smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC1CCC(NCCOC(=O)c2ccc([N+](=O)[O-])cc2)CC1 1710471 LGFGMQMMCBQTPS-UHFFFAOYSA-N 306.362 2.920 5 40 DFBB Cn1c2ccccc2c2nn3c(-c4ccccc4)nnc3nc21 1731281 XBGFFVZKERAEQJ-UHFFFAOYSA-N 300.325 2.831 5 40 DFBB Cc1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)no1 4863353 ZQZICAATTKNYHB-UHFFFAOYSA-N 316.317 2.744 5 40 DFBB CCC[C@@H](C)NC(=O)/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2 8937253 VVXKXLJVMZNCAB-BRAIEQGRSA-N 306.318 2.642 5 40 DFBB Cc1noc(/C=C\c2ccc(OCC(=O)O)cc2)c1[N+](=O)[O-] 408543224 NUQASGGGNJCQIF-DAXSKMNVSA-N 304.258 2.525 5 40 DFBB Cc1cccc(COc2cc(O)c(C(=O)O)cc2[N+](=O)[O-])c1 216932937 PNGXWSQRUSERIE-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB Cn1c(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)nnc1C1CC1 195550086 ZPXXOSRMHGRNPY-UHFFFAOYSA-N 315.377 2.626 5 40 DFBB O=[N+]([O-])c1c(N2CCC(c3nc[nH]n3)CC2)ccc2ncccc12 81036763 SCPRRWWEFDSJTO-UHFFFAOYSA-N 324.344 2.645 5 40 DFBB CC(C)(C)c1ccc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1 9685560 MOGZCPDDWDEUOA-UHFFFAOYSA-N 314.341 2.937 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1S(=O)(=O)Nc1cccc(F)c1 12679617 ZQCVFIMSWLYOIS-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB Cc1sc(C(=O)NC[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] 48380416 RXKDTCTUIKWXOM-NSHDSACASA-N 323.374 2.590 5 40 DFBB OCSc1ccc2nc3cc(SCO)ccc3nc2c1 3843430 YZHRDDRMRAGMMK-UHFFFAOYSA-N 304.396 2.867 5 40 DFBB biogenic CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H]2CCCC[C@H]2C1 195576751 IUPDFKSMGCABIG-RYUDHWBXSA-N 324.402 2.625 5 40 DFBB CCOC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 14291382 RCPGQKHRIOCLOL-UHFFFAOYSA-N 304.258 2.617 5 40 DFBB CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CCCCC1 6001538 VVNYCZXZLHUHIF-CQSZACIVSA-N 308.378 2.599 5 40 DFBB Cc1nc2c(c(=O)c3ccccc3n2C)c(=O)n1-c1ccccc1 2212799 DUBNONWWMOUVDR-UHFFFAOYSA-N 317.348 2.546 5 40 DFBB Cc1ccc(N(C(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)cc1 69593671 SXAMQYRSHCTFFE-UHFFFAOYSA-N 302.334 2.541 5 40 DFBB C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccs1 8562456 OGBLEHDOFXIJAO-JTQLQIEISA-N 306.343 2.740 5 40 DFBB Cc1ncc(C(=O)OCc2ccc([N+](=O)[O-])c(C)c2)c(C)n1 97080335 CNJZSZPZDRZLMH-UHFFFAOYSA-N 301.302 2.667 5 40 DFBB COc1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1NC(C)=O 24214402 QBYNOABALATGPE-UHFFFAOYSA-N 302.290 2.700 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COc1cccnc1Cl 77494669 RQAVANMTYIIUTO-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB O=c1c2ccccc2c2ccccc2c(=O)n1CN1CCCCC1 227173781 KLVLJBUIFDBKMA-UHFFFAOYSA-N 320.392 2.958 5 40 DFBB CN(C)Cc1ccc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1 166142240 XRRSXXITIOFMAA-UHFFFAOYSA-N 315.329 2.614 5 40 DFBB CCCc1ccc(-c2cc(NC(=O)[C@H]3C[C@H]3[N+](=O)[O-])[nH]n2)cc1 57205619 QSETWVXEHOCNHR-GXTWGEPZSA-N 314.345 2.633 5 40 DFBB