O-])cc3)nc2c1 587269893 GCESMXCRRBOCFT-ZDUSSCGKSA-N 419.235 3.263 5 1 HGBF C[C@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)n1cc([N+](=O)[O-])cn1 587660711 JGQGTCTVKUKTRJ-GFCCVEGCSA-N 407.361 3.209 5 1 HGBF CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 586937391 ZLMFOHXOFXBMQL-UHFFFAOYSA-N 406.471 3.341 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1cccc(OCn4cc([N+](=O)[O-])cn4)c1)[C@@H](C2)C3=O 587434419 UXNPGXWDGYGILK-UWJYYQICSA-N 407.382 3.325 5 1 HGBF C[N+]12CCC(CC1)[C@H](Cc1nc(-c3cccc(I)c3)no1)C2 1857556015 JGFJPQCMIMKWEB-CURUXHCOSA-N 410.279 3.370 5 1 HGBF O=C(NCc1ccc2c(c1)OCO2)c1ccc2nc3ccc(Cl)cc3c(=O)n2c1 2965673 WMSKHHRPXFMJLC-UHFFFAOYSA-N 407.813 3.160 5 1 HGBF O=C(NCCN1CCCCC1)c1cn2c(ccc3sc4ccccc4c(=O)c32)n1 27990386 KZKGSUVTYVCWSI-UHFFFAOYSA-N 406.511 3.278 5 1 HGBF COC1=C(OC)Cc2c(cc[n+]3c(CCC(=O)O)c4cc(OC)c(OC)cc4cc23)C1 71282478 OEJNPKRBIYBZOT-UHFFFAOYSA-O 424.473 3.216 5 1 HGBF Cc1nc(-c2cnc(N3CCC[C@H](C(N)=O)C3)nc2-c2ccc([N+](=O)[O-])cc2)oc1C 82174552 VLMDXIZIAHZEEE-HNNXBMFYSA-N 422.445 3.025 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587735880 VQANNCHOTKBAQK-BWKAKNAASA-N 424.201 3.365 5 1 HGBF CN1CCN(CCO[C@@H]2Cn3cc(C=O)c4ccc5c6ccccc6n(c5c43)C2)CC1 473153329 AJSYAAJWTNZAAX-LJQANCHMSA-N 416.525 3.208 5 1 HGBF Cc1cc(S(N)(=O)=O)c(SCC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 45496951 CCZSXQSRUDZTJJ-UHFFFAOYSA-N 400.865 3.179 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cc(-c3ccc(OC(F)F)cc3)ccn1)C2 66262537 ZNJFVSLTZAQQOU-INIZCTEOSA-N 418.356 3.433 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(OC(F)(F)F)c2[C@@]2(CCNc3ccc([N+](=O)[O-])cc32)N1 962625475 CLXIOVSYPKIJLY-KSSFIOAISA-N 423.347 3.152 5 1 HGBF COc1ccc(-n2nnc(-c3ccccc3NC(=O)c3ccccc3[N+](=O)[O-])n2)cc1 1772613822 ZJDZRYSPJVZFQT-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Cn1nc([N+](=O)[O-])cc1C 587871113 AFWHLMHAJWTTSU-LBPRGKRZSA-N 401.398 3.478 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(Br)c(F)cc3[nH]2)cc1 586920850 ZOKMPOCHSBHPJP-UHFFFAOYSA-N 414.212 3.347 5 1 HGBF O=C(Cc1ccc(-c2ncco2)cc1)N1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 96938243 MONKSINLMVHJNG-UHFFFAOYSA-N 420.469 3.179 5 1 HGBF O=C1CCc2c1c1cc(I)ccc1n1c(=O)c3ccccc3n21 1911584579 GKYFIKAFJXZYFZ-UHFFFAOYSA-N 414.202 3.439 5 1 HGBF Cc1nc2ccc(Cl)cn2c1-c1ccn(S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1 28640705 OGTVETDRQHQBEX-UHFFFAOYSA-N 417.834 3.305 5 1 HGBF CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(C(=O)O)cc2)c([N+](=O)[O-])c1 13765341 MZSLFJYHWQGRQW-UHFFFAOYSA-N 408.418 3.089 5 1 HGBF COc1cc2c(cc1OC)C(=O)[C@H]([C@@H](O)C1CC[N+](C)(Cc3ccccc3)CC1)C2 38142505 IBATXZHEHNSLNL-LGGNYIIDSA-N 410.534 3.477 5 1 HGBF O=C([C@@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCCC1 82085275 CFNWVLSZCTVKJE-KRWDZBQOSA-N 414.487 3.335 5 1 HGBF COCCCNC(=O)[C@H](CCSC)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 82195370 AWBZRUKDMPAFNP-HNNXBMFYSA-N 424.548 3.405 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(C(=O)OC)nc2[nH]1 587261864 DJRXESOSBYAOQV-SNVBAGLBSA-N 414.374 3.004 5 1 HGBF CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 587057982 YUXSUDZLUJOHDD-SNVBAGLBSA-N 424.248 3.059 5 1 HGBF Cc1onc(-c2nc3cc4c(cc3[nH]2)OCCO4)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079666 LUDRKKQOTNNILM-UHFFFAOYSA-N 416.781 3.104 5 1 HGBF O=C(c1[nH]c2ccccc2c1Nc1nc(N2CCOCC2)ncc1[N+](=O)[O-])C1CC1 1772650076 MNBORRLAWIDFRO-UHFFFAOYSA-N 408.418 3.039 5 1 HGBF O=C1NCc2c1c1c3ccccc3n3c1c1c2c2cc(CO)ccc2n1C[C@@H](CO)C3 28819513 YBOHKHOOGLAEEN-AWEZNQCLSA-N 411.461 3.260 5 1 HGBF Nc1nccc2[nH]c(-c3ccc(Cn4cc([N+](=O)[O-])c(C(F)(F)F)n4)cc3)nc12 587117478 DSLDOADVCNESMF-UHFFFAOYSA-N 403.324 3.379 5 1 HGBF CCOC(=O)C[C@@]1(c2ccc([N+](=O)[O-])cc2)NCCc2cc3cccc(OC)c3nc21 963062530 DTRVRELHWJVEEQ-QHCPKHFHSA-N 421.453 3.494 5 1 HGBF Cn1ccc2c3n(c(=O)c(=O)cc1-3)c1c(Br)cc(Br)cc21 1772593474 LUKSFALCZJHUPP-UHFFFAOYSA-N 408.049 3.219 5 1 HGBF CC(C)Nc1nc2cc(Cl)c([N+](=O)[O-])c(C(F)(F)F)c2nc1S(C)(=O)=O 28951121 NOOXLGYRLZPUTB-UHFFFAOYSA-N 412.777 3.434 5 1 HGBF C[N+](C)(C)CCO[P@@](=O)(O)OC[C@@H](COCc1ccccc1)Oc1ccccc1 40875322 XXFYMVMKLFUROC-OAQYLSRUSA-O 424.454 3.491 5 1 HGBF C[C@H](Cn1cc([N+](=O)[O-])cn1)C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587662257 XVDALRGXBJGREO-CYBMUJFWSA-N 421.388 3.284 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738366 NONOKKUTWWLIOH-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF COCCOc1ccc(-c2nc3c(F)cnc(Br)c3[nH]2)cc1[N+](=O)[O-] 587264198 CWBYSODHQLHFAO-UHFFFAOYSA-N 411.187 3.460 5 1 HGBF COCCNc1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1[N+](=O)[O-] 587265951 SRXHFELZJSPUNM-UHFFFAOYSA-N 402.323 3.013 5 1 HGBF Cn1c([N+](=O)[O-])cnc1[S@@](=O)CCCCCCCOc1ccccc1[N+](=O)[O-] 169347003 JEGFARDNTLHTSU-NDEPHWFRSA-N 410.452 3.374 5 1 HGBF CCOC(=O)[C@@H]1C(=O)C[C@](O)(c2cccc([N+](=O)[O-])c2)C[C@H]1C=C(Cl)Cl 1234770 BXMYJRYHDYQCFE-PHEKWQANSA-N 402.230 3.260 5 1 HGBF COc1cccc(CNc2ncc([N+](=O)[O-])c(NCC3CCC(CN)CC3)n2)c1 28898409 POUPXWBYQNVIPM-UHFFFAOYSA-N 400.483 3.183 5 1 HGBF COc1cc(OC(C)(C)CO)c(CO)c2c1c(=O)c1cc3ccccc3cc1n2C 40862646 OGOXMFPZOKPNRH-UHFFFAOYSA-N 407.466 3.496 5 1 HGBF COc1ccc(/C=C2\c3cc(OC)c(OC)c(OC)c3CC[C@@H]2O)cc1[N+](=O)[O-] 299867424 XZESVJDLEMLIKQ-FVLHSZHDSA-N 401.415 3.477 5 1 HGBF CCCCNS(=O)(=O)c1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 587148991 NZZKVJWRSMPPMM-UHFFFAOYSA-N 422.438 3.268 5 1 HGBF N[C@@H](CCc1nc2ccc(OC(F)(F)F)cc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587270530 LVWKGUUYORGVCD-ZDUSSCGKSA-N 423.351 3.268 5 1 HGBF Cc1nc2[nH]c(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)nc2cc1Br 587268852 BXGHHQVDBUQSOC-UHFFFAOYSA-N 400.196 3.185 5 1 HGBF C[C@@](N)(c1ccc(S(=O)(=O)O)cc1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 586957562 BGXOIWIZRLHYTN-OAQYLSRUSA-N 419.466 3.128 5 1 HGBF CC(C)Nc1ccc([C@H](CC(N)=O)NC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 13878845 NURVLBKXIYRCTJ-KRWDZBQOSA-N 418.881 3.344 5 3 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(Cc1ccccc1[N+](=O)[O-])C(=O)O 587574968 HLEKOFLDRFWWMP-XMSQKQJNSA-N 421.361 3.328 5 1 HGBF COc1ccc(OC[C@](C)(O)C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1 13559489 CIWUJQDQZXMWRL-KRWDZBQOSA-N 414.336 3.391 5 1 HGBF O=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1cccc([C@@H]2CN3CCSC3=N2)c1 29394997 IUVOLXDWWJDXMQ-HNNXBMFYSA-N 411.443 3.016 5 1 HGBF COc1ccc(OC)c(C2=C[C@@H](c3ccc(OC)c([N+](=O)[O-])c3)NC(=S)N2)c1 40848569 SQYNXBPEYFZJSC-AWEZNQCLSA-N 401.444 3.181 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2c(C(=O)OC)ccnc2[nH]1 587266324 ZZJUQMUNHYKCFD-SNVBAGLBSA-N 414.374 3.004 5 1 HGBF COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](C2)C3=O 587431405 DXARCWWUVMSKGL-QKKBWIMNSA-N 412.398 3.147 5 1 HGBF C[C@@]1(Cn2ccc([N+](=O)[O-])n2)c2ccccc2C[C@H]2CN(c3ccccc3)CCN21 962645784 SHJMCMUULHNCGE-NZQKXSOJSA-N 403.486 3.454 5 1 HGBF COCCCNC(=O)c1c(C(C)(C)C)noc1-c1cc(OC)c(OC)cc1[N+](=O)[O-] 2483352 WPDDGQVATGQESF-UHFFFAOYSA-N 421.450 3.331 5 1 HGBF COC(=O)c1cc2[nH]c(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])nc2cc1OC 587136283 CZFYUXXZXXLVJU-UHFFFAOYSA-N 402.382 3.350 5 1 HGBF COc1cc([C@H]2NCCc3cc(C)c(F)cc32)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 962303868 XQPXPPHUOQDBGN-BBATYDOGSA-N 404.394 3.138 5 1 HGBF O=C(c1ccc([N+](=O)[O-])o1)N1CCC2(CC1)C[C@H](Cc1nc(C3CC3)no1)CCO2 1857612548 CHFSOZOFKOHEAF-ZDUSSCGKSA-N 416.434 3.092 5 1 HGBF COC(=O)[C@H](C(C)C)n1c(=O)c2cc(OC)c(OC)cc2c2c[nH]c3nccc-3c21 1857771286 ADEMHSKRIMQOSA-SFHVURJKSA-N 409.442 3.370 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 772624 GRNGRADFUBMVFX-AEFFLSMTSA-N 417.805 3.157 5 1 HGBF CN(C)C(=O)c1ccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c2c1 587268931 DTOWUAMQJZESBY-UHFFFAOYSA-N 421.457 3.193 5 1 HGBF Cc1c(NCc2nnc(Nc3ccc([N+](=O)[O-])cc3)o2)c(=O)n(-c2ccccc2)n1C 73221743 SBNDGHZXELWOKX-UHFFFAOYSA-N 421.417 3.131 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(CCC[S@](=O)c3ccc(Br)cc3)nc2c1 586958641 GYZDQBNNDPXLLK-DEOSSOPVSA-N 409.265 3.369 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3nccnc3I)[nH]c2cc1Cl 587186707 PQTYYWRFLXOHEL-UHFFFAOYSA-N 401.551 3.186 5 1 HGBF COc1ccccc1N1CCN(CC[C@H]2CCc3ccc([N+](=O)[O-])cc3[C@@H]2O)CC1 103232407 FMPGJOKHIUMWLA-WZONZLPQSA-N 411.502 3.412 5 1 HGBF O=C(O)[C@H]1Cc2c(cnc3ccccc23)[C@](c2cccc([N+](=O)[O-])c2)(c2ncco2)N1 963229430 WFWCOECTIXUXRD-DENIHFKCSA-N 416.393 3.022 5 1 HGBF NCC1CCC(CNc2nc(NCc3ccc(F)cc3F)ncc2[N+](=O)[O-])CC1 28898512 BTTRVTAXKXHUPL-UHFFFAOYSA-N 406.437 3.452 5 1 HGBF COc1cc2c(cc1OC)CN(CCCCNC(=O)c1ccc([N+](=O)[O-])cc1)CC2 82154001 SIUGTNMGLMBNFZ-UHFFFAOYSA-N 413.474 3.180 5 1 HGBF COc1cccc(-n2nnc(-c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3)n2)c1 299852650 VTVFTFXYVIRFSS-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF O=[N+]([O-])c1cc(-c2nc3ccc(Br)c(O)c3[nH]2)nn1CC(F)(F)F 587093164 XEOXWEQCHITSJI-UHFFFAOYSA-N 406.118 3.365 5 1 HGBF COc1ccc(CCN2CN=C(SCc3ccc([N+](=O)[O-])cc3)NC2)cc1OC 58541352 VNPAJRVHRNMEAY-UHFFFAOYSA-N 416.503 3.264 5 1 HGBF CCCCCNC[C@H](O)COc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1 96933350 AALBFEXMHQNKIV-AWEZNQCLSA-N 401.459 3.180 5 1 HGBF COc1ccccc1N1CCN(CC[C@@H]2CCc3ccc([N+](=O)[O-])cc3[C@@H]2O)CC1 103232405 FMPGJOKHIUMWLA-FDDCHVKYSA-N 411.502 3.412 5 1 HGBF C[C@]1(CCn2cnc([N+](=O)[O-])n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 587341598 KABQGGXHDRLISS-FXAWDEMLSA-N 412.377 3.239 5 1 HGBF CN(C)C(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 770361 AYLDPEIBDUYUCZ-PKOBYXMFSA-N 416.865 3.494 5 1 HGBF Cc1ccc2c(OCCN3CCN(Cc4ccc(O)c([N+](=O)[O-])c4)CC3)cccc2n1 13643839 GCIDJPAHOAQOPY-UHFFFAOYSA-N 422.485 3.354 5 1 HGBF C[C@@]12CC(C(F)(F)F)=NN1C(=O)N(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C2=O 40584472 PKSJTBLLAZZQMG-LBPRGKRZSA-N 410.230 3.463 5 1 HGBF O=C(c1ccc(N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])c1)N1CCCCC1 101706843 VWXDVOUHOGJHMZ-WMZOPIPTSA-N 422.485 3.006 5 1 HGBF Cc1ccc(Cn2cc([N+](=O)[O-])c(C(=O)n3ncc4ccc(Cl)cc4c3=O)n2)cc1 587652773 JHCDFUJQBPTKQB-UHFFFAOYSA-N 423.816 3.200 5 1 HGBF COc1ccc(C)c(Nc2nccnc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 299822365 OMESWGVOMOATBE-UHFFFAOYSA-N 415.431 3.246 5 1 HGBF CC(C)(C)OC(=O)N(Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)C[C@@H]1CCCO1 587197488 PPTSUFOHJUOCAP-NSHDSACASA-N 421.410 3.295 5 1 HGBF COc1cc2c(=O)n(CCN(C)C)c3c4cccc([N+](=O)[O-])c4ncc3c2cc1OC 27073502 ZWKXFOLGURDAFF-UHFFFAOYSA-N 422.441 3.190 5 1 HGBF COc1cc(OCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)ccc1[N+](=O)[O-] 587263221 OXABSHJTTXNJIO-UHFFFAOYSA-N 422.401 3.118 5 1 HGBF CN(C)C[C@H](O)COc1ccc(Nc2cc(Nc3ccccc3[N+](=O)[O-])ncn2)cc1 13537895 WWCTWZWHBBXROW-INIZCTEOSA-N 424.461 3.173 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587733903 PABKNFDBSMMRPA-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587750854 JWWNRUQOUALYBS-QPFGOUBPSA-N 406.211 3.226 5 1 HGBF CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 587057977 YUXSUDZLUJOHDD-JTQLQIEISA-N 424.248 3.059 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587567929 FWYIVTSSYGQUIB-IIBYNOLFSA-N 422.324 3.249 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(Cc1ccccc1[N+](=O)[O-])C(=O)O 587574965 HLEKOFLDRFWWMP-AVRDEDQJSA-N 421.361 3.328 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cncc(-c3ccc(OC(F)F)cc3)c1)C2 66251776 HPOKMKKSZQKVHZ-INIZCTEOSA-N 418.356 3.433 5 1 HGBF CCCc1cc(=O)oc2c1c(OCCN1CCOCC1)cc1oc([N+](=O)[O-])cc12 169342973 PDAVSVQUCQXZJB-UHFFFAOYSA-N 402.403 3.111 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2ccccc2c1 27554734 WBLCYZLPPWOMON-CQSZACIVSA-N 414.439 3.412 5 1 HGBF COc1ccc(-c2coc3c(OC)c(OC)c(OC)c(O)c3c2=O)cc1[N+](=O)[O-] 73240713 FMQIVIBGEJPRTK-UHFFFAOYSA-N 403.343 3.108 5 1 HGBF COCCNc1ccc(-c2nc3c(F)cnc(Br)c3[nH]2)cc1[N+](=O)[O-] 587262356 SQZIWAMOIJPIQC-UHFFFAOYSA-N 410.203 3.493 5 1 HGBF C[C@@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(F)c(F)c(F)c2[nH]1 587264303 LBHXUWWZIQPQBI-RCNPXXIZSA-N 411.296 3.331 5 1 HGBF CC(C)N=c1nc(Nc2ccc([N+](=O)[O-])cc2)[nH]c(Nc2ccc([N+](=O)[O-])cc2)n1 1772614818 SBSBBMCBKAVYQY-UHFFFAOYSA-N 410.394 3.417 5 1 HGBF O=C(c1cnc(NC2CCCCC2)nc1-c1cccc([N+](=O)[O-])c1)N1CCOCC1 82134496 JRQCCTFNMFNDMG-UHFFFAOYSA-N 411.462 3.269 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(Br)cc(F)c3[nH]2)cc1 586919841 IFJPVPMLBBAYEV-UHFFFAOYSA-N 414.212 3.347 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(Br)c(F)c(F)c3[nH]2)[C@H]1C[N+](=O)[O-] 587263668 NLLVYLPAHLDBSL-CSMHCCOUSA-N 402.195 3.264 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cncc([N+](=O)[O-])c2[nH]1 587266195 ZBSRQAJVHQCJJQ-VIFPVBQESA-N 401.335 3.126 5 1 HGBF C[C@@H]1O[C@@H](n2c3ccccc3c3ccc4c5ccccc5[nH]c4c32)[C@H](O)[C@H](O)[C@H]1O 85599979 WAYQLPDVCJWOAA-XRGZWHKWSA-N 402.450 3.429 5 1 HGBF Nc1ncnc2c1N=C(c1ccc([N+](=O)[O-])cc1)C[C@H](c1ccc3c(c1)OCO3)N2 40423786 GLVNTUNXRSQYEB-OAHLLOKOSA-N 404.386 3.373 5 1 HGBF CCCCN(CCCC)CCCNC(=O)[C@@H]1CC(c2cccc([N+](=O)[O-])c2)=NO1 8829403 TVBRUJPZIZRJLO-FQEVSTJZSA-N 404.511 3.496 5 3 HGBF O=[N+]([O-])c1ccc(CNC[C@@](O)(Cn2cncn2)c2ccc(Cl)cc2Cl)cc1 29040344 LADHIZJQZAYMPT-GOSISDBHSA-N 422.272 3.171 5 1 HGBF CN(C)CCNC(=O)c1ccc2c3c1nc1ccccc1c3[nH]n2CCN1CCCC1 26984994 QQUWQLINRMUJBF-UHFFFAOYSA-N 418.545 3.058 5 1 HGBF CC(C)(C)NC(=O)/C=C/c1nc2ccccc2n(Cc2ccc([N+](=O)[O-])cc2)c1=O 169342600 FFZUWOMMRDOHPZ-OUKQBFOZSA-N 406.442 3.281 5 1 HGBF O=C(c1cc(N2CCOCC2)ccc1[N+](=O)[O-])n1nc2cc1Oc1ccc(F)cc1-2 587875648 TVGNABPRJFXLDT-UHFFFAOYSA-N 410.361 3.228 5 1 HGBF COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCn1cc([N+](=O)[O-])cn1 587388891 HOWMQYWQLPCGPE-IBGZPJMESA-N 424.413 3.434 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587567927 FWYIVTSSYGQUIB-IERDGZPVSA-N 422.324 3.249 5 1 HGBF COc1c2occc2c(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccc(=O)oc12 39246007 ITCTUEAHZNUPHC-UHFFFAOYSA-N 416.367 3.257 5 1 HGBF CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 769150 OIELNGLIOPIRQE-SJLPKXTDSA-N 417.805 3.157 5 1 HGBF COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OCC(F)(F)F)[C@H]1c1cccc([N+](=O)[O-])c1 169723492 SBQMUDOWNMWGOH-HIFRSBDPSA-N 414.336 3.322 5 1 HGBF COc1cc(C2=C[C@H](c3ccc([N+](=O)[O-])cc3)NC(=S)N2)cc(OC)c1OC 40848344 IQRGLWJUVRRTHS-CQSZACIVSA-N 401.444 3.181 5 1 HGBF O=C(NCCO)c1c(-c2ccccc2F)noc1-c1ccc(Cl)c([N+](=O)[O-])c1 2483260 BTXWESXYJPAKIF-UHFFFAOYSA-N 405.769 3.431 5 1 HGBF C[C@H](Oc1ccccc1)C(=O)NCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587225280 PDTNRXXKQIECPA-JTQLQIEISA-N 419.235 3.317 5 1 HGBF CCCCOCCOC(=O)[C@@H](C)NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82083982 YIJBEFFSOZEJFM-CYBMUJFWSA-N 421.475 3.197 5 1 HGBF CCCc1ccccc1OC[C@@H](O)COc1ccc2c(O)c([N+](=O)[O-])c(=O)oc2c1 143205893 PMGJSINFNLWHDP-AWEZNQCLSA-N 415.398 3.178 5 1 HGBF CC(C)N1CCN(C(=O)c2cccn3c(=O)c4cc5ccccc5cc4nc23)CC1 169349306 JFGHZYXCOQFYFA-UHFFFAOYSA-N 400.482 3.167 5 1 HGBF COc1cc(Br)c([C@@H](N)c2nc3cccc([N+](=O)[O-])c3[nH]2)cc1OC 586976023 RTXKXGPTBJVWDI-CQSZACIVSA-N 407.224 3.299 5 1 HGBF CCCc1c(O)ccc2c1O[C@H](c1cc([N+](=O)[O-])ccc1OCC(=O)O)CC2=O 587472922 OMNMOICEEPFDMP-SFHVURJKSA-N 401.371 3.423 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1ccc(OCn4ccc([N+](=O)[O-])n4)cc1)[C@@H](C2)C3=O 587431983 SLWRJJWLJUJFBL-HRAATJIYSA-N 407.382 3.325 5 1 HGBF O=C(Oc1ccccc1N1C(=O)[C@H]2[C@@H]3C=C[C@H](C3)[C@H]2C1=O)c1ccc([N+](=O)[O-])cc1 139139041 FXUAGKWMODMEET-OHHBCXFOSA-N 404.378 3.126 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 587271024 XELBRJIQCJLUOQ-LBPRGKRZSA-N 414.365 3.007 5 1 HGBF CCOC(=O)CCC[C@@]1(c2ccc(OC)c([N+](=O)[O-])c2)NCCc2c(C)ccnc21 963071215 PXMVUGKTHROGEF-QFIPXVFZSA-N 413.474 3.430 5 1 HGBF CC[C@H](O)CNC(=O)c1c(C(C)(C)C)noc1-c1cc(OC)c(OC)cc1[N+](=O)[O-] 775700 WEIQQHBORCLXEO-NSHDSACASA-N 421.450 3.065 5 1 HGBF CCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4049550 KUCYLUSPYUOIDA-UYAOXDASSA-N 411.414 3.332 5 1 HGBF COc1cc([C@H]2Oc3c(O)cc4c(=O)c5ccccc5oc4c3O[C@@H]2CO)ccc1O 137677761 YAZWZKNWFXTOQR-UYAOXDASSA-N 422.389 3.239 5 1 HGBF Nc1cc([N+](=O)[O-])ccc1[C@@H]1N[C@H](C(=O)O)Cc2ccc(Oc3ccc(O)cc3)cc21 962925851 RCLVEQGPDRCIPG-SFTDATJTSA-N 421.409 3.363 5 1 HGBF O=[N+]([O-])c1ccc2c(c1)N(CCCN1CCN(CCO)CC1)c1ccccc1S2 35227161 OAKTVRMGEANBON-UHFFFAOYSA-N 414.531 3.198 5 1 HGBF COC(=O)c1cc(Cl)c2[nH]c(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)nc2c1 587116407 FVUIWGDULXFXEK-UHFFFAOYSA-N 417.731 3.483 5 1 HGBF COc1ccc(CS(=O)(=O)CC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] 48720839 YOUBOUPMABVNSF-UHFFFAOYSA-N 406.460 3.082 5 1 HGBF C[C@]1(CCn2cnc([N+](=O)[O-])n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587341603 KABQGGXHDRLISS-YLJYHZDGSA-N 412.377 3.239 5 1 HGBF Cc1cc(N(C)Cc2nc3ccc(N4CCN(C)CC4)cc3[nH]2)c([N+](=O)[O-])cc1F 587136665 ICGHURPDVYVWFA-UHFFFAOYSA-N 412.469 3.307 5 1 HGBF Cc1nn(Cn2ccc(C(=O)n3nc4cc3Oc3ccc(F)cc3-4)n2)c(C)c1[N+](=O)[O-] 587876012 XYXMIKRPJXOZAR-UHFFFAOYSA-N 423.364 2.907 5 1 HGBF Cc1cc2c(cc1O)[C@@H](c1cc(Br)ccc1[N+](=O)[O-])N[C@H](C(=O)O)C2 963487191 CIHPCQQVEHTQAF-BBRMVZONSA-N 407.220 3.060 5 1 HGBF CC(=O)OCCN(CCn1nc2c3ccccc3sc3c(N)ccc1c32)C(C)=O 29330141 SOXVXPJWSQDWCQ-UHFFFAOYSA-N 410.499 3.398 5 1 HGBF CCOC(=O)C(=O)c1c(-c2cc(C)cc([N+](=O)[O-])c2O)[nH]c2cccc([N+](=O)[O-])c12 587648055 ZLKGZWKPTPAFME-UHFFFAOYSA-N 413.342 3.411 5 1 HGBF O=C1C=C[C@@]2(C[C@H](OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@@H](c3ccccc3)O2)O1 1772606740 FCHAFJRGIGCZMO-LXGUWOKQSA-N 407.378 3.491 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1 84757836 CPBSTHKCTYJZIJ-UHFFFAOYSA-N 405.310 3.000 5 1 HGBF CCOC(=O)CCC[C@]1(c2cccc([N+](=O)[O-])c2)NCCc2c(C(=O)O)cccc21 963130562 JXGANGXAJRSXCU-JOCHJYFZSA-N 412.442 3.416 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(Cn4cc([N+](=O)[O-])cn4)c1)[C@@H](C2)C3=O 587431200 CYVASDGHIYYVBE-HTAPYJJXSA-N 421.409 3.346 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1ccc(O)c([N+](=O)[O-])c1 587868499 NBANUFBTEHQKEA-UHFFFAOYSA-N 422.319 3.469 5 1 HGBF O=C(c1ccc(Cl)cc1)N1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)s2)CC1 40865162 QPNBZUUOZDRJHU-UHFFFAOYSA-N 419.850 3.322 5 1 HGBF Cc1cc(S(N)(=O)=O)ccc1OCc1nc2cc3nc4ccccc4nc3cc2[nH]1 586929426 BWUKGRUVJWIBJB-UHFFFAOYSA-N 419.466 3.194 5 1 HGBF COC(=O)C(=O)C[C@@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 587512940 QAGKFWQVNRLRCR-HSZRJFAPSA-N 423.421 3.467 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587754381 YGSOVYONHSDUQE-WNWIJWBNSA-N 406.211 3.226 5 1 HGBF C[C@](O)(CSc1ccncc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28022275 QRTIZJPHGRAFQW-HNNXBMFYSA-N 401.366 3.490 5 1 HGBF O=c1oc2cc(O)c(Br)cc2cc1-c1nc2c([N+](=O)[O-])cncc2[nH]1 587000633 RWEKIGUSQGSGEO-UHFFFAOYSA-N 403.148 3.108 5 1 HGBF O=C(O)[C@H]1Cc2cccc(OC(F)(F)F)c2[C@@]2(CCNc3ccc([N+](=O)[O-])cc32)N1 962625474 CLXIOVSYPKIJLY-KDOFPFPSSA-N 423.347 3.152 5 1 HGBF CCCCNC(=O)[C@H]1CCCN(C(=O)c2csc(-c3ccccc3[N+](=O)[O-])n2)C1 82081429 MSZMFNCDLQTYDL-AWEZNQCLSA-N 416.503 3.487 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 82149879 JRYDJYNMXSRUPU-HUUCEWRRSA-N 413.478 3.228 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c([N+](=O)[O-])cccc12 587577719 UHQUVHASNDWRLT-HRAATJIYSA-N 404.334 3.110 5 1 HGBF CC(=CCC[C@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@@H](O)C(C)(C)O 2356828324 CAJMFLABBNVXCD-MDZRGWNJSA-N 402.919 3.462 5 1 HGBF CC(C)c1nn(C)c2c1[C@@H](c1ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)o1)NCC2 962920245 RFTAUEZSGZYAKZ-QGZVFWFLSA-N 404.858 3.178 5 1 HGBF C[C@H]1C[C@]2(C[C@@H](C)N1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N2Cc1ccccc1 253666963 RVAVECVILHMNIE-GPVSGQMNSA-N 422.485 3.458 5 1 HGBF O=C(NC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc([C@H]2CN3CCSC3=N2)c1 29390024 KGHKBCOLWWSKGF-MRXNPFEDSA-N 411.443 3.016 5 1 HGBF C[C@@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(F)c(F)c(F)c2[nH]1 587264305 LBHXUWWZIQPQBI-RWBAJPLHSA-N 411.296 3.331 5 1 HGBF COC(=O)[C@@H](C(C)C)n1c(=O)c2cc(OC)c(OC)cc2c2c[nH]c3nccc-3c21 1857648914 ADEMHSKRIMQOSA-GOSISDBHSA-N 409.442 3.370 5 1 HGBF CCCCNC(=O)[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C 82082246 HJTNLPAYRZVJCV-INIZCTEOSA-N 404.492 3.389 5 1 HGBF CC(C)(C)OC(=O)NC1(c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CCC(=O)CC1 587234342 JVJHIUPBOMMPLQ-UHFFFAOYSA-N 419.394 3.242 5 1 HGBF COc1ccc(S(=O)(=O)N(Cc2ccccc2[N+](=O)[O-])C2CCC2)cc1OC 1772622416 YKYUOSXHSFZOBL-UHFFFAOYSA-N 406.460 3.355 5 1 HGBF Cc1ccc(CNc2ncc(C(=O)N3CCOCC3)c(-c3cccc([N+](=O)[O-])c3)n2)o1 82134492 UCJJJIRDONEJDE-UHFFFAOYSA-N 423.429 3.038 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3cccc(Cl)c3[nH]2)cc1[N+](=O)[O-] 586941696 VGNXCPIHHSTOJF-UHFFFAOYSA-N 412.880 3.325 5 1 HGBF COc1cc(Br)cc(C=O)c1OCc1nc2cncc([N+](=O)[O-])c2[nH]1 586979773 ASSWUMIPDMPODC-UHFFFAOYSA-N 407.180 3.029 5 1 HGBF COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 587391350 VVGPEAXRUAWKNI-MGPLVRAMSA-N 416.386 3.052 5 1 HGBF O=C(O)[C@H]1Cc2c(cnc3ccccc23)[C@@](c2cccc([N+](=O)[O-])c2)(c2ncco2)N1 963229432 WFWCOECTIXUXRD-KNQAVFIVSA-N 416.393 3.022 5 1 HGBF Cc1ccc(S(=O)(=O)N2CCC(c3nc4cccc([N+](=O)[O-])c4[nH]3)CC2)cc1 586954825 PMLVAYMCFTTZNZ-UHFFFAOYSA-N 400.460 3.348 5 1 HGBF Cc1cc(N(C)Cc2nc3ccc(CN4CCOCC4)cc3[nH]2)c([N+](=O)[O-])cc1F 587136659 IBYCKSSLGAXCQC-UHFFFAOYSA-N 413.453 3.387 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738240 LTZRSHVHDRYORD-BWKAKNAASA-N 424.201 3.365 5 1 HGBF CCCCn1c(=O)c2ccc3c(=O)n(C4CCCCC4)c(=O)c4ccc(c1=O)c2c34 1857769617 WJUYZDHIBLMBFN-UHFFFAOYSA-N 404.466 3.371 5 1 HGBF O=C(O)c1cc2[nH]c(CCO)nc2cc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12 586894419 DNPJSUSRYFVJRA-UHFFFAOYSA-N 416.389 3.380 5 1 HGBF C[C@@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3ncccc3c2[nH]1 587267309 WVFJBPPEDVVBFI-QGHHPUGFSA-N 408.374 3.462 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587735886 VQANNCHOTKBAQK-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF C[C@@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)O[C@H](C(C)(C)O)C5 1772629494 UJMMSIVZESHDCI-VFZGTOFNSA-N 412.438 3.490 5 1 HGBF COC(=O)[C@]1(c2ccc([N+](=O)[O-])cc2)C[C@H]1CN1CCC(O)(c2ccccc2)CC1 28634762 BBKFUZZJHOHATF-CVDCTZTESA-N 410.470 3.009 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2c(Cl)c(Br)cnc2[nH]1 587266540 ZXVJZULFOCSCGG-QMMMGPOBSA-N 412.631 3.230 5 1 HGBF O=C(O)c1cc(-n2c(O)cc(-c3ccc([N+](=O)[O-])cc3)c2O)c(Br)cn1 587939778 LOYQLSYRCNIKGB-UHFFFAOYSA-N 420.175 3.319 5 1 HGBF O=C(CSc1nnc(Cc2ccccc2)o1)Nc1nc2ccc([N+](=O)[O-])cc2[nH]1 1857645972 RLEFCXCNQSOSSU-UHFFFAOYSA-N 410.415 3.176 5 1 HGBF COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 587391349 VVGPEAXRUAWKNI-HWPZZCPQSA-N 416.386 3.052 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(OCCCC(=O)O)ccc1[N+](=O)[O-])O2 587391380 WHICXIGQLRDSAZ-SFHVURJKSA-N 400.387 3.436 5 1 HGBF CCOC(=O)C1=CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 72139350 GGBRNUQFBBUEQF-KRWDZBQOSA-N 416.455 3.220 5 3 HGBF COc1cccc2cc3c(nc12)[C@](c1cccc([N+](=O)[O-])c1)(c1nccn1C)NCC3 963047370 OJKVSZIGQDNNDT-HSZRJFAPSA-N 415.453 3.323 5 1 HGBF C[C@@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 36177255 ICCAPQVBVNHAEX-JTQLQIEISA-N 422.375 3.394 5 1 HGBF C[C@H]1O[C@@H](n2c3ccccc3c3ccc4c5ccccc5[nH]c4c32)[C@H](O)[C@H](O)[C@H]1O 85599977 WAYQLPDVCJWOAA-QCMNMXPUSA-N 402.450 3.429 5 1 HGBF Cc1ccc(S(=O)(=O)N2CCC(c3nc4ccc([N+](=O)[O-])cc4[nH]3)CC2)cc1 586955111 UFZFWEDBYOVFPW-UHFFFAOYSA-N 400.460 3.348 5 1 HGBF CCn1cc([N+](=O)[O-])c(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 587661089 MFJJMMAYKBUCEX-UHFFFAOYSA-N 407.361 3.016 5 1 HGBF O=[N+]([O-])c1cccc(CN(c2ccc([N+](=O)[O-])c(Br)c2)n2cnnc2)c1 1857612690 WEEKLVCMWOEOEO-UHFFFAOYSA-N 419.195 3.327 5 1 HGBF COc1cc2c3c(c1)O[C@@](c1ccc([N+](=O)[O-])cc1)(c1cc(C=O)n(C)c1)[C@@H](C2)C3=O 587434158 RPEXQEYFSCAXMI-CVDCTZTESA-N 418.405 3.446 5 1 HGBF O=C(N[C@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 33819162 SMVIJKKEWFATTJ-HXUWFJFHSA-N 400.394 3.140 5 1 HGBF O=C(c1[nH]nc([N+](=O)[O-])c1Cl)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587656978 OLSSXTBCHRPLLK-UHFFFAOYSA-N 413.752 3.176 5 1 HGBF CC(C)(CO)CNC(=O)c1c(C(C)(C)C)noc1-c1cc2c(cc1[N+](=O)[O-])OCO2 775843 VPJWGHSTDFFWPC-UHFFFAOYSA-N 419.434 3.024 5 1 HGBF COc1cc2nc(-c3cc([N+](=O)[O-])c(Cl)c(S(C)(=O)=O)c3)[nH]c2cc1OC 586926199 MDBVPZLMPWVQBJ-UHFFFAOYSA-N 411.823 3.212 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cccc(-c3ccc(OC(F)F)cc3)n1)C2 66258994 HYOIVGVCBYUOML-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF Nc1c(S(=O)(=O)c2ccc(Cl)cc2)c2nc3ccccc3nc2n2ccnc12 5846482 RIRDAJLJBIAKDF-UHFFFAOYSA-N 409.858 3.499 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(F)c2[C@H](c2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)N1 962923439 QYGOPSWCURRKNN-NHYWBVRUSA-N 400.284 3.321 5 1 HGBF CN(C)CCN1C(=O)c2c(c3c4cc(O)ccc4[nH]c3c3[nH]c4ccncc4c23)C1=O 40956559 NTYOJFFTQVMCLG-UHFFFAOYSA-N 413.437 3.214 5 1 HGBF CCOC(=O)Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1-c1ccccc1[N+](=O)[O-] 587649889 DJOOHSNBGAEBCY-UHFFFAOYSA-N 402.428 3.252 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)Cn1cc([N+](=O)[O-])cn1 587868389 KAQYZQUJXXMSPG-SNVBAGLBSA-N 424.339 3.054 5 1 HGBF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@@H](c2cc([N+](=O)[O-])c(Br)cc2F)N1 962915294 BTSUOMZWACTIPI-ZFWWWQNUSA-N 413.174 3.324 5 1 HGBF C[C@]1(CN2CCc3nc(-c4ccccc4F)ccc3C2)Cn2cc([N+](=O)[O-])nc2O1 1857564130 QGSYQCJWVLKXMY-NRFANRHFSA-N 409.421 3.202 5 1 HGBF O=c1c2ccccc2n(C[C@@H](O)CN2CCC(N3CCCCC3)CC2)c2ccccc12 40402079 IFGBRQCKHUVSIA-NRFANRHFSA-N 419.569 3.466 5 1 HGBF O=C(N[C@@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 28572664 VNTSYMJKMVSSSN-FQEVSTJZSA-N 400.394 3.140 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 587266019 TYYQTUHPXOARLP-VIFPVBQESA-N 422.195 3.090 5 1 HGBF Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)sc(=O)n1Cc1cccc(F)c1 61897754 ITCSFJFUGRCWBH-UHFFFAOYSA-N 401.419 3.244 5 3 HGBF COc1ccc2[nH]c3c4c(OC)c(OC)c(OC)cc4c4c(c3c2c1)C(=O)NC4=O 13681663 HMVQTNUYQSDKRR-UHFFFAOYSA-N 406.394 3.392 5 1 HGBF O=C(CCN1CCN2Cc3[nH]c4ccccc4c3C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] 40461584 QXYZVNBLMDBTOZ-INIZCTEOSA-N 419.485 3.147 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cnc(-c3ccc(C(F)(F)F)cc3)nc1)C2 66259385 XXDSVOZGJDSCGU-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF COCCNc1ncc(C(=O)NCC2CCCCC2)c(-c2cccc([N+](=O)[O-])c2)n1 82134974 YLMSUWVCFGKSKU-UHFFFAOYSA-N 413.478 3.420 5 1 HGBF COc1ccc(/C=C2\c3cc(OC)c(OC)c(OC)c3CC[C@H]2O)cc1[N+](=O)[O-] 299867426 XZESVJDLEMLIKQ-NQUDRAQSSA-N 401.415 3.477 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c([N+](=O)[O-])cccc12 587577870 UHQUVHASNDWRLT-KKSFZXQISA-N 404.334 3.110 5 1 HGBF COC(=O)c1ccc2c(c1)nc(Nc1ccccc1)c1nc(S(C)(=O)=O)ncc12 114266571 XVQZAZQCVIRLJV-UHFFFAOYSA-N 408.439 3.112 5 1 HGBF CN(C)C(=O)c1ccc2c(c1)[C@H](c1cc(Br)ccc1[N+](=O)[O-])NCC2 962930775 ZAYWRXCPLSCVBX-QGZVFWFLSA-N 404.264 3.294 5 1 HGBF O=C1C(=O)N(Cc2ccco2)[C@H](c2cccs2)[C@@H]1C(=O)c1cccc([N+](=O)[O-])c1 2218450 ZRMNIEZDAHTATG-IAGOWNOFSA-N 410.407 3.401 5 1 HGBF Cc1cc(C)c(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C(=O)O)c(C)c1 27557947 JKBBSMUMHOCBPS-OAHLLOKOSA-N 406.460 3.184 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1cccc(-c3ccc(OC(F)F)cc3)n1)C2 72125885 JLLTWASVAFHMPL-ZDUSSCGKSA-N 404.329 3.295 5 1 HGBF COc1cc(C(=O)Nc2ccc(-c3ccc[n+](C)c3)cc2[N+](=O)[O-])cc(OC)c1OC 73277047 NXNBSHGCVWNPTI-UHFFFAOYSA-O 424.433 3.364 5 1 HGBF CC(=O)c1ccc(OCCCOc2ccc3c(O)c([N+](=O)[O-])c(=O)oc3c2)cc1O 143243983 GCXKEZWYCSFHRY-UHFFFAOYSA-N 415.354 3.163 5 1 HGBF O=c1oc2cc(O)c(Br)cc2cc1-c1nc2ncc([N+](=O)[O-])cc2[nH]1 586999816 IISPPTXNVZKTEK-UHFFFAOYSA-N 403.148 3.108 5 1 HGBF C[C@]1(COc2cccc(-c3ccc(F)nc3F)n2)CCn2cc([N+](=O)[O-])nc2O1 1772583745 HFNAVNFFYSRPCT-GOSISDBHSA-N 403.345 3.147 5 1 HGBF Cc1nc(-c2cnc(N3CCC[C@H](C(N)=O)C3)nc2-c2cccc([N+](=O)[O-])c2)oc1C 82163657 KELCCRPWPATRRP-HNNXBMFYSA-N 422.445 3.025 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587754374 YGSOVYONHSDUQE-CQLKUDPESA-N 406.211 3.226 5 1 HGBF CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(C(N)=O)cc2[nH]1 587058019 ZJKREVBPHDTZDC-INIZCTEOSA-N 415.837 3.351 5 1 HGBF COc1cc2c3c(c1)O[C@@](CNC(=O)c1ccc([N+](=O)[O-])cc1)(C(C)C)[C@@H](C2)C3=O 587434707 YVMOIPBCPUWVPR-JTSKRJEESA-N 