O=C(Nc1cccc(F)c1)c1cccc([N+](=O)[O-])c1C(=O)O 4744999 LWSJSIAAPCLKGO-UHFFFAOYSA-N 304.233 2.684 5 40 DFBB COc1ccccc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 17971955 JCNRUBOYBSARIV-JTQLQIEISA-N 316.313 2.800 5 40 DFBB Cc1cc(N2C(=O)CS[C@@H]2c2ccc([N+](=O)[O-])cc2)no1 18199880 JSUHNVQZLZFYFK-CYBMUJFWSA-N 305.315 2.670 5 40 DFBB C[C@@]1(c2ccccc2)NC(=S)N(c2ccc([N+](=O)[O-])cc2)N1 225345857 BBUFNNIOOPHHRD-OAHLLOKOSA-N 314.370 2.667 5 40 DFBB CSC[C@H](C)N(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C 96443424 XNDMUTYNHOHXFV-NSHDSACASA-N 311.407 2.525 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1ccccc1F 5971140 VRPUBEOXIUVLAV-VIFPVBQESA-N 305.265 2.535 5 40 DFBB CCc1nc(CCNC(=O)c2ccccc2[N+](=O)[O-])cs1 69706831 FNLYJTQLVQPNQC-UHFFFAOYSA-N 305.359 2.586 5 40 DFBB COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 72331454 IMMYOEOQTZQRIQ-UHFFFAOYSA-N 316.313 2.542 5 40 DFBB O=[N+]([O-])c1ccccc1OCCN1CCO[C@H]2CCCC[C@@H]21 40153610 XIXARARHMZHKFX-ZFWWWQNUSA-N 306.362 2.617 5 40 DFBB Cc1ccccc1NC(=O)COC(=O)c1ccc([N+](=O)[O-])s1 3496487 BZZOVTXSWZYVNE-UHFFFAOYSA-N 320.326 2.760 5 40 DFBB O=C(O)CNc1nc(-c2ccccc2)c2cc([N+](=O)[O-])ccc2n1 4118118 FIRWCGITIPXVQL-UHFFFAOYSA-N 324.296 2.702 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 5618207 IOCVTBDTUSMFMC-NWDGAFQWSA-N 304.302 2.509 5 40 DFBB Cc1cc(NC(=O)NC[C@H]2CCC[C@@H](O)C2)ccc1[N+](=O)[O-] 97163050 GPYIVWYKEJSLCJ-WCQYABFASA-N 307.350 2.576 5 40 DFBB C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 9913935 GGGVKDIWIDYXIF-NSHDSACASA-N 324.340 2.891 5 40 DFBB COCc1cc([N+](=O)[O-])ccc1N1CCC(n2cccn2)CC1 95437241 NSHYPFPOQYPCIG-UHFFFAOYSA-N 316.361 2.779 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(N2CCC(N3CCCC3)CC2)c1 96453547 RTBYBPJNVZIPMW-UHFFFAOYSA-N 323.368 2.807 5 40 DFBB C[C@@H]1O[C@](O)(c2ccc([N+](=O)[O-])cc2)CC[N+]12CCCCC2 162703 SODNBJROKAQGMX-BBRMVZONSA-N 307.370 2.507 5 40 DFBB O=C(Nc1cccc(C(F)(F)F)c1)c1[nH]ncc1[N+](=O)[O-] 5323138 QOAQBSVOONHARD-UHFFFAOYSA-N 300.196 2.589 5 40 DFBB O=C(NCC1CC1)C1(NCc2ccccc2[N+](=O)[O-])CCCC1 85937280 KADKCOMSAXNFMZ-UHFFFAOYSA-N 317.389 2.523 5 40 DFBB CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCO1 97162566 QOYZUOWKYLBGKN-LLVKDONJSA-N 312.753 2.889 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc(F)c(F)c1 168341 IXHSRUCBXUGDEZ-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB Cc1ccc(CNC(=O)COc2ccccc2[N+](=O)[O-])cc1 3382170 WDEKUTFTEAJGRQ-UHFFFAOYSA-N 300.314 2.598 5 40 DFBB O=C(O[C@@H]1CC[C@@H]2CCC[C@@H]1C2=O)c1ccc([N+](=O)[O-])cc1 104098473 NAJGMLORGKZFRW-LEWSCRJBSA-N 303.314 2.899 5 40 DFBB CC[C@@H]1CCCCN1C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3263625 COOUYIHXNRCIMG-CYBMUJFWSA-N 320.345 2.543 5 40 DFBB Cc1csc2nc(COc3ccc([N+](=O)[O-])cc3)cc(=O)n12 5216447 BLWCRLZZSFYQPG-UHFFFAOYSA-N 317.326 2.552 5 40 DFBB CSc1nnc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)s1 223458671 NEUNHAMNZGYQCK-QPJJXVBHSA-N 322.371 2.820 5 40 