410.426 3.176 5 1 HGBF CCN(CC)S(=O)(=O)c1cccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c1 586929825 AYEYBJLBPBWNGX-UHFFFAOYSA-N 419.419 3.077 5 1 HGBF O=C(NC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc([C@H]2CN3CCSC3=N2)c1 29398476 DORQOHYPWLGYTC-MRXNPFEDSA-N 411.443 3.016 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cnc(-c3ccc(C(F)(F)F)cc3)cn1)C2 66258592 CPKHNQZJFNPSKI-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF C/C(=C/CC[C@@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@@H](O)C(C)(C)O 238745460 CAJMFLABBNVXCD-DBEUVCASSA-N 402.919 3.462 5 1 HGBF CSCC[C@@H](NS(=O)(=O)c1ccccc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 586939159 YJECXQWCJPJIBO-CQSZACIVSA-N 406.489 3.244 5 1 HGBF O=C(O)COc1ccc(-c2csc(NCC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 53296755 XZAXVLMMMOPWGN-UHFFFAOYSA-N 413.411 3.477 5 1 HGBF N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cncc([N+](=O)[O-])c2[nH]1 587000371 JDOZIWGVZHJMKM-NSHDSACASA-N 401.224 3.352 5 1 HGBF CC(C)(C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)n1cc([N+](=O)[O-])cn1 587661124 MYTUVVFSRDEBQP-UHFFFAOYSA-N 421.388 3.383 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587752855 TWDGQSRUKMPDAG-QPFGOUBPSA-N 406.211 3.226 5 1 HGBF CC1=NN(c2ccc(C(=O)O)cc2)C(=O)[C@H]1CC(=O)Nc1cc(C)c(C)cc1[N+](=O)[O-] 1857599986 PNFBUUIWCMROEV-INIZCTEOSA-N 424.413 3.277 5 1 HGBF N[C@H](Cc1cccc(Br)c1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 586983803 JBZBNKIXUHNNEZ-SNVBAGLBSA-N 406.196 3.384 5 1 HGBF C[C@@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2ccccc2c1 13840049 WBLCYZLPPWOMON-AWEZNQCLSA-N 414.439 3.412 5 1 HGBF Cc1c(Sc2ccccc2)n(COCc2ccc([N+](=O)[O-])s2)c(=O)[nH]c1=O 28120297 BDPAZECBUNNDRR-UHFFFAOYSA-N 405.457 3.140 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1cc(-c3ccc(C(F)(F)F)cc3)ncn1)C2 72124302 YWCGGJWRFVXWMN-LBPRGKRZSA-N 407.308 3.107 5 1 HGBF Cc1c(C2=C[C@H](c3ccc([N+](=O)[O-])cc3)NC(=S)N2)nnn1Cc1ccccc1 95580516 IGUOPWBYTXDZSR-QGZVFWFLSA-N 406.471 3.103 5 1 HGBF O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cccc(I)c2[nH]1 587268654 APVBYAQXZAGBFS-UHFFFAOYSA-N 423.166 3.467 5 1 HGBF CC1=C2C[C@H]3O[C@@]3(C)[C@@H]2[C@H]2OC(=O)[C@@H](Cn3ncc4ccc([N+](=O)[O-])cc43)[C@@H]2CC1 96910787 RDFBAOOOUGTGIR-WWXCXZFISA-N 409.442 3.390 5 1 HGBF O=[N+]([O-])c1cccc(/C=C2\CNC[C@H]3C2=NC(=S)N[C@@H]3c2cccc([N+](=O)[O-])c2)c1 169729960 XUWVLBDHXAMFMC-UBAQAOMRSA-N 423.454 3.176 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587733402 OHJWRXLDAUZEBP-BWKAKNAASA-N 424.201 3.365 5 1 HGBF COCCOc1cc2ncnc(Nc3ccc(F)c([N+](=O)[O-])c3)c2c2c1OCCO2 653887020 XNPBVLWYKQZCCY-UHFFFAOYSA-N 416.365 3.217 5 1 HGBF O=[N+]([O-])c1ccccc1S(=O)(=O)n1c(CCc2ccccn2)nc2ccccc21 5940169 FBPUWJOTTVRNED-UHFFFAOYSA-N 408.439 3.362 5 1 HGBF CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1cnc([N+](=O)[O-])n1 587859966 KGFNXRHKKICPTN-UHFFFAOYSA-N 411.205 3.096 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3ccc(F)c(C)c3[nH]2)cc1[N+](=O)[O-] 586941141 OPMAUGZVABBECX-UHFFFAOYSA-N 410.452 3.119 5 1 HGBF COc1cc(OCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)ccc1[N+](=O)[O-] 587262510 BFGNAUKACAGPKW-UHFFFAOYSA-N 403.704 3.473 5 1 HGBF N[C@@H](N=O)c1ccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c2c1 587269675 LWWZTEWRRQJIFE-SFHVURJKSA-N 408.418 3.215 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])ccc1N1CCC(CO)CC1)[C@@H](C2)C3=O 587434412 UUDJJUAXUDPPJX-FDDCHVKYSA-N 424.453 3.301 5 1 HGBF CN(C)CCC(=O)Nc1ccc2cc3ccc(NC(=O)CCN(C)C)cc3nc2c1 26496576 DALVTFLIYKCFIO-UHFFFAOYSA-N 407.518 3.168 5 1 HGBF Cc1cnc(Cl)c2[nH]c([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)nc12 587266092 ZDZLXCOCYHDTDH-ISVAXAHUSA-N 406.786 3.270 5 1 HGBF O=[N+]([O-])c1cccc(/C=C2\CNC[C@H]3C2=NC(=S)N[C@H]3c2cccc([N+](=O)[O-])c2)c1 169729962 XUWVLBDHXAMFMC-PLDDMEKUSA-N 423.454 3.176 5 1 HGBF C[C@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)OC(C)(C)[C@@H](O)C5 299836035 XYWJIADIOMLDJB-PSLIRLAXSA-N 412.438 3.490 5 1 HGBF Cc1c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)cc(Br)cc1[N+](=O)[O-] 586979713 IMXLBSVYIOZGAH-UHFFFAOYSA-N 400.196 3.185 5 1 HGBF Cc1cc2c(cc1O)[C@@](c1c[nH]c3ccc([N+](=O)[O-])cc13)(C1CC1)N[C@H](C(=O)O)C2 963494251 YXVBRJQPEMWPDU-SIKLNZKXSA-N 407.426 3.343 5 1 HGBF CN(C)CCNc1nn2c(=O)c3cc(Br)ccc3nc2c2ccccc12 1772641893 GHXVEPWTRMYRCZ-UHFFFAOYSA-N 412.291 3.132 5 1 HGBF O=C(c1cnc(NCc2ccccc2)nc1-c1cccc([N+](=O)[O-])c1)N1CCOCC1 82134992 FNTQXOUMWIKVRG-UHFFFAOYSA-N 419.441 3.136 5 1 HGBF C[C@]1(COC(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@]2(C)[C@@H]3COC(=O)C3=C[C@H](O)[C@H]12 2356827484 OJYDAIRJVVQDEZ-PEWUMXJESA-N 415.442 3.038 5 1 HGBF COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1ccc([N+](=O)[O-])n1 587390872 SDIYQKBOCVUTDQ-IBGZPJMESA-N 408.414 3.445 5 1 HGBF O=C(NCCO)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4206730 OGKUEFYHDIYRHU-RDJZCZTQSA-N 424.240 3.102 5 1 HGBF O=[N+]([O-])c1ccc(N2CCN(C[C@@H](O)c3ccc(Br)cc3)CC2)cc1 209582055 XJMAXELUJLRZJX-GOSISDBHSA-N 406.280 3.213 5 1 HGBF Cc1onc(-c2nc3c(C(=O)O)cc(F)cc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079266 ILMWWUYNVRCIGU-UHFFFAOYSA-N 420.744 3.170 5 1 HGBF COCCCNc1ncc(C(=O)NCc2ccccc2)c(-c2cccc([N+](=O)[O-])c2)n1 82135619 KGWGXUPMSCMUIV-UHFFFAOYSA-N 421.457 3.430 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccnc(Br)c2[nH]1 587117715 VTWCORZJYKANMJ-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF CCCCOCCOC(=O)[C@@H](C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82083693 CFFDMJHROHSKIZ-CYBMUJFWSA-N 421.475 3.197 5 1 HGBF Cc1cnc(Cl)c2[nH]c([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)nc12 587266094 ZDZLXCOCYHDTDH-SDBXPKJASA-N 406.786 3.270 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CN(CCO)CN1C3 72108679 QQRIPRBUSMRPRO-HNNXBMFYSA-N 408.498 3.011 5 1 HGBF COc1cc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2cc1C 587266775 OQMOTDYBXBCREI-DYZYQPBXSA-N 401.379 3.230 5 1 HGBF CN1C(=O)C[C@H]2CN[C@@](C)(c3cc([N+](=O)[O-])c(SCCO)s3)c3cccc1c32 963037472 VOTPFFWIEJJYQI-JEOXALJRSA-N 419.528 3.058 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)n2c(cc(=O)[nH]c2=S)N1 8830404 LTJDDPGANWGWHY-MRXNPFEDSA-N 402.432 3.055 5 3 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587753398 VQPBUQWRPLNGAX-WNWIJWBNSA-N 406.211 3.226 5 1 HGBF NC(=O)O[C@@H](CCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 95573761 KHHAPFDKHFOVNP-IBGZPJMESA-N 402.426 3.083 5 1 HGBF COCCOC(=O)C1=C(C)N=C(C)[C@H](C(=O)OC(C)C)[C@H]1c1cccc([N+](=O)[O-])c1 101235408 SVMHYHIZWOJKDL-OALUTQOASA-N 418.446 3.184 5 1 HGBF Nc1ccc2nc(-c3cc(CC(=O)O)cc(-c4cccc([N+](=O)[O-])c4)c3O)[nH]c2n1 14953802 FIJGUBVGCGLGJQ-UHFFFAOYSA-N 405.370 3.115 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587570481 LAGAXUAZFKGVPH-UTKZUKDTSA-N 422.324 3.249 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587750848 JWWNRUQOUALYBS-CQLKUDPESA-N 406.211 3.226 5 1 HGBF CN1C(=O)C[C@H](c2ccccc2)N=C1SCc1cn(-c2cccc([N+](=O)[O-])c2)nn1 1911573825 MYROLRWFEBCOAO-GOSISDBHSA-N 422.470 3.368 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3c(Br)cnc(Cl)c3[nH]2)[C@H]1C[N+](=O)[O-] 587264041 QNDDZLRZVIHBGH-CSMHCCOUSA-N 401.648 3.034 5 1 HGBF O=C(Nc1ccc([N+](=O)[O-])cc1)c1c(O)c2cccnc2n(-c2ccccc2)c1=O 101171992 QIGFVPYIPDGJEX-UHFFFAOYSA-N 402.366 3.252 5 1 HGBF O=c1c2cnc3ccccc3c2ncn1CCN1CCN(c2cccc(Cl)c2)CC1 72106653 SORWINRGGXOMGM-UHFFFAOYSA-N 419.916 3.420 5 1 HGBF CC(=CCC[C@](C)(Cl)[C@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@H](O)C(C)(C)O 2356828322 CAJMFLABBNVXCD-FCEWJHQRSA-N 402.919 3.462 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cncc([N+](=O)[O-])c2[nH]1 587266192 ZBSRQAJVHQCJJQ-SECBINFHSA-N 401.335 3.126 5 1 HGBF Cc1cc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F 587123099 BHXPEWXNGZLVIQ-UHFFFAOYSA-N 401.326 3.103 5 1 HGBF CCOC(=O)[C@@H]1C(=O)C[C@@](O)(c2cccc([N+](=O)[O-])c2)C[C@H]1C=C(Cl)Cl 4011798 BXMYJRYHDYQCFE-TYFHEEPYSA-N 402.230 3.260 5 1 HGBF COCCNc1ncc(C(=O)N[C@@H]2CCCC[C@@H]2C)c(-c2cccc([N+](=O)[O-])c2)n1 82134888 RYFDGUIYRVMDEA-KBXCAEBGSA-N 413.478 3.419 5 1 HGBF C[C@@]1(CCn2cnc([N+](=O)[O-])n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 587341602 KABQGGXHDRLISS-XLIONFOSSA-N 412.377 3.239 5 1 HGBF COC(=O)c1ccc(OCCCOc2ccc3c(O)c([N+](=O)[O-])c(=O)oc3c2)cc1 169337576 MDSXSQBEQAJLMZ-UHFFFAOYSA-N 415.354 3.041 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587570476 LAGAXUAZFKGVPH-DYESRHJHSA-N 422.324 3.249 5 1 HGBF COc1ccc([N+](=O)[O-])cc1CN1CCN(c2ncc(Cc3ccccc3)cn2)CC1 95564920 GKQNBHARQIMVCD-UHFFFAOYSA-N 419.485 3.306 5 3 HGBF N=C(N)SCc1ccccc1C(=O)c1cc([N+](=O)[O-])ccc1CSC(=N)N 84671827 AFZKHTKMFXVPKU-UHFFFAOYSA-N 403.489 3.079 5 1 HGBF O=[N+]([O-])c1cncc2nc(CCC[S@@](=O)c3ccc(Br)cc3)[nH]c12 586961290 UFDDNKCEPRAHJF-XMMPIXPASA-N 409.265 3.369 5 1 HGBF CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(C(N)=O)c2[nH]1 587054789 LTYUSEHSZHKVHI-OAHLLOKOSA-N 415.837 3.351 5 1 HGBF Cc1c(F)c(Br)cc([N+](=O)[O-])c1-n1c(O)cc(CCC(=O)O)c1O 587943859 QGXQVJXBWXDJTL-UHFFFAOYSA-N 403.160 3.024 5 1 HGBF C[C@]1(c2ccc(N)c([N+](=O)[O-])c2)N[C@H](C(=O)O)Cc2c(C(F)(F)F)cc(F)cc21 962697025 BAKFSMSOABDHQE-WMLDXEAASA-N 413.327 3.197 5 1 HGBF c1ccc2c(N3CCN(CCN4CCOCC4)CC3)c3[nH]c4ccccc4c3nc2c1 95575053 ZKECELWWLKRSFZ-UHFFFAOYSA-N 415.541 3.324 5 1 HGBF C[C@]1(CN2CCc3nc(-c4ccc(F)cc4)ccc3C2)Cn2cc([N+](=O)[O-])nc2O1 1857586114 FCADCCRNDDKTOK-NRFANRHFSA-N 409.421 3.202 5 1 HGBF NCC1CCC(CNc2nc(NCc3c(F)cccc3F)ncc2[N+](=O)[O-])CC1 28898526 BMXSARXRDRGPLX-UHFFFAOYSA-N 406.437 3.452 5 1 HGBF Cc1nn(CCC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc1[N+](=O)[O-] 587661091 MGTPCJFOHMICMF-UHFFFAOYSA-N 421.388 3.346 5 1 HGBF O=c1c(Nc2ccc([N+](=O)[O-])cc2O)c(Nc2ccccc2Br)c1=O 101101174 DSSDIJIJASNQMM-UHFFFAOYSA-N 404.176 3.146 5 1 HGBF CCCc1c(O)ccc2c1O[C@@H](c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])CC2=O 587489540 VFARZUBOOHSYDM-GOSISDBHSA-N 405.428 3.363 5 1 HGBF Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2)sc(=O)n1Cc1ccccc1F 61927600 SKYWJKRLEQHESS-UHFFFAOYSA-N 401.419 3.244 5 3 HGBF Cc1c(I)cnn1[C@H](C)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587182718 RHYNKDLCBDICSW-SSDOTTSWSA-N 415.166 3.329 5 1 HGBF CCCCNC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(C)cc1 36190332 JATWQUFMAQBWNP-UHFFFAOYSA-N 407.448 3.484 5 1 HGBF CCOC(=O)[C@@]1(c2ccc([N+](=O)[O-])cc2)N[C@@H](C(=O)C(F)(F)F)Cc2ccccc21 962727933 BGVHTDIGYAMTAT-APWZRJJASA-N 422.359 3.047 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)n1cc([N+](=O)[O-])c(C)n1 587868985 ZIZWGLFUFOHIJJ-JTQLQIEISA-N 424.339 3.287 5 1 HGBF CCCCCNC[C@@H](O)COc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1 96933351 AALBFEXMHQNKIV-CQSZACIVSA-N 401.459 3.180 5 1 HGBF Cc1cc(C)c(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C(=O)O)c(C)c1 13840037 JKBBSMUMHOCBPS-HNNXBMFYSA-N 406.460 3.184 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cc(-c3ccc(C(F)(F)F)cc3)no1)C2 45245760 BKEPEEVQXQINPR-ZDUSSCGKSA-N 410.308 3.443 5 1 HGBF N[C@H](CCc1ccc([N+](=O)[O-])cc1)[P@](=O)(O)C[C@H](Cc1ccccc1)C(=O)O 299841238 YSYQXQQIKOEBNN-WMZOPIPTSA-N 406.375 3.026 5 1 HGBF in-vitro O=C(CCc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)Nc1nnc(-c2ccncc2)s1 587023507 DZNXJTZPNOFKPN-UHFFFAOYSA-N 413.394 3.095 5 1 HGBF COc1cc2nc(C3CCN(c4ccc([N+](=O)[O-])c(C(N)=O)c4)CC3)[nH]c2cc1F 587263107 LWJMXTSVFGVUPK-UHFFFAOYSA-N 413.409 3.102 5 1 HGBF Cc1nc2ccc(NCC[N+](C)(C)[O-])c3c(=O)c4cc(Br)ccc4n1c23 101446278 ARXUOQXSVWEMQY-UHFFFAOYSA-N 415.291 3.496 5 1 HGBF CS(=O)(=O)Nc1ccc(-c2nc3c([N+](=O)[O-])c(Br)ccc3[nH]2)cc1 586950843 NULXKYMVSRIKGT-UHFFFAOYSA-N 411.237 3.272 5 1 HGBF CC(=O)N1CCN(c2cnc3cccc(NCc4cccc([N+](=O)[O-])c4)c3c2)CC1 71319139 BDEVKMQTDVHFEO-UHFFFAOYSA-N 405.458 3.424 5 1 HGBF COc1cc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)ccc1OCC(=O)NC(C)C 587224685 PXQAHQWPUYTCNS-UHFFFAOYSA-N 402.382 3.189 5 1 HGBF CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cn1cc([N+](=O)[O-])cn1 587865753 HQQUIBURVAGGLI-UHFFFAOYSA-N 409.324 3.413 5 1 HGBF C[C@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)O[C@H](C(C)(C)O)C5 1772629492 UJMMSIVZESHDCI-PSLIRLAXSA-N 412.438 3.490 5 1 HGBF COC(=O)[C@H](Cc1ccccc1)NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82081088 GKHCDXQCCHPHRO-HNNXBMFYSA-N 411.439 3.232 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 587867779 ANSMKKCBTHOYJN-UHFFFAOYSA-N 424.339 3.153 5 1 HGBF C[C@]1(Cn2ccc([N+](=O)[O-])n2)c2ccccc2C[C@@H]2CN(c3ccccc3)CCN21 962645787 SHJMCMUULHNCGE-OFNKIYASSA-N 403.486 3.454 5 1 HGBF CCCN(CCC)c1c([N+](=O)[O-])cc(S(=O)(=O)Nc2ccccn2)cc1[N+](=O)[O-] 29480517 SAAXFWVPGNDHGC-UHFFFAOYSA-N 423.451 3.325 5 1 HGBF COc1cc([C@@H]2CC(c3ccc([N+](=O)[O-])cc3)=NC(=S)N2)cc(OC)c1OC 103165066 KUKPWZQNSJMXEI-HNNXBMFYSA-N 401.444 3.429 5 1 HGBF C[C@@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3ncccc3c2[nH]1 587267304 WVFJBPPEDVVBFI-BMLIUANNSA-N 408.374 3.462 5 1 HGBF O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3cc4c(cc3[nH]2)OCCO4)CC1 587270802 PVGQWCSYMFZSSE-UHFFFAOYSA-N 408.414 3.262 5 1 HGBF CC1=CN2[CH]C=CC=C2N1CC(=O)c1ccc(I)c([N+](=O)[O-])c1 2356817584 GNAFYCRMMRDXSE-UHFFFAOYSA-N 422.202 3.434 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)n1nc([N+](=O)[O-])cc1C 587868485 MMWNSFSCEFSVTH-SNVBAGLBSA-N 424.339 3.287 5 1 HGBF O=[N+]([O-])c1ccc(-c2nnc(NCc3cn(Cc4ccccc4F)nn3)s2)o1 73278913 XAGIWUDAKGDYKZ-UHFFFAOYSA-N 401.383 3.097 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3cc(Br)c(F)c(F)c3[nH]2)[C@@H]1C[N+](=O)[O-] 587263667 NLLVYLPAHLDBSL-BWZBUEFSSA-N 402.195 3.264 5 1 HGBF CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCC(=O)O)c([N+](=O)[O-])c1)CC2=O 587473205 RCHXVXCDUINIOL-GOSISDBHSA-N 401.371 3.423 5 1 HGBF Cc1c2c3cc(NC(=O)[C@@H]4CCCN4C(=N)N)ccc3nc-2n(C)c2ccccc12 653760847 HANDNKLDMVZXJH-IBGZPJMESA-N 400.486 3.436 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc(F)c(Br)c3[nH]2)cc1 586920185 NRFDUOLHAWVUND-UHFFFAOYSA-N 414.212 3.347 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3cc(S(=O)(=O)N4CCC4)ccc3Cl)[nH]c2cc1F 586956141 WHZSTRDFLAMNGK-UHFFFAOYSA-N 410.814 3.325 5 1 HGBF CC(C)c1nn(C)c2c1[C@H](c1ccc(Cn3cc(Cl)c([N+](=O)[O-])n3)o1)NCC2 962920241 RFTAUEZSGZYAKZ-KRWDZBQOSA-N 404.858 3.178 5 1 HGBF COc1ccc([C@@H]2N[C@@H](c3ccc(OC)cc3)[C@@H]([N+](=O)[O-])C(C)(C)[C@@H]2[N+](=O)[O-])cc1 13154604 PHVJOZFYTCDHBH-VNTMZGSJSA-N 415.446 3.406 5 1 HGBF CN1CCN(c2ccc([N+](=O)[O-])cc2NC(=O)c2cc(O)cc(C(F)(F)F)c2)CC1 653847496 HRZXDMPIGXWQLN-UHFFFAOYSA-N 424.379 3.323 5 1 HGBF CN1C(=O)C[C@@H]2CN[C@](C)(c3cc([N+](=O)[O-])c(SCCO)s3)c3cccc1c32 963037496 VOTPFFWIEJJYQI-WYRIXSBYSA-N 419.528 3.058 5 1 HGBF O=[N+]([O-])c1cncc2nc(-c3ccccc3NS(=O)(=O)c3ccc(F)cc3)[nH]c12 587170361 PKKJZFSBQVJKSL-UHFFFAOYSA-N 413.390 3.473 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc([N+](=O)[O-])c1Cl 586926000 LRHLIRJEAWYYLK-UHFFFAOYSA-N 420.834 3.080 5 1 HGBF COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82081087 GKHCDXQCCHPHRO-OAHLLOKOSA-N 411.439 3.232 5 1 HGBF CS(=O)(=O)C[C@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 587530652 GIFAQPYMGBPYOJ-NRFANRHFSA-N 415.467 3.379 5 1 HGBF CCCC[C@H](CC)C(=O)OC[C@]1(CO)C/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O1 45498272 AQWODVHYXIDBMB-CFDSWCKNSA-N 405.447 3.416 5 1 HGBF O=C1C[C@H](N(OCc2ccccc2)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)N1 653742629 BUXZQGJFLDFXIB-HNNXBMFYSA-N 409.320 3.034 5 1 HGBF CCCCCNc1nc(Oc2cccc([N+](=O)[O-])c2)c2ncn(CC(=O)O)c2n1 66101587 ZHBCHDYGYPMLMO-UHFFFAOYSA-N 400.395 3.214 5 1 HGBF O=C(O)C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl 1857752015 RQLHTMJZTODOCE-CQSZACIVSA-N 419.242 3.396 5 1 HGBF O=C(COC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)Nc1ccc(C(=O)O)cc1 5546119 NKZNDEYRBDVABF-UHFFFAOYSA-N 416.389 3.175 5 1 HGBF CN(C)CCNc1c2ccccc2c2c3c(cccc13)C(=O)N(CCN(C)C)C2=O 29391036 AGPDTLQAUOSTKB-UHFFFAOYSA-N 404.514 3.124 5 1 HGBF COC(=O)c1cnn2c1N=C(C)/C(=C(\O)OC(C)C)[C@H]2c1cccc([N+](=O)[O-])c1 101268704 VDGLFIWHGYKXDR-URTGMZOISA-N 400.391 3.468 5 1 HGBF CCS(=O)(=O)c1ccc2nc([C@H](C)Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2c1 587265127 NGUICMOYISWTPS-JTQLQIEISA-N 419.419 3.346 5 1 HGBF COc1cc2c3c(c1)OC1(CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC1)[C@@H](C2)C3=O 587430691 AYNBEVJREIABAK-KRWDZBQOSA-N 408.410 3.026 5 1 HGBF Cc1nc2ccc([N+](=O)[O-])cn2c1C(=O)NCCOc1ccc(Br)cc1 1857613072 NTLZDQPVJNOVOL-UHFFFAOYSA-N 419.235 3.122 5 1 HGBF O=C(NCc1nnc(-c2cccc3c(=O)c4ccccc4c(O)nc23)o1)c1ccccc1 1857763882 HSRULIAYLLLOED-UHFFFAOYSA-N 424.416 3.434 5 1 HGBF CCOC(=O)C1=CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])[C@H]1c1ccc(C)cc1 72136561 OTJVYQDACVYQGB-IBGZPJMESA-N 416.455 3.138 5 3 HGBF CC(=O)Nc1ccc2cc3c(nc2n1)c1cccnc1n3S(=O)(=O)c1ccccc1 6244648 LKFOTCDUWPISCJ-UHFFFAOYSA-N 417.450 3.328 5 1 HGBF NCC1CCC(CNc2nc(NCCc3ccccc3F)ncc2[N+](=O)[O-])CC1 28898795 LYQFQWWBCAZYID-UHFFFAOYSA-N 402.474 3.356 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587753396 VQPBUQWRPLNGAX-QPFGOUBPSA-N 406.211 3.226 5 1 HGBF O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2ccc(I)cc2[nH]1 587270419 XKYXFEYAHWGFJJ-UHFFFAOYSA-N 423.166 3.467 5 1 HGBF N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cccc(I)c2[nH]1 587270958 VEJNMLKXQBDSMF-LBPRGKRZSA-N 408.199 3.318 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587571698 OWTVZDLESKGPLZ-HRAATJIYSA-N 422.324 3.249 5 1 HGBF COCCNc1ncc(C(=O)N[C@H]2CCCC[C@H]2C)c(-c2cccc([N+](=O)[O-])c2)n1 82134880 RYFDGUIYRVMDEA-KDOFPFPSSA-N 413.478 3.419 5 1 HGBF O=C(NCCCn1cnc([N+](=O)[O-])n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 84671987 RFGRYUDNYJHOBA-UHFFFAOYSA-N 411.262 3.044 5 1 HGBF COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4050100 AGDOXLRJNKUXCK-IEBWSBKVSA-N 417.849 3.493 5 1 HGBF Cc1c(Br)cnc2[nH]c(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)nc12 587269751 OAUXTJWLSSKCOY-UHFFFAOYSA-N 400.196 3.185 5 1 HGBF Cn1c(CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cnc1-c1ccc(C(F)(F)F)cc1 45245574 FITOJIVBWKNTMA-AWEZNQCLSA-N 423.351 3.188 5 1 HGBF Cc1nc(-c2cnc(N3CCC[C@@H](C(N)=O)C3)nc2-c2ccc([N+](=O)[O-])cc2)oc1C 82174555 VLMDXIZIAHZEEE-OAHLLOKOSA-N 422.445 3.025 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1-c1nc2cncnc2[nH]1 586948350 HGJZQLWJIGVOKR-UHFFFAOYSA-N 410.415 3.037 5 1 HGBF NC1=N[C@H](c2ccc([N+](=O)[O-])cc2)NC(NCCc2ccc(Cl)c(Cl)c2)=N1 71294702 SWYBTOOYUCNLTC-HNNXBMFYSA-N 407.261 3.006 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cncc([N+](=O)[O-])c3[nH]2)[C@H]2CCCO[C@H]2C1(C)C 587238339 CFAYBSMDFIVZAQ-RPLLZPRCSA-N 417.466 3.421 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCn1ncc([N+](=O)[O-])c1C 587867880 DNPGRGDKUDANGK-UHFFFAOYSA-N 424.339 3.116 5 1 HGBF COCCCNc1ncc(C(=O)N2CCC(C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 82149689 NIPQZXZIHRIFMM-UHFFFAOYSA-N 413.478 3.372 5 1 HGBF COc1ccc(S(=O)(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CCC2)cc1OC 1772585125 ZNCXRNCIRXQPFF-UHFFFAOYSA-N 406.460 3.355 5 1 HGBF O=c1c2cc(Cl)ccc2nc2c3ccccc3c(NCCCN3CCOCC3)nn12 1772633303 QLUDFFSLKKLHEV-UHFFFAOYSA-N 423.904 3.184 5 1 HGBF NCCCN1CCN(CCCNc2nnc(Cl)c3cc4ccccc4cc23)CC1 53294114 UJKFLRZPOFZDKR-UHFFFAOYSA-N 412.969 3.205 5 1 HGBF CN(C)CCCNC(=O)c1ccc2c3c1nc1ccccc1c3[nH]n2CCCN(C)C 26983542 ISLPVTDZMSBNJE-UHFFFAOYSA-N 420.561 3.304 5 1 HGBF Cc1cnc(Cl)c2[nH]c([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)nc12 587266091 ZDZLXCOCYHDTDH-AMIZOPFISA-N 406.786 3.270 5 1 HGBF O=C1N=C2/C(=C/c3cccc([N+](=O)[O-])c3)CNC[C@H]2[C@H](c2cccc([N+](=O)[O-])c2)N1 169730010 ZKLUDMIJZMEMSE-DRRZOZHPSA-N 407.386 3.011 5 1 HGBF CCOC(=O)C1=CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(C)cc1 199358351 OOVUBHXAJUWUMN-LJQANCHMSA-N 416.455 3.138 5 3 HGBF CC(C)c1ccccc1OC[C@H](O)COc1ccc2c(O)c([N+](=O)[O-])c(=O)oc2c1 169337592 BBPITHUUIKNMEZ-CYBMUJFWSA-N 415.398 3.349 5 1 HGBF Cc1cc2[nH]c([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)nc2cc1[N+](=O)[O-] 587266613 LSRGTZMFASNSOQ-FVMDXXJSSA-N 416.350 3.130 5 1 HGBF Cc1ccc2c(c1)ncc1c(=O)n(CCCN3CCN(c4ccccc4)CC3)cnc12 72121984 ZWJAXFNBXZXHSU-UHFFFAOYSA-N 413.525 3.465 5 1 HGBF N[C@@H](CCCNC(=O)OCc1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587259376 FRPQMRCNCQNDLC-AWEZNQCLSA-N 401.398 3.317 5 1 HGBF Nc1cc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc([N+](=O)[O-])c1 587661955 UVXQUYXXRXKFSP-UHFFFAOYSA-N 404.357 3.382 5 1 HGBF CCOC(=O)[C@]1(c2ccc([N+](=O)[O-])cc2)N[C@@H](C(=O)C(F)(F)F)Cc2ccccc21 962727939 BGVHTDIGYAMTAT-VQIMIIECSA-N 422.359 3.047 5 1 HGBF Nc1c(-c2nnc3n2NC(c2ccc([N+](=O)[O-])cc2)=CS3)cnn1-c1ccccc1 957877266 DLRKUIWBYRMZDJ-UHFFFAOYSA-N 418.442 3.269 5 1 HGBF CC(C)=CCc1c(O)cc2oc3ccc4c(c3c(=O)c2c1O)[C@@H](O)[C@H](C(C)(C)O)O4 141616050 GTFZZWXWNSXLEV-FGZHOGPDSA-N 412.438 3.431 5 1 HGBF CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cc(N)c(N)cc2[nH]1 587054864 MMPAEKYABOGIFC-INIZCTEOSA-N 402.842 3.416 5 1 HGBF O=[N+]([O-])c1cn2c(n1)O[C@H](COc1ccc(-c3ccc(C(F)(F)F)nc3)nc1)CC2 1772600103 LCDSXAZAXQWKPC-ZDUSSCGKSA-N 421.335 3.497 5 1 HGBF NCC1CCC(CNc2nc(NCCc3cccc(F)c3)ncc2[N+](=O)[O-])CC1 28898799 WSQBNABVOGQVPU-UHFFFAOYSA-N 402.474 3.356 5 1 HGBF CC(C)N(Cc1ccc(OC(F)(F)F)cc1)[C@@H]1COc2nc([N+](=O)[O-])cn2C1 72178895 UXPIACUVWZOFKH-ZDUSSCGKSA-N 400.357 3.362 5 1 HGBF CSc1nn(-c2ccc([N+](=O)[O-])cc2)c2cc(C3=CCN(C(=O)CN)CC3)ccc12 169706043 QXLHUBAFZPQJGZ-UHFFFAOYSA-N 423.498 3.230 5 1 HGBF C[C@]1(CO)CCC[C@]2(C)[C@H]3COC(=O)C3=C[C@@H](OC(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]12 34751134 HETGKXPYEMRZHE-PEVTXAFISA-N 415.442 3.038 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC(C)C)C(=N)O1 169730054 ARRRXEMYGJAWIC-IAGOWNOFSA-N 404.419 3.479 5 1 HGBF CNCCn1c(=O)c2cc(OC)c(OC)cc2c2ccc3cc4c(cc3c21)OCO4 1857612909 ISACNBGFGVEWCJ-UHFFFAOYSA-N 406.438 3.273 5 1 HGBF COC(=O)c1ccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c2c1 587270146 QQCWNOURWBDJNQ-UHFFFAOYSA-N 408.414 3.278 5 1 HGBF CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cn1ccc([N+](=O)[O-])n1 587865963 QZJWJMIKPXMSTB-UHFFFAOYSA-N 409.324 3.413 5 1 HGBF C[C@@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(F)cnc(Cl)c2[nH]1 587266941 QOTDPOASIFDYGN-KSBSHMNSSA-N 410.749 3.101 5 1 HGBF O=[N+]([O-])c1cc(-c2nc3c(F)cnc(Br)c3[nH]2)nn1CC(F)(F)F 587091960 KBKJRWLXICHOSA-UHFFFAOYSA-N 409.097 3.194 5 1 HGBF CCCCNS(=O)(=O)c1ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2c1 587159235 NQLUXHRTERETQU-UHFFFAOYSA-N 422.438 3.268 5 1 HGBF C=C(C(=O)O)c1cc(O)n(-c2c([N+](=O)[O-])cc(Br)c(F)c2C)c1O 587943863 QIFYSLQWIXOPMC-UHFFFAOYSA-N 401.144 3.105 5 1 HGBF C[C@]1(Cn2ccc([N+](=O)[O-])n2)c2ccccc2C[C@H]2CN(c3ccccc3)CCN21 962645789 SHJMCMUULHNCGE-REWPJTCUSA-N 403.486 3.454 5 1 HGBF O=C(O)c1cc(Br)cc2nc(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c12 587263818 FJRRJBOJEPXVLB-UHFFFAOYSA-N 421.163 3.431 5 1 HGBF CCOC(=O)C1=C(N)Oc2n[nH]c(C)c2[C@@H]1c1cc(=O)oc2c1ccc1ccccc12 1772623512 DMLHNURHCAFKTM-SFHVURJKSA-N 417.421 3.235 5 1 HGBF CCn1c(-c2ccc([N+](=O)[O-])cc2)cs/c1=N/c1ccc(S(N)(=O)=O)cc1 1911573893 QSEQWAIRBDLQKI-HTXNQAPBSA-N 404.473 3.025 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1ccc(Cl)cc1)[C@@H]([N+](=O)[O-])[C@H]1CSCN12 221599138 SWMUBZKWOUVLJU-VXIBKDFQSA-N 401.875 3.305 5 1 HGBF O=[N+]([O-])c1cccc(/C=C2\CNC[C@@H]3C2=NC(=S)N[C@@H]3c2cccc([N+](=O)[O-])c2)c1 169729959 XUWVLBDHXAMFMC-XQMGMDATSA-N 423.454 3.176 5 1 HGBF O=C(O)[C@@H]1Cc2cc(F)ccc2[C@@H](c2cc(F)c([N+](=O)[O-])cc2Br)N1 962900487 IQLFWYCHKLVTPU-ZFWWWQNUSA-N 413.174 3.324 5 1 HGBF CC(C)[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N1CCCCC1 82082258 SLWIXCUYUSPCNQ-KRWDZBQOSA-N 416.503 3.485 5 1 HGBF C[C@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(F)cnc(Cl)c2[nH]1 587266943 QOTDPOASIFDYGN-UPONEAKYSA-N 410.749 3.101 5 1 HGBF Cn1cc(C2=C(c3cn(C)c4cccc([N+](=O)[O-])c34)C(=O)NC2=O)c2ccccc21 13447809 LNSJKQOQRBZRIO-UHFFFAOYSA-N 400.394 3.145 5 1 HGBF CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Cn1nc([N+](=O)[O-])cc1C 587871112 AFWHLMHAJWTTSU-GFCCVEGCSA-N 401.398 3.478 5 1 HGBF CCc1c(Sc2ccccc2)n(COCc2ccc([N+](=O)[O-])s2)c(=O)[nH]c1=O 28120304 DENQCWDGXWJZOD-UHFFFAOYSA-N 419.484 3.394 5 1 HGBF COc1ccc(CNC(=O)c2cc3c(ccc4c(C)cc(=O)oc43)oc2=N)c(OC)c1 653810135 ZJRBVJALNVWYRQ-UHFFFAOYSA-N 420.421 3.274 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(Cn4cc([N+](=O)[O-])cn4)c1)[C@@H](C2)C3=O 587431213 CYVASDGHIYYVBE-JTSKRJEESA-N 421.409 3.346 5 1 HGBF COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c2[nH]c(C)c(N(C)C)c2c1 587621591 WMRTYJQGBGCIEO-UHFFFAOYSA-N 404.448 3.260 5 1 HGBF C[C@@]1(c2cccc([N+](=O)[O-])c2Br)N[C@H](C(=O)O)Cc2cc(F)ccc21 962909465 XNUJEIWLUYDDBQ-SUMWQHHRSA-N 409.211 3.359 5 1 HGBF O=C(NCCN1CCCCC1)c1cccn2c(=O)c3cc4ccccc4cc3nc12 169349314 TXTDKLMFBBYADC-UHFFFAOYSA-N 400.482 3.217 5 1 HGBF C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587754378 YGSOVYONHSDUQE-RBHXEPJQSA-N 406.211 3.226 5 1 HGBF CNCCCCCCCCCCCC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 40895112 ZVMAINMRCBFQIC-IFMALSPDSA-N 423.554 3.226 5 1 HGBF O=C(NO[C@@H]1CCCCO1)c1ccc(Sc2ccc([N+](=O)[O-])c3nonc23)cc1 299828725 SQTNQISEVXUUSS-OAHLLOKOSA-N 416.415 3.470 5 1 HGBF COc1ccccc1-n1nnc(-c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2)n1 299852941 ZRSXVNHPYYFFNS-UHFFFAOYSA-N 416.397 3.498 5 1 HGBF CCOC(=O)Cc1ccc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2c1 587116851 DMOCNHMVOAUBRP-UHFFFAOYSA-N 411.340 3.149 5 1 HGBF COc1ccc(-c2noc(-c3ccc(Cl)c([N+](=O)[O-])c3)c2C(=O)NCCO)cc1 2481013 GDMKZVAIORRHFW-UHFFFAOYSA-N 417.805 3.301 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587571700 OWTVZDLESKGPLZ-IIBYNOLFSA-N 422.324 3.249 5 1 HGBF O=[N+]([O-])c1cn2c(n1)O[C@@H](COc1ccc(-c3ccc(C(F)(F)F)nc3)nc1)CC2 1772600102 LCDSXAZAXQWKPC-CYBMUJFWSA-N 421.335 3.497 5 1 HGBF CC1=C2C[C@H]3O[C@@]3(C)[C@@H]2[C@H]2OC(=O)[C@@H](Cn3ncc4cc([N+](=O)[O-])ccc43)[C@@H]2CC1 96910788 LVMYADYWWSPADQ-WWXCXZFISA-N 409.442 3.390 5 1 HGBF Cn1c2ccccc2c2cc(C(=O)NCCCN3CCOCC3)c3ncccc3c21 96921197 XMTWHIKJCUEIJJ-UHFFFAOYSA-N 402.498 3.332 5 1 HGBF Cc1cccc([C@]2(c3ccc([N+](=O)[O-])cc3)N[C@H](C(=O)O)Cc3cc(C)c(O)cc32)n1 963557798 YKTZCDKWGRKPBQ-WMZHIEFXSA-N 419.437 3.203 5 1 HGBF CCCc1c(O)ccc2c1O[C@@H](c1cc([N+](=O)[O-])ccc1S(C)(=O)=O)CC2=O 587490891 ZMLICQHEMYUHMO-QGZVFWFLSA-N 405.428 3.363 5 1 HGBF Cc1cc(C)cc(C(=O)N[C@@H](CC(N)=O)c2ccc(NCC3CC3)c([N+](=O)[O-])c2)c1 15937553 IZBGQRWUYFTFRN-IBGZPJMESA-N 410.474 3.380 5 3 HGBF N[C@@H](CCc1nc2ccc(Br)cc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587269970 GTXGFNPESBTLCP-ZDUSSCGKSA-N 418.251 3.132 5 1 HGBF CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2sc4ccccc4n23)CC1 100793549 IOMMASNQPJYSEU-UHFFFAOYSA-N 411.458 3.257 5 1 HGBF COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 587391352 VVGPEAXRUAWKNI-QLJPJBMISA-N 416.386 3.052 5 1 HGBF COCCCNc1ncc(C(=O)N2CCC(C)CC2)c(-c2cccc([N+](=O)[O-])c2)n1 82135571 FWSRYZHVICBNRC-UHFFFAOYSA-N 413.478 3.372 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587567926 FWYIVTSSYGQUIB-HRAATJIYSA-N 422.324 3.249 5 1 HGBF CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc([N+](=O)[O-])cnc2[nH]1 587263457 MXSVLMGSGDNJDK-SECBINFHSA-N 401.335 3.126 5 1 HGBF O=C1C[C@H](c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CN1Cc1ccc(F)cc1F 587149610 NTVOJXSVEWHTDH-JTQLQIEISA-N 417.328 3.174 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cc(F)c(F)c(F)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263106 LVJACKMOXFTZSS-UHFFFAOYSA-N 419.363 3.371 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738243 LTZRSHVHDRYORD-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF O=C(O)[C@H]1Cc2cccc(OC(F)(F)F)c2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 962626290 GSSWQTDGRUBHSP-BMIGLBTASA-N 400.284 3.321 5 1 HGBF CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@](C)(O)[C@@H]2C[C@@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 169349994 JJIVYXXDAPXFLI-AXIIEQSXSA-N 415.442 3.179 5 1 HGBF COc1cc2nc(Cl)nc(NCCCCn3ccnc3[N+](=O)[O-])c2cc1OC 73167182 OBVWNQOOPRWIKQ-UHFFFAOYSA-N 406.830 3.297 5 1 HGBF CCCC[C@@H](CC)C(=O)OC[C@]1(CO)C/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1 45495723 AQWODVHYXIDBMB-POYKEPLOSA-N 405.447 3.416 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ncc(-c3ccc(C(F)(F)F)cc3)cn1)C2 66259148 YWLCMPJKOFZFCS-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF O=Cc1cn2c3c1ccc1c4ccccc4n(c13)C[C@@H](OCCN1CCOCC1)C2 473154746 LDNGCIKJNBLDQE-SFHVURJKSA-N 403.482 3.293 5 1 HGBF O=C(O)C[C@](O)(CSCCCCCCc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O 13758312 YLGDVICWNSZSHH-KRWDZBQOSA-N 419.883 3.375 5 1 HGBF COC(=O)c1cccc2nc3c(S(=O)(=O)c4ccc([N+](=O)[O-])cc4)cccc3nc12 103221294 STFGVVPUWHKUHT-UHFFFAOYSA-N 423.406 3.311 5 1 HGBF C[C@@H](c1nc2c(Br)cnc(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 587276496 LHTLLNULGJCFFF-YFKPBYRVSA-N 416.033 3.197 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(OCCCC(=O)O)ccc1[N+](=O)[O-])O2 587391379 WHICXIGQLRDSAZ-GOSISDBHSA-N 400.387 3.436 5 1 HGBF CCOC(=O)CCC[C@@]1(c2cccc([N+](=O)[O-])c2)NCCc2c(C(=O)O)cccc21 963130564 JXGANGXAJRSXCU-QFIPXVFZSA-N 412.442 3.416 5 1 HGBF O=c1oc2ccccc2cc1-c1nnc2n1N=C(c1ccc([N+](=O)[O-])cc1)CS2 1857534292 WLJLRSNSESMWED-UHFFFAOYSA-N 405.395 3.318 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1cccc2ccccc12 27556149 OLYLZZQOHLJXFS-CQSZACIVSA-N 414.439 3.412 5 1 HGBF CCCC[C@@H](CC)C(=O)OC[C@@]1(CO)C/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1 45495727 AQWODVHYXIDBMB-KPVIDISKSA-N 405.447 3.416 5 1 HGBF Cc1cc(N(C)Cc2nc3ccc(OCCN(C)C)cc3[nH]2)c([N+](=O)[O-])cc1F 587136996 NTSASLUISGDZFJ-UHFFFAOYSA-N 401.442 3.495 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccc([N+](=O)[O-])cc1)Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 36177259 ICCAPQVBVNHAEX-SNVBAGLBSA-N 422.375 3.394 5 1 HGBF CC(C)(C)OC(=O)N[C@]1(c2nc3cncc([N+](=O)[O-])c3[nH]2)[C@H]2CCCO[C@@H]2C1(C)C 587238337 CFAYBSMDFIVZAQ-ORBZYBPHSA-N 417.466 3.421 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)[C@H]1C[N+](=O)[O-] 587263397 MIOJWGNUGJKZPJ-HLTSFMKQSA-N 406.311 3.273 5 1 HGBF O=C(O)CSc1ncccc1-c1nc2c([N+](=O)[O-])cc(Br)cc2[nH]1 586966308 AYISSWRPMFLJCJ-UHFFFAOYSA-N 409.221 3.472 5 1 HGBF Cc1onc(-c2nc3c(C(=O)O)cccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587078862 CDTYADWXZLHPQU-UHFFFAOYSA-N 402.754 3.031 5 1 HGBF Cc1ccc(C(=O)Nc2cccc(COc3cncc(C(N)=O)c3)c2)cc1[N+](=O)[O-] 653878744 CSOQPXJHQCNEDU-UHFFFAOYSA-N 406.398 3.228 5 1 HGBF CN1C(=O)C[C@@H]2CN[C@@](C)(c3cc([N+](=O)[O-])c(SCCO)s3)c3cccc1c32 963037481 VOTPFFWIEJJYQI-NSPYISDASA-N 419.528 3.058 5 1 HGBF O=[N+]([O-])c1ccc(F)c(CN2CCN(c3ncc(Cc4ccccc4)cn3)CC2)c1 95566983 UXTVWTVTMIIMFR-UHFFFAOYSA-N 407.449 3.437 5 3 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCCCNc1ccnc3cc(Cl)ccc13)C2 95591531 UTLUGEWNJYSTFN-ZDUSSCGKSA-N 403.826 3.273 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Br)ncc2[nH]1 587116388 FNBLWGXFRAPTRL-UHFFFAOYSA-N 405.134 3.201 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3c(Cl)c(Br)cnc3[nH]2)[C@@H]1C[N+](=O)[O-] 587264751 SMMAJHXMMXZHGZ-GJMOJQLCSA-N 401.648 3.034 5 1 HGBF O=C(O)c1cc(F)cc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 587268893 CQJSWRZQQJJAFG-UHFFFAOYSA-N 412.377 3.328 5 1 HGBF CC(=O)NCCNc1ncc(-c2nc(C)c(C)s2)c(-c2cccc([N+](=O)[O-])c2)n1 82219663 NGJSIYVBZAEJOV-UHFFFAOYSA-N 412.475 3.340 5 1 HGBF COc1cc2c(=O)n(CCN(C)C)c3c4cc([N+](=O)[O-])ccc4ncc3c2cc1OC 27079306 HSDFZMUQOVQMSC-UHFFFAOYSA-N 422.441 3.190 5 1 HGBF C[C@@](O)(C[S@@](=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28015908 SMQYNPMQOPFYTJ-HJWYETAXSA-N 416.377 3.111 5 1 HGBF CCc1cnc(-c2cnc(NCCNC(C)=O)nc2-c2cccc([N+](=O)[O-])c2)s1 82163887 BWPZPTRJTIDXQP-UHFFFAOYSA-N 412.475 3.286 5 1 HGBF C[C@@]1(COc2ccc(-c3ccc(F)nc3F)nc2)CCn2cc([N+](=O)[O-])nc2O1 1772637333 OJXJGKAFQPXUFF-SFHVURJKSA-N 403.345 3.147 5 1 HGBF CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(C(=O)O)cc2)c([N+](=O)[O-])c1 13765343 YLNLGHQMRMWPSK-UHFFFAOYSA-N 422.445 3.113 5 1 HGBF CCCCNC(=O)[C@@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085262 CEGGFUSAINCHPH-INIZCTEOSA-N 402.476 3.239 5 1 HGBF N[C@@H](CCc1nc2cc(Cl)nc(Cl)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587269585 FRJOPIKBMWPZJK-JTQLQIEISA-N 409.233 3.072 5 1 HGBF O=C1c2ccccc2C(=O)N1CCOC(=S)Nc1ccc(Cl)c([N+](=O)[O-])c1 45484366 QPGYOZPVSSCLKX-UHFFFAOYSA-N 405.819 3.258 5 1 HGBF O=C1[C@H]2CC=CC[C@@H]2C(=O)N1c1ccc(NCCc2ccc(O)cc2)c([N+](=O)[O-])c1 13496413 BJRYZTDRHVYPTC-ROUUACIJSA-N 407.426 3.411 5 3 HGBF O=C1/C(=C\c2ccc([N+](=O)[O-])o2)S[C@@H]2NC(COc3ccc(Cl)cc3)=NN12 1660318 OTSACXQINMHLAT-NYUWMOHMSA-N 406.807 3.037 5 1 HGBF COC(=O)C1=C(C(C)C)NC(=O)N(C(=O)OC(C)C)[C@H]1c1cccc([N+](=O)[O-])c1 96272063 ZHQUFYKOKIITMM-INIZCTEOSA-N 405.407 3.289 5 1 HGBF C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 586961118 FUBDAJLIUDUKLS-RXMQYKEDSA-N 411.241 3.165 5 1 HGBF CN(Cc1ccccc1)Cc1ccn(-c2cc3nc(O)c(O)nc3cc2[N+](=O)[O-])c1 36338512 OOIMGNLMHOCHOG-UHFFFAOYSA-N 405.414 3.372 5 1 HGBF O=C([C@H]1CCCN1C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)N1CCCCC1 82085380 VAPDWNBNOICTHH-QGZVFWFLSA-N 414.487 3.335 5 1 HGBF COc1cc(OC)c2nc(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)[nH]c2c1 587079087 GXVHPEFTBDIKGG-UHFFFAOYSA-N 418.797 3.350 5 1 HGBF C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 587264205 DEWGMYJCXRRYFD-ZETCQYMHSA-N 417.294 3.369 5 1 HGBF COc1ccccc1CNc1ncc([N+](=O)[O-])c(NCC2CCC(CN)CC2)n1 28898397 TVXLIXGOPOXRMM-UHFFFAOYSA-N 400.483 3.183 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(Cc1ccccc1[N+](=O)[O-])C(=O)O 587574967 HLEKOFLDRFWWMP-PGRDOPGGSA-N 421.361 3.328 5 1 HGBF CC[C@H](O)CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 766958 FTYIKVXJJHYRDT-YJLNNSPDSA-N 417.849 3.227 5 1 HGBF COc1ccc2c3c4c(c5c(ccc6ccn(C)c65)c3n(CCO)c2c1)C(=O)NC4=O 13535061 NYEAMHXTSOXUPE-UHFFFAOYSA-N 413.433 3.324 5 1 HGBF O=C(O)[C@H](Cc1c[nH]c2ccccc12)NSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 103255445 ILPPWXZPWCQGEE-AWEZNQCLSA-N 402.388 3.277 5 1 HGBF CN1CCN(c2ccc3nc(-c4cc([N+](=O)[O-])ccc4N4CCCC4)[nH]c3c2)CC1 587269355 LVXWJSCQIJBYNW-UHFFFAOYSA-N 406.490 3.490 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1ccc(Cl)cc1)[C@@H]([N+](=O)[O-])[C@@H]1CSCN12 169322111 SWMUBZKWOUVLJU-MJQMVNBJSA-N 401.875 3.305 5 1 HGBF COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1cc([N+](=O)[O-])cn1 587388783 GNJRGMDDCXQQQB-FQEVSTJZSA-N 408.414 3.445 5 1 HGBF O=C(N[C@@H]1COc2nc([N+](=O)[O-])cn2C1)OCc1ccc(-c2ccc(F)cc2)cc1 82153605 SHWWYBRMQZBPKK-KRWDZBQOSA-N 412.377 3.285 5 1 HGBF O=C(NC1CCN(Cc2ccccc2)CC1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 103276769 ZVWLEWMOZZCARR-UHFFFAOYSA-N 407.426 3.096 5 1 HGBF O=[N+]([O-])c1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2cc1[N+](=O)[O-] 587006085 BXHZCOMMQIBWMN-UHFFFAOYSA-N 403.152 3.457 5 1 HGBF CCOC(=O)CCC[C@]1(c2ccc(OC)c([N+](=O)[O-])c2)NCCc2c(C)ccnc21 963071213 PXMVUGKTHROGEF-JOCHJYFZSA-N 413.474 3.430 5 1 HGBF O=c1c2cnc3ccccc3c2ncn1CCCN1CCN(c2ccc(F)cc2)CC1 72104828 DAOMOLBXBLWEOI-UHFFFAOYSA-N 417.488 3.296 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc([N+](=O)[O-])c1O 587868787 SLVAQULXVNKVRV-UHFFFAOYSA-N 408.292 3.275 5 1 HGBF COc1cc(C)nc(NC(=S)NC(=O)c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 28565997 FSIYKTAFNCAZBB-UHFFFAOYSA-N 413.415 3.089 5 1 HGBF O=[N+]([O-])c1ccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c2c1 586953383 NFXONMGPEXGRRC-UHFFFAOYSA-N 401.429 3.395 5 1 HGBF Cc1cc2[nH]c(CCC(=O)Nc3nnc(-c4ccncc4)s3)nc2cc1[N+](=O)[O-] 587025305 KXYQNPMYQIQOFX-UHFFFAOYSA-N 409.431 3.264 5 1 HGBF COc1cc(Cl)cc(C=O)c1OCc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 587067322 UIDJFUVCJGYULL-UHFFFAOYSA-N 406.738 3.433 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4ccc(F)c(F)c4[nH]3)CC2)ccc1[N+](=O)[O-] 587263448 UOJZAUFMQYPJHX-UHFFFAOYSA-N 401.373 3.232 5 1 HGBF CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccc(C)cc23)[C@H]1c1cccc([N+](=O)[O-])c1 103202825 TZXKEIOYIGYWMF-MRXNPFEDSA-N 421.409 3.002 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1ccc(OCn4cc([N+](=O)[O-])cn4)cc1)[C@@H](C2)C3=O 587434060 QGEIHKAYCSPSRX-LAUBAEHRSA-N 407.382 3.325 5 1 HGBF COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1[N+](=O)[O-] 40954371 XNYZHBIVYLEBMS-UHFFFAOYSA-N 417.370 3.411 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c(Cc3c([N+](=O)[O-])cnn3C(C)C)nc2c1 587267316 ILBBLJCTXLMAAV-UHFFFAOYSA-N 422.239 3.388 5 1 HGBF Cc1cc(S(N)(=O)=O)c(SCC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl 42879072 ZLLZYYMUEMWCAB-UHFFFAOYSA-N 400.865 3.179 5 1 HGBF CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(C(N)=O)c2[nH]1 587054760 LTYUSEHSZHKVHI-HNNXBMFYSA-N 415.837 3.351 5 1 HGBF COc1cc(N)c(I)cc1-c1nc2ccc([N+](=O)[O-])cc2[nH]1 587178886 NRKZMGBHJGKDBJ-UHFFFAOYSA-N 410.171 3.334 5 1 HGBF C[C@@H]1CC(=O)[C@@H](Cc2nc3c(Br)cnc(Cl)c3[nH]2)[C@@H]1C[N+](=O)[O-] 587264042 QNDDZLRZVIHBGH-GJMOJQLCSA-N 401.648 3.034 5 1 HGBF O=[N+]([O-])c1ccc2[nH]nc(NC3CCN(Cc4ccc5c(c4)OCCO5)CC3)c2c1 28529563 CVCGBWLRYBCWQT-UHFFFAOYSA-N 409.446 3.319 5 1 HGBF Cc1c(Cl)cccc1-n1nnnc1SCC(=O)Nc1ccccc1[N+](=O)[O-] 33817035 UROBAWJBVGELBL-UHFFFAOYSA-N 404.839 3.263 5 1 HGBF O=C(N[C@H](CO)COCc1ccccc1)c1csc(-c2ccccc2[N+](=O)[O-])n1 82085940 WHRWWAOCKONYHF-OAHLLOKOSA-N 413.455 3.026 5 1 HGBF O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)c1coc2cc([N+](=O)[O-])ccc12 587280270 QOOXHSXCDOTJOC-UHFFFAOYSA-N 400.412 3.357 5 1 HGBF COCCCNC(=O)c1c(C(C)(C)C)noc1-c1cc2c(cc1[N+](=O)[O-])OCO2 2483347 OHJRCPCJRMQVRF-UHFFFAOYSA-N 405.407 3.042 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2c(Br)cnc(Cl)c2[nH]1 587264596 GRDVNENGSMCJJK-QMMMGPOBSA-N 412.631 3.230 5 1 HGBF CN(C)S(=O)(=O)c1ccc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c2c1 587270678 YMVMDICQVQLUEB-UHFFFAOYSA-N 423.454 3.450 5 1 HGBF Cc1nc2ccc(Cl)cn2c1-c1ccn(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 28640122 YWSLBNYHOCEYAG-UHFFFAOYSA-N 417.834 3.305 5 1 HGBF COc1ccc([C@H]2N[C@H](c3ccc(OC)cc3)[C@@H]([N+](=O)[O-])C(C)(C)[C@@H]2[N+](=O)[O-])cc1 13154606 PHVJOZFYTCDHBH-UAFMIMERSA-N 415.446 3.406 5 1 HGBF Cn1ccc2ccc3c(c4c(c5c6cccc7c6n(c35)C[C@@H](CO)C7)C(=O)NC4=O)c21 14945618 FMZCXIHHKPGEAD-LBPRGKRZSA-N 409.445 3.488 5 1 HGBF C[C@@H](Nc1ncnc2[nH]c(-c3ccc(CNCC(=O)NO)cc3)cc12)c1ccccc1 138955344 OXCQIYIYJJKVOU-OAHLLOKOSA-N 416.485 3.393 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)n1cc([N+](=O)[O-])c(C)n1 587868986 ZIZWGLFUFOHIJJ-SNVBAGLBSA-N 424.339 3.287 5 1 HGBF CC1(C)CCN(S(=O)(=O)c2cccc(NC(=O)c3ccc([N+](=O)[O-])o3)c2)CC1 1772624920 FVTVAONYIKUKFQ-UHFFFAOYSA-N 407.448 3.251 5 1 HGBF O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccc(O)c3ncccc23)CC1 1857641459 AMIMZSRDAINEBM-BJMVGYQFSA-N 418.453 3.206 5 1 HGBF CCCc1ccccc1OC[C@H](O)COc1ccc2c(O)c([N+](=O)[O-])c(=O)oc2c1 143206099 PMGJSINFNLWHDP-CQSZACIVSA-N 415.398 3.178 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2cccc([N+](=O)[O-])c2)n1 82135813 BTVBTRPTCKLGBV-GASCZTMLSA-N 413.478 3.228 5 1 HGBF COCCCNC(=O)c1cnc(NCc2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 82148305 DOOBHNDINMHXGP-UHFFFAOYSA-N 421.457 3.430 5 1 HGBF COc1cc([N+](=O)[O-])ccc1NC(=O)c1c(C)[nH]c2ccc(S(C)(=O)=O)cc12 587649770 BJTIYDUYGUGYHT-UHFFFAOYSA-N 403.416 3.049 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1nc([N+](=O)[O-])cc1C 587862742 GXZYVHUAGYDKAL-UHFFFAOYSA-N 409.324 3.331 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1-c1nc2cnncc2[nH]1 586948275 GCEXFYYFESKBMO-UHFFFAOYSA-N 410.415 3.037 5 1 HGBF Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 84730132 HDQBNPODSBXIJC-UHFFFAOYSA-N 405.414 3.480 5 1 HGBF CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4081370 OIELNGLIOPIRQE-FUHWJXTLSA-N 417.805 3.157 5 1 HGBF Cc1cc2c(cc1O)[C@H](c1cc(Br)ccc1[N+](=O)[O-])N[C@H](C(=O)O)C2 963487193 CIHPCQQVEHTQAF-XJKSGUPXSA-N 407.220 3.060 5 1 HGBF CN1c2ccccc2N(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](CC(=O)O)c2cccn21 1629074 CVXRUIOICMNZGV-IBGZPJMESA-N 406.398 3.472 5 1 HGBF CN1C(=O)C[C@@H](c2ccccc2)N=C1SCc1cn(-c2cccc([N+](=O)[O-])c2)nn1 1911573827 MYROLRWFEBCOAO-SFHVURJKSA-N 422.470 3.368 5 1 HGBF O=C(N[C@H]1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccc([N+](=O)[O-])cc1 13601551 YQXMAJCEFRAMNB-HXUWFJFHSA-N 418.384 3.280 5 1 HGBF CCN(CC)CCn1c2cc(N3CCCC3)c(N)cc2c(=O)c2c(O)cc(O)cc21 26258075 VGTLYVBDODISGZ-UHFFFAOYSA-N 410.518 3.090 5 1 HGBF C[C@]1(COC(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@]2(C)[C@@H]3COC(=O)C3=C[C@@H](O)[C@@H]12 2356827482 OJYDAIRJVVQDEZ-IYZCWLJXSA-N 415.442 3.038 5 1 HGBF O=C1COc2cc(Br)ccc2N1CCc1nc2cccc([N+](=O)[O-])c2[nH]1 587002647 LVWYQFNKTJCDCM-UHFFFAOYSA-N 417.219 3.202 5 1 HGBF CNC(=O)NCCCCNC(=O)c1c2cc[n+](C)cc2c(C)c2c1[nH]c1ccccc12 1772577966 HMEMEAOFOHEDTR-UHFFFAOYSA-O 418.521 3.046 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ccnc(-c3ccc(C(F)(F)F)nc3)c1)C2 72125227 FWZUBEYPCLRRHM-LBPRGKRZSA-N 407.308 3.107 5 1 HGBF COC(=O)c1cc(Cl)c2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc2c1 587092442 OYUFISKXJIELEF-UHFFFAOYSA-N 403.704 3.337 5 1 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587266434 XPJOEVPVBDFFEC-VIFPVBQESA-N 422.195 3.090 5 1 HGBF CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1c([N+](=O)[O-])cnn1C 587865953 QOKGAGKKCLHXFK-UHFFFAOYSA-N 409.324 3.298 5 1 HGBF CCOC(=O)c1cc(-c2ccccc2)nn1C[C@H](O)COc1ccc([N+](=O)[O-])cc1 40585083 RPRFTFRXVJVARR-KRWDZBQOSA-N 411.414 3.075 5 1 HGBF CCCCCNc1nc(Oc2ccc([N+](=O)[O-])cc2)c2ncn(CC(=O)O)c2n1 66156610 ZSBCBYSRHKWZDZ-UHFFFAOYSA-N 400.395 3.214 5 1 HGBF C[C@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3ncccc3c2[nH]1 587267308 WVFJBPPEDVVBFI-DYZYQPBXSA-N 408.374 3.462 5 1 HGBF CC[n+]1c2ccnc(NCCCNCCCN)c2c(C)c2c3cc(OC)ccc3[nH]c21 28878642 JDSSUUAVIMBBKT-UHFFFAOYSA-O 421.569 3.234 5 1 HGBF CC(C)(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)COC(=O)c1ccc([N+](=O)[O-])o1 66252019 XYQDUAHNHBSSIG-UHFFFAOYSA-N 405.363 3.080 5 1 HGBF COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])c2[nH]c(C)c(NC(C)=O)c2c1 587621622 XIKNENXKJMIZMJ-UHFFFAOYSA-N 418.431 3.152 5 1 HGBF COc1ccc(-c2csc(N3CCC[C@H]3C(=O)NCC(C)C)n2)cc1[N+](=O)[O-] 82192392 KFTGPMCHMHQJTD-HNNXBMFYSA-N 404.492 3.468 5 1 HGBF COC(=O)c1cccc2nc3c(S(=O)(=O)c4ccccc4[N+](=O)[O-])cccc3nc12 103221299 WMAZPIOMHWZHGQ-UHFFFAOYSA-N 423.406 3.311 5 1 HGBF Cc1ccc2cc3c(=O)n(C)cc([C@H]4NCCc5c4c(C(C)C)nn5C)c3nc2c1 962917063 YZTIYDJSUHEVLS-HSZRJFAPSA-N 401.514 3.487 5 1 HGBF CC(=O)N[C@H](Cc1nc2cncc([N+](=O)[O-])c2[nH]1)c1ccc(Br)cc1 586985194 LJTKMPFJKRQNMC-GFCCVEGCSA-N 404.224 3.049 5 1 HGBF CC1(C)C=Cc2c(cc(O)c3c(=O)c4c(C[C@@H](O)C(C)(C)O)c(O)ccc4oc23)O1 13412008 BKIZQFZDTGMFFX-QGZVFWFLSA-N 412.438 3.216 5 1 HGBF biogenic CCOC(=O)CCSc1nc2ccc([N+](=O)[O-])cc2c(=O)n1Cc1ccccc1 49115745 PBROTYHVVQGPEV-UHFFFAOYSA-N 413.455 3.398 5 1 HGBF COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc([N+](=O)[O-])cc2)[nH]1)C(C)C 95604521 SEARVORXMSGLQF-IRXDYDNUSA-N 415.450 3.029 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1-c1nc2c(N)ccnc2[nH]1 586949133 QROKJOAHANVCPY-UHFFFAOYSA-N 424.442 3.225 5 1 HGBF CC(C)S(=O)(=O)Nc1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 586951020 QKIFKBYHGWRPRF-UHFFFAOYSA-N 405.392 3.196 5 1 HGBF CCCc1c2nc(C(=O)O)cc(Br)c2cc2c(=O)cc(C(=O)O)oc12 29236606 NKIBDNKQWZBQIT-UHFFFAOYSA-N 406.188 3.453 5 1 HGBF O=C(NC(=S)Nc1nc2cc([N+](=O)[O-])ccc2s1)c1ccc([N+](=O)[O-])cc1 49088930 CELMPJGRISMDOH-UHFFFAOYSA-N 403.401 3.240 5 1 HGBF Cc1nn(Cc2ccccc2-c2nc3c(S)nc(S)nc3[nH]2)c(C)c1[N+](=O)[O-] 587267428 KLNKIYLCJPZBBB-UHFFFAOYSA-N 413.488 3.367 5 1 HGBF O=C(CCn1ccc([N+](=O)[O-])n1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O 587662270 XXDPKLNRNQDUEP-UHFFFAOYSA-N 407.361 3.038 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c(CNc3ncccc3[N+](=O)[O-])nc2c1 587268389 VBNAPHKEBHMAKH-UHFFFAOYSA-N 420.223 3.417 5 1 HGBF CCc1nc(N)nc(N)c1-c1ccc(NCc2ccc(OC)c(OC)c2)c([N+](=O)[O-])c1 26487424 JMRFJFINEVYIBY-UHFFFAOYSA-N 424.461 3.408 5 1 HGBF O=C(Nc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])n1)c1ccccc1[N+](=O)[O-] 6445505 IBRNTSDETLHNMM-UHFFFAOYSA-N 407.342 3.403 5 3 HGBF aggregator COc1cc([C@H]2NCCc3cc(C)c(F)cc32)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 962303867 XQPXPPHUOQDBGN-ADLMAVQZSA-N 404.394 3.138 5 1 HGBF O=C(N[C@@H](CO)COCc1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085869 KAIQWAHSYIUEKO-INIZCTEOSA-N 413.455 3.026 5 1 HGBF COCCCNC(=O)[C@H](CCSC)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 82195368 LNCKIAOWXHPFCM-HNNXBMFYSA-N 424.548 3.405 5 1 HGBF CSc1nn(-c2ccc([N+](=O)[O-])cc2)c2cc(C(=O)NC3CCNCC3)ccc12 169706030 UBTOLNBEJUVJOJ-UHFFFAOYSA-N 411.487 3.137 5 1 HGBF C[N+]1(CCO[P@](=O)(O)OCCCCCCOc2ccccc2)CCOCC1 27866949 JLIJWFSMDNMILM-UHFFFAOYSA-O 402.448 3.236 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1cccc(Cl)c1)[C@@H]([N+](=O)[O-])[C@H]1CSCN12 221599508 VPJKSHAKFFWUBV-VXIBKDFQSA-N 401.875 3.305 5 1 HGBF CSCC[C@@H](NS(=O)(=O)c1ccccc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 586938041 UHPBBIAPVIBIGD-OAHLLOKOSA-N 406.489 3.244 5 1 HGBF CN(C)C(=O)c1ccc2c(c1)[C@@H](c1cc(Br)ccc1[N+](=O)[O-])NCC2 962930773 ZAYWRXCPLSCVBX-KRWDZBQOSA-N 404.264 3.294 5 1 HGBF Cc1onc(-c2nc3cc(C(=O)O)ccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079689 MAQUKWKPJWHGBC-UHFFFAOYSA-N 402.754 3.031 5 1 HGBF CS(=O)(=O)Nc1ccc(/N=c2/c3ccccc3[nH]c3cc([N+](=O)[O-])ccc23)cn1 26842277 NIINYVUAYHXJJA-UHFFFAOYSA-N 409.427 3.228 5 1 HGBF COc1cccc2c(Nc3ccc(NS(C)(=O)=O)cc3)c3ccc(=O)oc3nc12 40848076 FHBWMQMGINETBF-UHFFFAOYSA-N 411.439 3.465 5 1 HGBF O=[N+]([O-])c1cc(COc2nnnn2-c2ccc(Cl)c(Cl)c2)cc([N+](=O)[O-])c1 169331791 CMFLBQGIBWJXHH-UHFFFAOYSA-N 411.161 3.365 5 1 HGBF COCCOC(=O)C1=C(C)N=C(C)[C@@H](C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 169723651 SVMHYHIZWOJKDL-RTBURBONSA-N 418.446 3.184 5 1 HGBF Cc1cnc(Cl)c2[nH]c(C3CCN(c4ccc([N+](=O)[O-])c(C(N)=O)c4)CC3)nc12 587263179 NUZKVOBOYHDADM-UHFFFAOYSA-N 414.853 3.311 5 1 HGBF CC(=O)Oc1ccc(CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])o2)C(C)(C)C)cc1 66252021 YKAFLCOVAWCCAS-UHFFFAOYSA-N 418.402 3.097 5 1 HGBF CCCCNC(=O)[C@@H](NC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)C(C)C 82082390 WKHSYTLMDKUICG-INIZCTEOSA-N 404.492 3.389 5 1 HGBF O=[N+]([O-])c1ccc(OCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1F 587149369 RIUFUFMWHWJAHV-UHFFFAOYSA-N 410.365 3.249 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@@H]1CCN(CCO)CN1C3 72112301 MASNDWIXAXGDAZ-INIZCTEOSA-N 422.525 3.401 5 1 HGBF Cc1cc(CN2C(=O)/C(=C/C(=O)Nc3ccc([N+](=O)[O-])cc3)c3ccccc32)on1 299855567 BKQVOKOZELKPBE-WOJGMQOQSA-N 404.382 3.460 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCn1cc([N+](=O)[O-])c(C)n1 587868642 NUQXPKOPDRAFJI-UHFFFAOYSA-N 424.339 3.116 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587738364 NONOKKUTWWLIOH-BWKAKNAASA-N 424.201 3.365 5 1 HGBF CCOC(=O)C1=C(N)Oc2n[nH]c(C)c2[C@H]1c1cc(=O)oc2c1ccc1ccccc12 1772623511 DMLHNURHCAFKTM-GOSISDBHSA-N 417.421 3.235 5 1 HGBF O=[N+]([O-])c1cccc2nc(CCNS(=O)(=O)c3c(Cl)cccc3Cl)[nH]c12 586942603 OBXUFAVBUCDZAA-UHFFFAOYSA-N 415.258 3.299 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1ccc(Cl)cc1)[C@H]([N+](=O)[O-])[C@@H]1CSCN12 169322114 SWMUBZKWOUVLJU-DODZYUBVSA-N 401.875 3.305 5 1 HGBF COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCn1cc([N+](=O)[O-])cn1 587388892 HOWMQYWQLPCGPE-LJQANCHMSA-N 424.413 3.434 5 1 HGBF CCCCNC(=O)[C@@H]1CCCN(C(=O)c2csc(-c3ccccc3[N+](=O)[O-])n2)C1 82081428 MSZMFNCDLQTYDL-CQSZACIVSA-N 416.503 3.487 5 1 HGBF CCN1CCN(c2cc(Nc3cccc(C(=O)O)c3)c([N+](=O)[O-])cc2[N+](=O)[O-])CC1 957887836 DUCAXYUHAHVFAI-UHFFFAOYSA-N 415.406 3.087 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(C(F)(F)F)nc3)cn1)C2 66259550 JLNSDSZWGZTMTA-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF COc1cc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2cc1F 587264328 LQZZBQGMVGTJAK-PWJLMRLQSA-N 405.342 3.061 5 1 HGBF COC(=O)c1ccc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2n1 587267262 HWYCUSKXJFXLML-UHFFFAOYSA-N 406.402 3.181 5 1 HGBF CCn1cc([N+](=O)[O-])c(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)n1 587863314 XZYYRTCIXXFCIG-UHFFFAOYSA-N 409.324 3.391 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587733900 PABKNFDBSMMRPA-IWEMQMMOSA-N 424.201 3.365 5 1 HGBF C[C@@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)c1cccc2ccccc12 13863143 CZZNHPRNNMNVIE-AWEZNQCLSA-N 414.439 3.412 5 1 HGBF O=[N+]([O-])c1cc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)nn1CC(F)(F)F 587091098 AVMZIKIOHJSZTR-UHFFFAOYSA-N 415.641 3.311 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c([C@H](C)Cn3cc([N+](=O)[O-])cn3)nc2c1 587277272 RUKPUDJQNPUDOO-MRVPVSSYSA-N 408.212 3.020 5 1 HGBF CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cncc([N+](=O)[O-])c2[nH]1 586934810 AZXZWURUMSYDKI-AWEZNQCLSA-N 409.855 3.195 5 1 HGBF CC(=O)c1ccc2nc(C3CCN(c4ccc([N+](=O)[O-])c(C(N)=O)c4)CC3)[nH]c2c1 587262540 BZGZXLFRUNCMCB-UHFFFAOYSA-N 407.430 3.157 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](NCCCCc1ccc(OC(F)(F)F)cc1)C2 40379535 DDJFWSFJWYXXGK-ZDUSSCGKSA-N 400.357 3.063 5 1 HGBF C[C@H](c1nc2c(Br)cnc(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 587276492 LHTLLNULGJCFFF-RXMQYKEDSA-N 416.033 3.197 5 1 HGBF CCN(CC)S(=O)(=O)c1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 587148843 LQBCLADPHYIVSC-UHFFFAOYSA-N 422.438 3.220 5 1 HGBF O=[N+]([O-])c1cc(C(F)(F)F)cc2c(O)nc(=NCc3ccc4c(c3)OCCO4)oc12 1857549097 PCOMDWYPVRJJQC-UHFFFAOYSA-N 423.303 3.333 5 1 HGBF COc1ccc(-c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2)nn1 5204195 UNSXXPMXJXDSCU-UHFFFAOYSA-N 400.416 3.170 5 3 HGBF O=C1NCc2c1c1c3ccccc3n3c1c1c2c2ccccc2n1CC(=C(CO)CO)C3 28819485 PIIORMMYNVBQNF-UHFFFAOYSA-N 423.472 3.441 5 1 HGBF COc1cc2c(cc1OC)C(=O)[C@H]([C@H](O)C1CC[N+](C)(Cc3ccccc3)CC1)C2 38142506 IBATXZHEHNSLNL-TUHBOQGPSA-N 410.534 3.477 5 1 HGBF C[C@@]1(COc2cccc(-c3ccc(F)nc3F)n2)CCn2cc([N+](=O)[O-])nc2O1 1772583746 HFNAVNFFYSRPCT-SFHVURJKSA-N 403.345 3.147 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ccc(-c3ccc(C(F)(F)F)nc3)cn1)C2 72125836 ATTKGLXTYDFROS-LBPRGKRZSA-N 407.308 3.107 5 1 HGBF CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cncc([N+](=O)[O-])c2[nH]1 586934813 AZXZWURUMSYDKI-CQSZACIVSA-N 409.855 3.195 5 1 HGBF Cc1cc([N+](=O)[O-])nn1CCCC(=O)c1c(CO)oc2cc(Br)cnc12 587274662 YASNNSPBTIJNIQ-UHFFFAOYSA-N 423.223 3.159 5 1 HGBF O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3cc4nc(O)[nH]c4cc3[nH]2)CC1 587271090 ZZKKTYNSFGYICZ-UHFFFAOYSA-N 406.402 3.073 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(C(=S)NCc3ccccc3)CC2)cc1 45348029 ANBPTTVPKDBPRV-UHFFFAOYSA-N 419.528 3.113 5 1 HGBF Cc1c(-c2nc3ccc(S(=O)(=O)O)cc3[nH]2)cc(Br)cc1[N+](=O)[O-] 586980232 STKDQHIYKOBHFL-UHFFFAOYSA-N 412.221 3.456 5 1 HGBF COc1cc([N+](=O)[O-])cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@@H](C)C(=O)O 587390342 PTLIITIQAAIFEE-QFYYESIMSA-N 416.386 3.052 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1cc([N+](=O)[O-])nc1C 587862610 FOAWZHIXIPZXAI-UHFFFAOYSA-N 409.324 3.331 5 1 HGBF Cc1ccn2nc(SCc3nnc(SCc4cccc([N+](=O)[O-])c4)o3)nc2n1 40918714 KVSQIDBJNUOOBZ-UHFFFAOYSA-N 415.460 3.309 5 1 HGBF Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2c(F)cnc(Br)c2[nH]1 587116716 CJSBPQIVDZKDLW-UHFFFAOYSA-N 423.124 3.340 5 1 HGBF CCOC(=O)C(=O)c1c(-c2cc(C)cc([N+](=O)[O-])c2O)[nH]c2cc([N+](=O)[O-])ccc12 587647415 HIQGRXMLSJYZBO-UHFFFAOYSA-N 413.342 3.411 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](NCCCCCc1ccc(OC(F)(F)F)cc1)C2 40379240 HRPXDRRXRVBXNN-AWEZNQCLSA-N 414.384 3.454 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3c(F)cnc(Cl)c3[nH]2)cc([N+](=O)[O-])c1Cl 586925207 FZLXBCKPVQDQIU-UHFFFAOYSA-N 405.194 3.383 5 1 HGBF CCN1C(NCCc2ccc([N+](=O)[O-])cc2)=N[C@@H](c2ccccc2)[C@H](C(=O)OC)[C@H]1C 36379159 MPCBAZVSUBEKIO-HBGVWJBISA-N 424.501 3.337 5 3 HGBF Cc1ccc(S(=O)(=O)Cc2nc3ccc(Br)cn3c2[N+](=O)[O-])cc1 96939365 FMZDGGUASGXMGS-UHFFFAOYSA-N 410.249 3.287 5 1 HGBF O=C(CN1C(=O)[C@H]2CC[C@H](c3ccccc3)C[C@H]2C1=O)Nc1cccc([N+](=O)[O-])c1 100273629 RPHSVRKAPNYPTL-ZYSHUDEJSA-N 407.426 3.102 5 1 HGBF COC(=O)c1cc(OC)n(-c2c([N+](=O)[O-])cc(Br)c(F)c2C)c1OC 587943581 JNXKZXGENFHPCF-UHFFFAOYSA-N 417.187 3.399 5 1 HGBF CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(OC)cc2)c([N+](=O)[O-])c1 26497562 MZYVPYNSNSXNEO-UHFFFAOYSA-N 408.462 3.424 5 1 HGBF CC(=O)N[C@H](Cc1nc2cc([N+](=O)[O-])cnc2[nH]1)c1ccc(Br)cc1 586986409 XFIREDIVAWZPCH-CYBMUJFWSA-N 404.224 3.049 5 1 HGBF O=c1cccc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)n1CCOc1ccccc1Cl 587063879 BKWDGQVDDIORIZ-UHFFFAOYSA-N 411.805 3.427 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587733897 PABKNFDBSMMRPA-GJEGPGMTSA-N 424.201 3.365 5 1 HGBF O=C(NCc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1cccc(C(F)(F)F)c1 587112880 VNJAXIPIBULQOG-UHFFFAOYSA-N 409.280 3.328 5 1 HGBF O=C(O)[C@H]1Cc2c(Cl)cc(F)c(F)c2[C@H](c2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)N1 962956086 BISHORNUJQABKO-BMIGLBTASA-N 413.720 3.123 5 1 HGBF C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(N3CCN(c4ccccn4)CC3)c([N+](=O)[O-])c2)C1 4660422 RJTRUMKWEAYQOL-QZTJIDSGSA-N 423.517 3.435 5 1 HGBF NC(=O)c1cc(N2CCC(c3nc4cc(F)c(F)cc4[nH]3)CC2)ccc1[N+](=O)[O-] 587262484 APUXBQAUFUBEKM-UHFFFAOYSA-N 401.373 3.232 5 1 HGBF C[C@H](O)[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(F)c(F)c(F)c2[nH]1 587264300 LBHXUWWZIQPQBI-DXRPGJJCSA-N 411.296 3.331 5 1 HGBF N=C(N)NS(=O)(=O)c1ccc(NCCc2c3ccccc3nc3ccccc23)cc1 5594115 ZXWHDFAFFXJNMK-UHFFFAOYSA-N 419.510 3.214 5 1 HGBF COc1cc(-c2nnc3ccc(-c4ccc([N+](=O)[O-])cc4)nn23)cc(OC)c1OC 1772653061 YHOQWCRDPLJCRE-UHFFFAOYSA-N 407.386 3.392 5 1 HGBF CNC(=O)NCCOCC[n+]1ccc2c(C)c3c(c(C)c2c1)c1cc(O)ccc1n3C 169350000 KWEGAOJJIBZDSZ-UHFFFAOYSA-O 421.521 3.040 5 1 HGBF CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 586939395 NWZWKHNWWKZNEA-SNVBAGLBSA-N 419.419 3.123 5 1 HGBF O=C1c2cccc([N+](=O)[O-])c2[C@@]2(NCCc3ccc(O)cc32)c2cccc([N+](=O)[O-])c21 963343360 URLLXFULYOIGSB-JOCHJYFZSA-N 417.377 3.191 5 1 HGBF Cn1ccc2ccc3c(c4c(c5c6cccc7c6n(c35)C[C@H](CO)C7)C(=O)NC4=O)c21 14945619 FMZCXIHHKPGEAD-GFCCVEGCSA-N 409.445 3.488 5 1 HGBF COCCOC(=O)C1=C(C)N(c2ccccc2)C(=O)N[C@H]1c1cccc([N+](=O)[O-])c1 3078094 ZULQKYRWBUJZGR-IBGZPJMESA-N 411.414 3.329 5 3 HGBF C[C@H](Oc1ccccc1)C(=O)NCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587225334 PXHFOTIFGUWWGB-JTQLQIEISA-N 419.235 3.317 5 1 HGBF O=C(NCc1ccc(-c2ccc(F)cc2)cc1)O[C@@H]1COc2nc([N+](=O)[O-])cn2C1 73197170 ZRTDQFSXDSBSRZ-KRWDZBQOSA-N 412.377 3.285 5 1 HGBF O=[N+]([O-])c1cccc2nc(-c3ccc4ncc(I)n4c3)[nH]c12 587187662 KQICZPVFSHUAPF-UHFFFAOYSA-N 405.155 3.390 5 1 HGBF COc1ccc(-c2cc(=O)c3c(O)c(OC)c(OC)c(OC)c3o2)cc1[N+](=O)[O-] 40954735 URPOXEZQLLGDMW-UHFFFAOYSA-N 403.343 3.108 5 1 HGBF O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(I)cnc2[nH]1 587158331 CMPPAEYUFMDGNF-UHFFFAOYSA-N 414.134 3.189 5 1 HGBF COc1ccc2c(=O)n3cc(C(=O)NCCCCc4cccnc4)ccc3nc2c1 29553995 DGYJMRJVVGLCDV-UHFFFAOYSA-N 402.454 3.004 5 1 HGBF Cc1onc(-c2nc3cc4c(cc3[nH]2)OCO4)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587079089 GYXADYYJCARYGB-UHFFFAOYSA-N 402.754 3.061 5 1 HGBF C[C@]1(c2ccc(N)c([N+](=O)[O-])c2)N[C@@H](C(=O)O)Cc2c(C(F)(F)F)cc(F)cc21 962697024 BAKFSMSOABDHQE-RHSMWYFYSA-N 413.327 3.197 5 1 HGBF O=[N+]([O-])c1c(CS(=O)(=O)c2ccc(F)cc2)nc2ccc(Br)cn12 96939369 HFMALFQGVZNOMV-UHFFFAOYSA-N 414.212 3.118 5 1 HGBF O=C1N=C2/C(=C/c3cccc([N+](=O)[O-])c3)CNC[C@@H]2[C@H](c2cccc([N+](=O)[O-])c2)N1 169730009 ZKLUDMIJZMEMSE-PLDDMEKUSA-N 407.386 3.011 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587730379 IOSGWAJFFKOXDX-SKLCBMLGSA-N 424.201 3.365 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1c([N+](=O)[O-])c(C)nn1C 587863262 WLZQOFMNEUCRJT-UHFFFAOYSA-N 409.324 3.216 5 1 HGBF O=C(O)c1cccc(C(=O)N2CCN(c3nc4ccccc4c4ccccc34)CC2)n1 1772605423 DLHRCFBPIFOIAW-UHFFFAOYSA-N 412.449 3.444 5 1 HGBF Cc1onc(-c2nc3cc([C@@H](N)N=O)ccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 587078711 AEBZALMPZAJEIJ-AWEZNQCLSA-N 416.785 3.056 5 1 HGBF O=C(O)[C@H]1Cc2cccc(OC(F)(F)F)c2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 962626300 GSSWQTDGRUBHSP-MEBBXXQBSA-N 400.284 3.321 5 1 HGBF COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4050096 AGDOXLRJNKUXCK-HKUYNNGSSA-N 417.849 3.493 5 1 HGBF COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CCN(CCO)CN1C3 72111484 MASNDWIXAXGDAZ-MRXNPFEDSA-N 422.525 3.401 5 1 HGBF O=[N+]([O-])c1ccc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c2c1 586946217 UUTBTUFQOKIQJA-UHFFFAOYSA-N 404.429 3.271 5 1 HGBF O=C1C=C[C@]2(C[C@H](OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@@H](c3ccccc3)O2)O1 1772594051 FCHAFJRGIGCZMO-KZOIKCBQSA-N 407.378 3.491 5 1 HGBF Cc1cc(C)cc(C(=O)N[C@H](CC(N)=O)c2ccc(NCC3CC3)c([N+](=O)[O-])c2)c1 15937554 IZBGQRWUYFTFRN-LJQANCHMSA-N 410.474 3.380 5 3 HGBF Cc1nc(Nc2ccc(Br)cc2Br)c([N+](=O)[O-])c(=O)[nH]1 15974633 YMUORZKXTRCHID-UHFFFAOYSA-N 404.018 3.255 5 3 HGBF O=C(c1cnc(NC2CCCCC2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCOCC1 82147859 BLHKQCMYUFLWFG-UHFFFAOYSA-N 411.462 3.269 5 1 HGBF COCCNc1ncc(C(=O)N[C@@H]2CCCC[C@@H]2C)c(-c2ccc([N+](=O)[O-])cc2)n1 82148357 BZIGGPIHLGZCCD-KBXCAEBGSA-N 413.478 3.419 5 1 HGBF O=C1Nc2ccccc2[C@@]12[C@H](c1ccc(Cl)cc1)[C@H]([N+](=O)[O-])[C@H]1CSCN12 221599061 SWMUBZKWOUVLJU-YWTNHNAXSA-N 401.875 3.305 5 1 HGBF COC(=O)[C@H]1C[C@]23CCC[N+]4([O-])CC[C@]5(c6ccccc6N(C(=O)OC)[C@@]15CC2)[C@@H]34 238772893 LUMKFAALHXMJDY-RMZOGOIOSA-N 412.486 3.103 5 1 HGBF COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4050098 AGDOXLRJNKUXCK-MJGOQNOKSA-N 417.849 3.493 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cccc(-c3ccc(OC(F)F)cn3)c1)C2 66252502 RIGRSJVMDCQKLM-HNNXBMFYSA-N 418.356 3.433 5 1 HGBF CC[C@@H](C)n1ncc(I)c1-c1nc2ncc([N+](=O)[O-])cc2[nH]1 587181542 UTRVPBJSKQWODN-SSDOTTSWSA-N 412.191 3.305 5 1 HGBF C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2nc(Br)c[nH]c-2n1 587266793 OWNURJZVBYGGQP-LURJTMIESA-N 408.172 3.057 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3c(C)ccc(C)c3[nH]2)cc1[N+](=O)[O-] 586940909 JXVBYOYLRIGTRU-UHFFFAOYSA-N 406.489 3.288 5 1 HGBF COc1cc2nc(CC[C@H](N)C(=O)Nc3ccc([N+](=O)[O-])cc3)[nH]c2cc1Cl 587270589 NZDOBMDWMOTZRM-ZDUSSCGKSA-N 403.826 3.032 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1ccc(Sc4nncn4C)c([N+](=O)[O-])c1)[C@@H](C2)C3=O 587451588 JZIXFJAABJTFSI-DJJJIMSYSA-N 424.438 3.372 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3ccc(Cl)cc3[nH]2)cc1[N+](=O)[O-] 586940722 DJTATWLAYHTLCR-UHFFFAOYSA-N 412.880 3.325 5 1 HGBF COC(=O)N1CCN(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)CC1 103245440 ITQULBHDVBLMJV-NYYWCZLTSA-N 410.430 3.135 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(-c3ccccc3NS(=O)(=O)c3ccc(F)cc3)nc2c1 587170269 MNYJVOZZWQQZMJ-UHFFFAOYSA-N 413.390 3.473 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587750856 JWWNRUQOUALYBS-RBHXEPJQSA-N 406.211 3.226 5 1 HGBF O=[N+]([O-])c1ccc(F)cc1OCc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 587158309 BYXAVWUDGZMZHF-UHFFFAOYSA-N 419.312 3.483 5 1 HGBF O=C(O)C[C@H](NC(=O)OCc1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 587202834 LSUNVGQTTPJEEC-AWEZNQCLSA-N 402.338 3.052 5 1 HGBF CCCc1c2nc(C(=O)O)cc(C3OCCCO3)c2cc2c(=O)cc(C(=O)O)oc12 29234705 ICMNLZXTLCLIQU-UHFFFAOYSA-N 413.382 3.126 5 1 HGBF CSc1ccc(S(=O)(=O)NCc2nc3cc(C)cc(C)c3[nH]2)cc1[N+](=O)[O-] 586940737 DVIFDAPCJXTFAB-UHFFFAOYSA-N 406.489 3.288 5 1 HGBF C[C@H]1COC2(CCN(c3cc(=O)c4cc(C(F)(F)F)cc([N+](=O)[O-])c4o3)CC2)O1 1857546667 RYDCGMGCUFPPSQ-JTQLQIEISA-N 414.336 3.452 5 1 HGBF CCCN(CCC)c1c([N+](=O)[O-])cc(S(=O)(=O)NC2CCCC2)cc1[N+](=O)[O-] 13560025 KDROAUQVGSTBNO-UHFFFAOYSA-N 414.484 3.350 5 1 HGBF COc1cc(OC)c(/C=C/S(=O)(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c(OC)c1 96908648 GBKYIWDKCITDAH-VOTSOKGWSA-N 412.395 3.172 5 1 HGBF O=[N+]([O-])c1ccc(Cc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c([N+](=O)[O-])c1 587264220 KJBFHYHAQODZJJ-UHFFFAOYSA-N 421.373 3.029 5 1 HGBF O=c1c2ccccc2n(C[C@H](O)CN2CCC(N3CCCCC3)CC2)c2ccccc12 40402076 IFGBRQCKHUVSIA-OAQYLSRUSA-N 419.569 3.466 5 1 HGBF C[C@H]1C[C@@]2(C[C@@H](C)N1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N2Cc1ccccc1 253666958 RVAVECVILHMNIE-DTVZVWBHSA-N 422.485 3.458 5 1 HGBF CCCCO[C@H](COCc1ccccc1)CO[P@@](=O)(O)OCC[N+](C)(C)C 40878959 RFZBOETUACKJNA-LJQANCHMSA-O 404.464 3.228 5 1 HGBF O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nc(-c2cccc([N+](=O)[O-])c2)cs1 82195442 IWXPQXJUAOPJKA-ZDUSSCGKSA-N 400.382 3.366 5 1 HGBF C[C@H](C(=O)O)N(Cc1ccccc1[N+](=O)[O-])Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 36177251 VPGSWVUHTFUCKH-SNVBAGLBSA-N 422.375 3.394 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCn1nc([N+](=O)[O-])cc1C 587867797 BLIHEUWZZYQGGO-UHFFFAOYSA-N 424.339 3.116 5 1 HGBF CCCCNS(=O)(=O)c1cc([N+](=O)[O-])c(N(CCC)CCC)c([N+](=O)[O-])c1 29487433 XGWXZCXEXUQFEZ-UHFFFAOYSA-N 402.473 3.208 5 1 HGBF CCOc1ccc2nc(Nc3c([N+](=O)[O-])cc([N+](=O)[O-])c4no[n+]([O-])c34)sc2c1 473235346 YUKZPJSEGVZTEH-UHFFFAOYSA-N 418.347 3.030 5 1 HGBF COC(=O)c1ccc2nc(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])[nH]c2c1OC 587136955 MEZKGCHFVFBREM-UHFFFAOYSA-N 402.382 3.350 5 1 HGBF Cc1cc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F 587126537 ZEQQBRJXRBHABO-UHFFFAOYSA-N 401.326 3.103 5 1 HGBF O=C(O)c1cc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c2cc1F 587269775 OTXACYVAWQFYDT-UHFFFAOYSA-N 412.377 3.328 5 1 HGBF C[N+](C)([O-])CCOCCn1nc(OCc2ccccc2)c2cc([N+](=O)[O-])ccc21 40943035 JODSYEVWZZNZMV-UHFFFAOYSA-N 400.435 3.114 5 1 HGBF O=C1C=C[C@@]2(C[C@H](OC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@H](c3ccccc3)O2)O1 1772576536 FCHAFJRGIGCZMO-ADMIDOLJSA-N 407.378 3.491 5 1 HGBF CCOC(=O)N1CCN(c2ccc([C@@H]3CC(c4ccc([N+](=O)[O-])o4)=NO3)cc2)CC1 28961941 RYXHUSLFBJCZEG-SFHVURJKSA-N 414.418 3.332 5 1 HGBF COc1cc2ncc3c(N)nc(-c4cncc(OC[C@@H](C)N)c4)cc3c2cc1OC 49089536 CFWZNCTWCNPULR-GFCCVEGCSA-N 405.458 3.170 5 1 HGBF CCCc1c(O)ccc2c1O[C@@](CS(C)(=O)=O)(c1ccc([N+](=O)[O-])cc1)CC2=O 587488912 SNWMBFPFJULQOE-FQEVSTJZSA-N 419.455 3.158 5 1 HGBF COC(=O)c1cc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2cn1 587268262 ZEPUXPDSYPREKX-UHFFFAOYSA-N 406.402 3.181 5 1 HGBF O=C1C(=O)N(Cc2ccco2)[C@@H](c2cccs2)[C@H]1C(=O)c1cccc([N+](=O)[O-])c1 2218445 ZRMNIEZDAHTATG-IRXDYDNUSA-N 410.407 3.401 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)cc1 586919613 CJTJMRKRCWHZGV-UHFFFAOYSA-N 401.322 3.344 5 1 HGBF CC1=NN(c2ccc(C(=O)O)cc2)C(=O)[C@@H]1CC(=O)Nc1cc(C)c(C)cc1[N+](=O)[O-] 1857599987 PNFBUUIWCMROEV-MRXNPFEDSA-N 424.413 3.277 5 1 HGBF O=C(CNC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)NCC1CCCCC1 82084813 XBEQLAHAMGWEIL-UHFFFAOYSA-N 402.476 3.145 5 1 HGBF CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCn1cnc([N+](=O)[O-])n1 587866148 VPKHIDPDHXHULR-UHFFFAOYSA-N 424.339 3.198 5 1 HGBF CCOC(=O)[C@]1(c2ccc([N+](=O)[O-])cc2)N[C@H](C(=O)C(F)(F)F)Cc2ccccc21 962727937 BGVHTDIGYAMTAT-QFBILLFUSA-N 422.359 3.047 5 1 HGBF Nc1cc([N+](=O)[O-])ccc1[C@H]1N[C@H](C(=O)O)Cc2ccc(Oc3ccc(O)cc3)cc21 962925848 RCLVEQGPDRCIPG-LEWJYISDSA-N 421.409 3.363 5 1 HGBF C[C@](O)(C[S@@](=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28015913 SMQYNPMQOPFYTJ-OLRZCDJHSA-N 416.377 3.111 5 1 HGBF O=c1[nH]c(Nc2ccc3c(c2)CCC3)nc(O)c1CCCOc1ccc([N+](=O)[O-])cn1 28568708 ORQNWAKRVAJHLV-UHFFFAOYSA-N 423.429 3.023 5 1 HGBF O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc(Br)c(F)c3[nH]2)cc1 586919607 CIHLDMDHPIYGJF-UHFFFAOYSA-N 414.212 3.347 5 1 HGBF C[C@](O)(CSc1ccccn1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28016404 LTZBAGVQNRGURC-HNNXBMFYSA-N 401.366 3.490 5 1 HGBF CCOC(=O)C1=C(N)Oc2c(c(=O)[nH]c3ccc(C)cc23)[C@@H]1c1cccc([N+](=O)[O-])c1 103202823 TZXKEIOYIGYWMF-INIZCTEOSA-N 421.409 3.002 5 1 HGBF CN1CCC[C@H]1CCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 169349301 FCWDGRZECVKNPO-SFHVURJKSA-N 400.482 3.215 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC(C)C)C(=N)O1 169730055 ARRRXEMYGJAWIC-DLBZAZTESA-N 404.419 3.479 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c([C@H](C)n3ncc([N+](=O)[O-])c3C)nc2c1 587267369 JNHWLXBCAIVDKR-QMMMGPOBSA-N 408.212 3.134 5 1 HGBF COc1cc([N+](=O)[O-])cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@H](C)C(=O)O 587390344 PTLIITIQAAIFEE-QLJPJBMISA-N 416.386 3.052 5 1 HGBF N[C@@H](CCc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587271014 WSGDICFKMSICJY-ZDUSSCGKSA-N 407.352 3.389 5 1 HGBF N[C@H](Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1ccc(Br)cc1 586997731 SDRJMOGDQOGJME-SNVBAGLBSA-N 406.196 3.384 5 1 HGBF Nc1ccc(-c2ccc3nc([C@@H](N)Cc4ccc(O)c([N+](=O)[O-])c4)[nH]c3c2)cc1N 587263930 IEHZNNYXHXTDQC-INIZCTEOSA-N 404.430 3.251 5 1 HGBF C[C@@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)OC(C)(C)[C@H](O)C5 299836034 XYWJIADIOMLDJB-BJOHPYRUSA-N 412.438 3.490 5 1 HGBF COc1cc(Br)c([C@@H](N)c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc1OC 586976717 XERNEUQTECDRII-OAHLLOKOSA-N 407.224 3.299 5 1 HGBF COc1cc(OC)cc(-c2ccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cc2)c1 45286252 OJWBRGRSFMOCLM-IBGZPJMESA-N 411.414 3.453 5 1 HGBF COCCNC(=O)c1cnc(NCc2ccccc2)nc1-c1cccc([N+](=O)[O-])c1 82136135 DQEIUQZEHNRFHR-UHFFFAOYSA-N 407.430 3.040 5 1 HGBF COc1cc(-c2nc3cc(S(N)(=O)=O)cc4oc5ccccc5n2c34)ccc1O 95588954 ZAOJAPRWNJPRAU-UHFFFAOYSA-N 409.423 3.262 5 1 HGBF O=[N+]([O-])c1ccc2nc(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)[nH]c2c1 586951462 VTZSELOBAGCBNV-UHFFFAOYSA-N 415.475 3.403 5 1 HGBF COCCNc1ccc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1[N+](=O)[O-] 587266409 WHGXYRJZACYODJ-UHFFFAOYSA-N 411.462 3.029 5 1 HGBF CCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 4049547 KUCYLUSPYUOIDA-ICSRJNTNSA-N 411.414 3.332 5 1 HGBF O=C(O)CCCCC[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccnc1 13730230 QQXUFJHFJYXWOJ-MRXNPFEDSA-N 421.475 3.087 5 1 HGBF CCCN(CCC)c1c([N+](=O)[O-])cc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-] 29481247 WPERSSYJIIMYJZ-UHFFFAOYSA-N 402.473 3.160 5 1 HGBF Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)cc12 587037195 FVQHWGVUTOPCOJ-MRVPVSSYSA-N 402.411 3.358 5 1 HGBF Cc1ccc2cc3c(=O)n(C)cc([C@@H]4NCCc5c4c(C(C)C)nn5C)c3nc2c1 962917065 YZTIYDJSUHEVLS-QHCPKHFHSA-N 401.514 3.487 5 1 HGBF COc1ccc(C2=C(c3cc(OC)c(OC)c(OC)c3)C(=O)OC2)cc1[N+](=O)[O-] 27748367 XWHAWFFYARBMRS-UHFFFAOYSA-N 401.371 3.097 5 1 HGBF COCCNc1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 82149876 JRYDJYNMXSRUPU-GJZGRUSLSA-N 413.478 3.228 5 1 HGBF COC(=O)C1=C(C(C)C)NC(=O)N(C(=O)OC(C)C)[C@@H]1c1cccc([N+](=O)[O-])c1 96272064 ZHQUFYKOKIITMM-MRXNPFEDSA-N 405.407 3.289 5 1 HGBF O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 587578289 VVUCEJUNZYUTMW-DYESRHJHSA-N 404.334 3.110 5 1 HGBF N[C@H](N=O)c1ccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c2c1 587269674 LWWZTEWRRQJIFE-GOSISDBHSA-N 408.418 3.215 5 1 HGBF O=[N+]([O-])c1cc([N+](=O)[O-])c(S(=O)(=O)Nc2cccc(F)c2)c(C(F)(F)F)c1 64447100 ZDHKELLQVGOBGO-UHFFFAOYSA-N 409.273 3.462 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])ccc1N1CCC(CO)CC1)[C@@H](C2)C3=O 587434413 UUDJJUAXUDPPJX-MBSDFSHPSA-N 424.453 3.301 5 1 HGBF Cc1cccc([C@@]2(c3ccc([N+](=O)[O-])cc3)N[C@H](C(=O)O)Cc3cc(C)c(O)cc32)n1 963557790 YKTZCDKWGRKPBQ-CVDCTZTESA-N 419.437 3.203 5 1 HGBF O=C(NCCO)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 4055232 LKWJZXYMLVGINO-DOTOQJQBSA-N 424.240 3.102 5 1 HGBF N[C@H](Cc1ccc(I)cc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 587186277 UJUDYHXTQDFEEY-LLVKDONJSA-N 408.199 3.318 5 1 HGBF CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(I)cc2[nH]1 587268475 ZPMNVYIAABRQSW-UHFFFAOYSA-N 411.203 3.444 5 1 HGBF COc1cc2c3c(c1)O[C@H](c1cc(OCCCC(=O)O)ccc1[N+](=O)[O-])[C@@H](C2)C3=O 587432291 JCMPYZANTWLTHI-YCRPNKLZSA-N 413.382 3.336 5 1 HGBF CC(=CCC[C@](C)(Cl)[C@@H](O)Cc1c[nH]c([N+](=O)[O-])c1)CC[C@@H](O)C(C)(C)O 2356828323 CAJMFLABBNVXCD-GJYPPUQNSA-N 402.919 3.462 5 1 HGBF NCC1CCC(CNc2nc(NCc3cc(F)ccc3F)ncc2[N+](=O)[O-])CC1 28898521 GQYODXLHBCMWLI-UHFFFAOYSA-N 406.437 3.452 5 1 HGBF COc1ccc(-c2n[nH]nc2Cc2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-] 84669349 RZTLSKVSDQYDRE-UHFFFAOYSA-N 400.391 3.005 5 1 HGBF COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OCC(F)(F)F)[C@H]1c1cccc([N+](=O)[O-])c1 169723493 SBQMUDOWNMWGOH-ZFWWWQNUSA-N 414.336 3.322 5 1 HGBF COc1cc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2cc1C 587266777 OQMOTDYBXBCREI-QGHHPUGFSA-N 401.379 3.230 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)N(C(=O)OC(C)C)C(=O)N1 96272076 MSKZFZOPRWQKKK-INIZCTEOSA-N 405.407 3.432 5 1 HGBF C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cccc12 587752856 TWDGQSRUKMPDAG-RBHXEPJQSA-N 406.211 3.226 5 1 HGBF Cc1cnc(Cl)c2[nH]c([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)nc12 587266093 ZDZLXCOCYHDTDH-OQPBUACISA-N 406.786 3.270 5 1 HGBF CSCC[C@@H](NS(=O)(=O)c1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 586939188 YRSKZLPNEQIVOU-CYBMUJFWSA-N 424.479 3.383 5 1 HGBF CC[C@H](C)n1ncc(I)c1-c1nc2c([N+](=O)[O-])cncc2[nH]1 587180017 BWSWTCLKZBQSFZ-ZETCQYMHSA-N 412.191 3.305 5 1 HGBF CC1=C(c2ccc3nc(CCOc4cc(C)ccc4[N+](=O)[O-])[nH]c3c2)NNC(=O)C1 587263290 QKWVYROXDPJITH-UHFFFAOYSA-N 407.430 3.157 5 1 HGBF O=C(COc1ccc([N+](=O)[O-])cc1)c1c(CO)oc2cc(Br)cnc12 587272904 DHFKBSVLTXMRPN-UHFFFAOYSA-N 407.176 3.253 5 1 HGBF O=[N+]([O-])c1ccc(-n2cc(CN3CCCN(c4noc5ccccc45)CC3)nn2)cc1 653702394 BWTOGKBYTPCZMW-UHFFFAOYSA-N 419.445 3.029 5 1 HGBF O=C(O)[C@@H]1Cc2c(cnc3ccccc23)[C@@](c2cccc([N+](=O)[O-])c2)(c2ncco2)N1 963229435 WFWCOECTIXUXRD-UGKGYDQZSA-N 416.393 3.022 5 1 HGBF COc1ccc2nc3ccc(C(=O)NCCCCc4cccnc4)cn3c(=O)c2c1 29557120 OYMNICOOAXOYPP-UHFFFAOYSA-N 402.454 3.004 5 1 HGBF C[C@@H](NC(=O)/C=C/c1ccccc1)C(=O)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)s1 40429422 MYSOONWMJUSWRF-BWODNOAJSA-N 423.454 3.270 5 1 HGBF CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(CCc2ccc(C)cc2)c1=N 1857567875 YEFPKAQJAGHWQA-UHFFFAOYSA-N 416.481 3.165 5 1 HGBF COc1ccccc1N1CCN(CC[C@H]2CCc3ccc([N+](=O)[O-])cc3[C@H]2O)CC1 103232410 FMPGJOKHIUMWLA-JPYJTQIMSA-N 411.502 3.412 5 1 HGBF O=[N+]([O-])c1cc2c(NCCc3ccc(Cl)cc3)ncnc2cc1N1CCNCC1 3994909 AZIYFYFVCLBQGM-UHFFFAOYSA-N 412.881 3.256 5 1 HGBF COc1cc([N+](=O)[O-])cc(OC)c1[C@@H]1N[C@H](C(=O)C(F)(F)F)Cc2ccccc21 962715021 SQOPEWDZIMLHQX-SUMWQHHRSA-N 410.348 3.347 5 1 HGBF CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)C(F)(F)C1 587131962 GUQSOYBXDHWDAE-QMMMGPOBSA-N 413.337 3.349 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c([C@H](C)n3cc([N+](=O)[O-])cn3)nc2c1 587275324 BWMXKVXGDLDYMU-QMMMGPOBSA-N 408.212 3.216 5 1 HGBF COc1cc2c(=O)n(CCCO)c3c4cc5c(cc4ccc3c2cc1OC)OCO5 1857634564 VQCOLUXRDPSGDL-UHFFFAOYSA-N 407.422 3.436 5 1 HGBF O=C(N[C@H](CO)COCc1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 82085868 KAIQWAHSYIUEKO-MRXNPFEDSA-N 413.455 3.026 5 1 HGBF CS(=O)(=O)c1cc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc([N+](=O)[O-])c1Cl 586925824 JJXJFGHISNHYBO-UHFFFAOYSA-N 414.758 3.242 5 1 HGBF O=C1C[C@@H](N(OCc2ccccc2)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)N1 653742630 BUXZQGJFLDFXIB-OAHLLOKOSA-N 409.320 3.034 5 1 HGBF O=[N+]([O-])c1cnc2[nH]c(-c3sccc3S(=O)(=O)NCc3cccs3)nc2c1 586946826 SXEWPKZVLUVBCG-UHFFFAOYSA-N 421.485 3.135 5 1 HGBF Cc1cc2[nH]c([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)nc2cc1[N+](=O)[O-] 587266614 LSRGTZMFASNSOQ-JDNHERCYSA-N 416.350 3.130 5 1 HGBF O=[N+]([O-])c1ccc(-c2nnc(NCc3cn(Cc4ccc(F)cc4)nn3)s2)o1 73278916 CBNSGSZABVCFIZ-UHFFFAOYSA-N 401.383 3.097 5 1 HGBF CS(=O)(=O)c1ccc(C(=O)CCc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1 586924993 DPHCIDQPBCMILS-UHFFFAOYSA-N 407.835 3.344 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1ccc([N+](=O)[O-])cc12 587750857 JWWNRUQOUALYBS-WNWIJWBNSA-N 406.211 3.226 5 1 HGBF O=[N+]([O-])c1cnc(/C=C/c2ccc(F)cc2)n1CCn1cc(-c2ccccn2)nn1 1857651821 SAFBPPFNIHFTLP-RMKNXTFCSA-N 405.393 3.455 5 1 HGBF N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cc([N+](=O)[O-])cnc2[nH]1 586999735 BXLUGGWKHYXGLX-LBPRGKRZSA-N 401.224 3.352 5 1 HGBF C[C@@](O)(CSc1ccccn1)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 28016399 LTZBAGVQNRGURC-OAHLLOKOSA-N 401.366 3.490 5 1 HGBF COc1ccccc1N1CCN(CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 29135637 BRNCBKSQFYMZBG-UHFFFAOYSA-N 407.474 3.386 5 1 HGBF CN1CCN(c2ccc(NC(=O)c3ccc4ccccc4c3O)cc2[N+](=O)[O-])CC1 169323613 LBQMKYYXDMOYRW-UHFFFAOYSA-N 406.442 3.458 5 1 HGBF CCOC(=O)c1cc(Br)c2[nH]c(-c3cnc(N)c([N+](=O)[O-])c3)nc2c1 587268169 MRQXLUPBYSJOFD-UHFFFAOYSA-N 406.196 3.055 5 1 HGBF COC(=O)[C@@]1(c2ccc([N+](=O)[O-])cc2)C[C@@H]1CN1CCC(O)(c2ccccc2)CC1 28634753 BBKFUZZJHOHATF-AUSIDOKSSA-N 410.470 3.009 5 1 HGBF Cc1c(-c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)sc2ncnc(N3CCOCC3)c12 1857755771 QAPVCUOGIDDCAY-UHFFFAOYSA-N 424.442 3.462 5 1 HGBF COc1cc2c(c(OC)c1OC)C[C@H]1c3c(c(OC)c4c(c3-2)OCO4)CC[N+]1(C)[O-] 85996673 KVRQAVLXNPXEES-JRQMZCAUSA-N 415.442 3.214 5 1 HGBF CCOC(=O)c1cc(-c2ccccc2)nn1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 40754065 SUCVPYVQFYCKKB-MRXNPFEDSA-N 411.414 3.075 5 1 HGBF CCOC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1cc(C)cc([N+](=O)[O-])c1O 587639058 ZYOBBHSLZRGECJ-UHFFFAOYSA-N 412.354 3.196 5 1 HGBF CC(C)NC(=O)OCC1=C(COC(=O)NC(C)C)[C@H](c2ccccc2)[N@@+](C)([O-])C1 299804662 SDIAALDEQNWSDC-CYFREDJKSA-N 405.495 3.252 5 1 HGBF Cc1ccc2c(ccc3nc(CC[C@H](N)C(=O)Nc4ccc([N+](=O)[O-])cc4)[nH]c32)n1 587273198 RNPDNIUIMQRMTB-INIZCTEOSA-N 404.430 3.226 5 1 HGBF COc1ccc2nc3oc(=O)ccc3c(Nc3ccc(NS(C)(=O)=O)cc3)c2c1 40379581 DIGGPURKMXHGBM-UHFFFAOYSA-N 411.439 3.465 5 1 HGBF O=C(CSc1nnc(-c2cc3ccccc3oc2=O)o1)Nc1ccc([N+](=O)[O-])cc1 103195720 MEZMIOOUIZDSPE-UHFFFAOYSA-N 424.394 3.482 5 1 HGBF N[C@@H](Cc1cccc(Br)c1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 586983801 JBZBNKIXUHNNEZ-JTQLQIEISA-N 406.196 3.384 5 1 HGBF CCCC[C@H](CC)C(=O)OC[C@]1(CO)C/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1 45495725 AQWODVHYXIDBMB-OSZUCUMASA-N 405.447 3.416 5 1 HGBF C[C@H]1C[C@H](C)CN(C(=O)c2ccc(N3CCN(c4ccccn4)CC3)c([N+](=O)[O-])c2)C1 4660420 RJTRUMKWEAYQOL-ROUUACIJSA-N 423.517 3.435 5 1 HGBF Cc1nc2ccccc2c(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)c1O 653857060 XSBIZNZLZBNUAG-UHFFFAOYSA-N 421.457 3.161 5 1 HGBF Cc1nc(NS(C)(=O)=O)sc1-c1nc2c3cccnc3c3ncccc3c2[nH]1 586951648 SQDMPLDTBDUNQY-UHFFFAOYSA-N 410.484 3.463 5 1 HGBF COc1cc2oc3cc(OCCCCCO[N+](=O)[O-])cc(O)c3c(=O)c2cc1OC 1857630511 OJXGJXPVXQLMKH-UHFFFAOYSA-N 419.386 3.426 5 1 HGBF CCCC[C@H](CC)C(=O)OC[C@@]1(CO)C/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1 45495729 AQWODVHYXIDBMB-UKIQDEFRSA-N 405.447 3.416 5 1 HGBF O=[N+]([O-])c1cccc(S(=O)(=O)n2c(CCc3ccccn3)nc3ccccc32)c1 26651166 DMKVPVXINDFVCV-UHFFFAOYSA-N 408.439 3.362 5 1 HGBF O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1c(F)cc([N+](=O)[O-])cc12 587567932 FWYIVTSSYGQUIB-KKSFZXQISA-N 422.324 3.249 5 1 HGBF CCCCO[C@@H](COCc1ccccc1)CO[P@@](=O)(O)OCC[N+](C)(C)C 40878954 RFZBOETUACKJNA-IBGZPJMESA-O 404.464 3.228 5 1 HGBF COc1cc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2cc1F 587264330 LQZZBQGMVGTJAK-ZKANADHPSA-N 405.342 3.061 5 1 HGBF CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 587267379 JOKDNBZYSHFMQX-UHFFFAOYSA-N 408.212 3.300 5 1 HGBF O=C(O)[C@@H]1Cc2cccc(OC(F)(F)F)c2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 962626302 GSSWQTDGRUBHSP-ZUZCIYMTSA-N 400.284 3.321 5 1 HGBF Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)cc12 587037198 FVQHWGVUTOPCOJ-QMMMGPOBSA-N 402.411 3.358 5 1 HGBF O=C1c2cccc([N+](=O)[O-])c2[C@]2(NCCc3ccc(O)cc32)c2cccc([N+](=O)[O-])c21 963343361 URLLXFULYOIGSB-QFIPXVFZSA-N 417.377 3.191 5 1 HGBF NC1=N[C@@H](c2ccc([N+](=O)[O-])cc2)NC(NCCc2ccc(Cl)c(Cl)c2)=N1 71294703 SWYBTOOYUCNLTC-OAHLLOKOSA-N 407.261 3.006 5 1 HGBF COC(=O)c1cc(Br)c2[nH]c(CNc3ncccc3[N+](=O)[O-])nc2c1 587267844 HBCDLHDAESLYGO-UHFFFAOYSA-N 406.196 3.027 5 1 HGBF O=C(O)C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl 1857752014 RQLHTMJZTODOCE-AWEZNQCLSA-N 419.242 3.396 5 1 HGBF Cc1nn(C)c(C)c1Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H](C4)[C@H]3C2=O)cc1[N+](=O)[O-] 104798577 VHPKSXBBZWUYIL-HLNSBACISA-N 407.430 3.000 5 1 HGBF C[C@@H]1Oc2cc3oc4c5c(c(O)cc4c(=O)c3c(O)c2C1(C)C)OC(C)(C)[C@@H](O)C5 299836038 XYWJIADIOMLDJB-VFZGTOFNSA-N 412.438 3.490 5 1 HGBF COc1ccc(-c2nnc3sc(-c4ccc(OC)c([N+](=O)[O-])c4)nn23)cc1OC 1857630731 HGAQMFJRJVBUDJ-UHFFFAOYSA-N 413.415 3.454 5 1 HGBF COc1cc2c(=O)n(CCN(C)C)c3c(cnc4cccc([N+](=O)[O-])c43)c2cc1OC 26994903 MJPRKMPPQYLZHD-UHFFFAOYSA-N 422.441 3.190 5 1 HGBF N[C@@H](CCc1nc2c(Cl)cnc(Cl)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587270531 LXDXZTWQQPYARI-NSHDSACASA-N 409.233 3.072 5 1 HGBF Cc1nnc(SC[C@](C)(O)C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)s1 28094094 MPCNDLVBUWRIHK-ZDUSSCGKSA-N 422.410 3.255 5 1 HGBF Cc1ccc(Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)NC(=O)NCC(C)C)cc1 40565866 CLKRNYWCCLZOLQ-UHFFFAOYSA-N 406.464 3.291 5 1 HGBF CS(=O)(=O)Nc1ccc(-c2nc3c([N+](=O)[O-])cc(Br)cc3[nH]2)cc1 586950103 ADWRQNOMDZXRIY-UHFFFAOYSA-N 411.237 3.272 5 1 HGBF COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)n1nc([N+](=O)[O-])cc1C 587868484 MMWNSFSCEFSVTH-JTQLQIEISA-N 424.339 3.287 5 1 HGBF O=C(Nc1ccc(Cl)cc1)c1cn(CCO)c2c(cc(O)c3ncccc32)c1=O 103292153 RLVLPOVQXRQBQL-UHFFFAOYSA-N 409.829 3.153 5 1 HGBF O=[N+]([O-])c1cn2c(n1)[S@@](=O)C[C@@H](OCc1ccc(OCc3ccccc3)cc1)C2 40933984 SZJFIYHXCJWTAT-RBSBEOHCSA-N 413.455 3.077 5 1 HGBF O=C(/C=C/C=C/c1ccc2c(c1)OCO2)OCc1cn(-c2ccc([N+](=O)[O-])cc2)nn1 299862729 NSZQVRKRIKHXMV-ZPUQHVIOSA-N 420.381 3.217 5 1 HGBF O=[N+]([O-])c1cc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2cc1[N+](=O)[O-] 587085547 ZEDGRJZEAPRABP-UHFFFAOYSA-N 403.786 3.207 5 1 HGBF O=C(NCCF)c1cc(-c2c(O)cc(O)cc2Oc2ccc([N+](=O)[O-])cc2)on1 96939871 GOBZONJCQIFXET-UHFFFAOYSA-N 403.322 3.153 5 1 HGBF O=C(Cc1ccccc1)NCCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 587229004 XMBYNAPZDQPMTI-UHFFFAOYSA-N 403.236 3.135 5 1 HGBF O=c1oc(Nc2ccccc2I)nc2cc([N+](=O)[O-])ccc12 1485517 FPVBAAYYWDYGKN-UHFFFAOYSA-N 409.139 3.444 5 1 HGBF CN(C)CCNC(=O)c1ccc(NCc2ccncc2)c2c(O)c3ccccc3nc12 299861297 IEAJZIHVSPTQIQ-UHFFFAOYSA-N 415.497 3.392 5 1 HGBF Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Sc3nncn3C)c([N+](=O)[O-])c1)O2 587409067 GADJBSNHYZSIIC-MRXNPFEDSA-N 411.443 3.472 5 1 HGBF C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1cc(F)c([N+](=O)[O-])cc12 587733892 PABKNFDBSMMRPA-BWKAKNAASA-N 424.201 3.365 5 1 HGBF CC(=O)NCCNc1ncc(-c2nc(C)c(C)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 82221443 HDWJUFVZCLPGNN-UHFFFAOYSA-N 412.475 3.340 5 1 HGBF CC(C)c1s/c(=N\S(=O)(=O)c2cccc([N+](=O)[O-])c2)n(C)c1C(F)(F)F 14944858 VGHZPJFAGPDRIR-AQTBWJFISA-N 409.411 3.427 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(OC(F)F)cc3)cn1)C2 66261954 WIUAQBGBICXBTC-INIZCTEOSA-N 418.356 3.433 5 1 HGBF Cc1cc2[nH]c([C@@H](C)n3ncc(I)c3C)nc2cc1[N+](=O)[O-] 587181772 CLEHNPBIJCOWNV-SECBINFHSA-N 411.203 3.498 5 1 HGBF CN1CCC[C@@H]1CCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 169349300 FCWDGRZECVKNPO-GOSISDBHSA-N 400.482 3.215 5 1 HGBF COc1cc2c(cc1OC)C[N@+](C)(CCCCCc1cccc(OC)[n+]1C)CC2 299844630 MBZYGGWJVSHAQB-AREMUKBSSA-N 400.563 3.453 5 1 HGBF C[C@@H]1CC(=O)[C@H](Cc2nc3c(Cl)c(Br)cnc3[nH]2)[C@H]1C[N+](=O)[O-] 587264752 SMMAJHXMMXZHGZ-PRJMDXOYSA-N 401.648 3.034 5 1 HGBF Cc1cc2[nH]c(Cn3c(=O)cc(C(F)(F)F)c4c(C)nn(C)c43)nc2cc1[N+](=O)[O-] 587129202 VGZGNEUXJCPPJM-UHFFFAOYSA-N 420.351 3.203 5 1 HGBF Cc1nn(C)c(C)c1Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)cc1[N+](=O)[O-] 4684246 VHPKSXBBZWUYIL-GGNLRSJOSA-N 407.430 3.000 5 1 HGBF O=C(c1ccc(Cn2cnc([N+](=O)[O-])n2)cc1)n1nc2cc1Oc1ccc(F)cc1-2 587876104 ZBIQOHKUAHIBEA-UHFFFAOYSA-N 406.333 3.031 5 1 HGBF COc1cccc2cc3c(nc12)[C@@H](c1coc2ccc([N+](=O)[O-])cc2c1=O)NCC3 963056788 MVAOPVRCKRQJCP-OAQYLSRUSA-N 403.394 3.493 5 1 HGBF O=C(CNC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1)NCCC1=CCCCC1 82084806 MKPDSXRDCFACOM-UHFFFAOYSA-N 414.487 3.455 5 1 HGBF CCCCNC(=O)[C@H]1CCCN1C(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 82085369 UDCDPOYWZBHTLQ-MRXNPFEDSA-N 402.476 3.239 5 1 HGBF COc1cc(OC)c2[nH]c(-c3cc([N+](=O)[O-])c(Cl)c(S(C)(=O)=O)c3)nc2c1 586927823 WQTUPPZELYCDKY-UHFFFAOYSA-N 411.823 3.212 5 1 HGBF COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1cc([N+](=O)[O-])c(C)n1 587862687 FQUKOZYHPPCNES-UHFFFAOYSA-N 409.324 3.331 5 1 HGBF CCCC[C@@H](CC)C(=O)OC[C@]1(CO)C/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O1 45498270 AQWODVHYXIDBMB-KPMHLKNASA-N 405.447 3.416 5 1 HGBF COc1ccccc1N1CCN(CC[C@@H]2CCc3ccc([N+](=O)[O-])cc3[C@H]2O)CC1 103232408 FMPGJOKHIUMWLA-MBSDFSHPSA-N 411.502 3.412 5 1 HGBF Cc1nn(C)c(C)c1Nc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1[N+](=O)[O-] 13133326 VHPKSXBBZWUYIL-VUWOVVPOSA-N 407.430 3.000 5 1 HGBF CCCCCCOC(=O)[C@@H](C(=O)O[C@H]1C[C@H]2[C@@H]3O[C@@H]3[C@@H](C1)[N+]2(C)C)c1ccccc1 103227270 YZSQAUILEKBORC-KINXCBNHSA-N 416.538 3.194 5 1 HGBF Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1-c1nc2cc(N)ncc2[nH]1 586948457 IOVOFXNKGRGGNI-UHFFFAOYSA-N 424.442 3.225 5 1 HGBF CCOC(=O)C(C(=O)OCC)c1[nH]c2cccc([N+](=O)[O-])c2c1CC(F)(F)F 587646408 RVDQWDHFCBZFPD-UHFFFAOYSA-N 402.325 3.391 5 1 HGBF COC(=O)[C@@]1(c2ccc([N+](=O)[O-])cc2)C[C@H]1CN1CCC(O)(c2ccccc2)CC1 28634759 BBKFUZZJHOHATF-WMZHIEFXSA-N 410.470 3.009 5 1 HGBF CCOC(=O)[C@H]1[C@H](C(=O)c2ccc([N+](=O)[O-])cc2)[C@]12C(=O)Nc1ccc(Cl)cc12 473150561 MKDRDSVGOWVPAT-QINHECLXSA-N 414.801 3.130 5 1 HGBF N[C@@H](CCc1nc2cccc(C(F)(F)F)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 587270538 MMYVGIKMOPVBBR-ZDUSSCGKSA-N 407.352 3.389 5 1 HGBF COc1ccc2c(Nc3ccc(NS(C)(=O)=O)cc3)c3ccc(=O)oc3nc2c1 40848075 NIVGZNAFLFOONA-UHFFFAOYSA-N 411.439 3.465 5 1 HGBF O=C1N=C2/C(=C/c3cccc([N+](=O)[O-])c3)CNC[C@@H]2[C@@H](c2cccc([N+](=O)[O-])c2)N1 169730007 ZKLUDMIJZMEMSE-UBAQAOMRSA-N 407.386 3.011 5 1 HGBF COC(=O)c1cccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 587270627 XFPOHVZMXLHNJT-UHFFFAOYSA-N 408.414 3.278 5 1 HGBF C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1c([N+](=O)[O-])cc(F)cc12 587730358 IOSGWAJFFKOXDX-BWKAKNAASA-N 424.201 3.365 5 1 HGBF CCCCNC(=O)[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C 82082244 HJTNLPAYRZVJCV-MRXNPFEDSA-N 404.492 3.389 5 1 HGBF CCCCN(CCCC)CCCNC(=O)[C@H]1CC(c2cccc([N+](=O)[O-])c2)=NO1 8829404 TVBRUJPZIZRJLO-HXUWFJFHSA-N 404.511 3.496 5 3 HGBF CCN(CC)CCn1ccc(=O)c2cc3c(=O)ccn(CCN(CC)CC)c3c(C)c21 1629465 WPBJWZUIXYBIHI-UHFFFAOYSA-N 424.589 3.308 5 1 HGBF CCNCCn1c(=O)c2cc(OC)c(OC)cc2c2cnc3cc4c(cc3c21)OCO4 28522567 GMUDTVNHMSFVLQ-UHFFFAOYSA-N 421.453 3.058 5 1 HGBF COc1cc2oc3cc(OCCCCO[N+](=O)[O-])cc(O)c3c(=O)c2cc1OC 1857748923 LVQSMUXJAOUNHM-UHFFFAOYSA-N 405.359 3.036 5 1 HGBF COCCOC(=O)C1=C(C)N(c2ccccc2)C(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1 3078093 ZULQKYRWBUJZGR-LJQANCHMSA-N 411.414 3.329 5 3 HGBF N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Br)c(F)c(F)c2[nH]1 587266391 VNOLKBUEJRLRNU-QMMMGPOBSA-N 413.178 3.460 5 1 HGBF CC1=C(c2ccc3nc(CN(C)c4cc(C)c(F)cc4[N+](=O)[O-])[nH]c3c2)NNC(=O)C1 587136687 IOIUJGRBAGZZJT-UHFFFAOYSA-N 424.436 3.311 5 1 HGBF COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(Cn4ccc([N+](=O)[O-])n4)c1)[C@@H](C2)C3=O 587432042 TZROWAMYAQAEGM-AOMKIAJQSA-N 421.409 3.346 5 1 HGBF CCOC(=O)C(C(=O)OCC)c1[nH]c2cc([N+](=O)[O-])ccc2c1CC(F)(F)F 587646607 XFQKBCAFODFBLR-UHFFFAOYSA-N 402.325 3.391 5 1 HGBF O=[N+]([O-])c1cccc(-c2noc([C@@H]3C[C@H](O)CN3Cc3c[nH]c4ccccc34)n2)c1 2356836622 AGHAFRLWWAYIOG-LPHOPBHVSA-N 405.414 3.434 5 1 HGBF COCCNc1ncc(C(=O)NCc2ccccc2)c(-c2cccc([N+](=O)[O-])c2)n1 82135893 VZTQQMXPTAWGKG-UHFFFAOYSA-N 407.430 3.040 5 1 HGBF C[C@@H](Sc1nc(N)cc(O)n1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 586961580 KERHIJZJHQUOTQ-RXMQYKEDSA-N 411.241 3.165 5 1 HGBF CCc1nc(-c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)sc1C(=O)N1CCCCC1 84690549 RSFGEIMRRNTSHK-UHFFFAOYSA-N 423.516 3.310 5 1 HGBF CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)n2c(cc(=O)[nH]c2=S)N1 8830405 LTJDDPGANWGWHY-INIZCTEOSA-N 402.432 3.055 5 3 HGBF O=[N+]([O-])c1cccc(/C=C2\CNC[C@@H]3C2=NC(=S)N[C@H]3c2cccc([N+](=O)[O-])c2)c1 169729961 XUWVLBDHXAMFMC-DRRZOZHPSA-N 423.454 3.176 5 1 HGBF C[C@@H](O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(F)cnc(Cl)c2[nH]1 587266938 QOTDPOASIFDYGN-KBUNVGBDSA-N 410.749 3.101 5 1 HGBF COCCOc1cc2ncnc(Nc3ccc(C)c([N+](=O)[O-])c3)c2c2c1OCCO2 653871506 FSRMUDDPGLEQSI-UHFFFAOYSA-N 412.402 3.386 5 1 HGBF O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(C(F)(F)F)cn3)cn1)C2 66259505 KVOWQFVORKBHFW-AWEZNQCLSA-N 421.335 3.245 5 1 HGBF Cn1c([N+](=O)[O-])cnc1[S@](=O)CCCCCCCOc1ccccc1[N+](=O)[O-] 169347004 JEGFARDNTLHTSU-MUUNZHRXSA-N 410.452 3.374 5 1 HGBF O=c1c2ccc3sc4ccccc4c4ccc(c(=O)n1CN1CCNCC1)c2c34 95588140 WIUUATIHYAEWAU-UHFFFAOYSA-N 401.491 3.183 5 1 HGBF Cc1nn2c(SCC(=O)Nc3cccc(Cl)c3)nc3ccccc3c2nc1=O 98083458 ZMOKBNRSOPWHEF-UHFFFAOYSA-N 411.874 3.330 5 1 HGBF O=C(COc1ccc2c(c1)oc(=O)c1ccccc12)NCC1CCC(C(=O)O)CC1 2124662 XHVFBECDJUGMAD-UHFFFAOYSA-N 409.438 3.332 5 3 HGBF biogenic