DFBB O=C(CNc1ccc(F)c([N+](=O)[O-])c1)N1CCc2ccccc21 6885870 WXJSIUIWASGQMO-UHFFFAOYSA-N 315.304 2.735 5 40 DFBB CCOc1ccccc1CNC(=O)c1cccc([N+](=O)[O-])c1 20105406 IIZBYQULRWDUNI-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C 5786505 VRNLPPIGDIYAEJ-MFKMUULPSA-N 312.391 2.760 5 40 DFBB O=C1CCCN1c1ccc(CNc2ncccc2[N+](=O)[O-])cc1 15118010 ARAQOQXPOHDFFP-UHFFFAOYSA-N 312.329 2.729 5 40 DFBB CC(=O)Oc1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])cc1 4322827 NUDWVDROXYXHBJ-UHFFFAOYSA-N 300.270 2.772 5 40 DFBB O=C(NCCSCc1ccco1)c1ccc([N+](=O)[O-])s1 6588818 DRYOZAPZVFFCNV-UHFFFAOYSA-N 312.372 2.913 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC=CC[C@H]1C(=O)O 5944028 FWMZYGAEPXRDNX-VHSXEESVSA-N 324.720 2.854 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCCCN1CCCCCC1 13674895 QLWKVTRCROUHLF-UHFFFAOYSA-N 319.405 2.520 5 40 DFBB COc1cccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)c1 14258198 DWEGASUUPCCYDR-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB COc1ccc(C(=O)N(C)Cc2ccccc2)cc1[N+](=O)[O-] 284754 XBHYSJAMJQTENK-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB Cc1ccccc1NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 20456377 AVZSHUSIZVQJCF-UHFFFAOYSA-N 306.343 2.845 5 40 DFBB Cc1cccc(C(=O)N2CCC[C@H](N3CCCC3)C2)c1[N+](=O)[O-] 69812357 NDXDYNLTRWVNFA-AWEZNQCLSA-N 317.389 2.604 5 40 DFBB COc1ccc(Cn2ccc(=O)c3ccccc32)cc1[N+](=O)[O-] 76021000 RQZASBDVURNTDK-UHFFFAOYSA-N 310.309 2.967 5 40 DFBB C[C@@H](Nc1ncccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 22813250 LNYVPICEMANMSY-LLVKDONJSA-N 310.317 2.744 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(NCc2ccccc2)n1 4306410 VSLKFMVROPFSLL-UHFFFAOYSA-N 316.365 2.647 5 40 DFBB COc1cc(OC)cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1 5512288 BNZWFCRUVMRJEN-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB Cc1ccc(C(=O)NCCN2CCCCCC2)cc1[N+](=O)[O-] 40074562 XSHLWNKQNDPXPA-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB COc1ccccc1NC(=O)CSc1ccc([N+](=O)[O-])cn1 160095368 OTJCDCYSHHHOAB-UHFFFAOYSA-N 319.342 2.729 5 40 DFBB O=C(Nc1ncc(Cc2cccc([N+](=O)[O-])c2)s1)C1CC1 9668217 BVJPSCLQRRFZAQ-UHFFFAOYSA-N 303.343 2.991 5 40 DFBB CC(=O)Oc1c(C(=O)O)cc(-c2ccccc2)cc1[N+](=O)[O-] 57340114 XAZFCAXAOCMGFL-UHFFFAOYSA-N 301.254 2.885 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)c2ccc(F)cc2)cc1[N+](=O)[O-] 30835956 XOLROELHXSCSSH-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB C[C@@H](CCc1cccn1C)NC(=O)Cc1ccccc1[N+](=O)[O-] 96425731 HZTZKMGTNGKIPZ-ZDUSSCGKSA-N 315.373 2.613 5 40 DFBB CC(=O)c1ccccc1OC(=O)COc1ccc([N+](=O)[O-])cc1 472362 GSPWRKYMVCXCCW-UHFFFAOYSA-N 315.281 2.782 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(Nc2ccccc2)c([N+](=O)[O-])c1 34370509 MDPOBYVJWFEBRC-UHFFFAOYSA-N 303.230 2.945 5 40 DFBB C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccccc1 22085969 VEKOICOQIMLTRN-VXGBXAGGSA-N 315.329 2.635 5 40 DFBB Cc1nc2c(c(=O)c3ccccc3n2C)c(=O)n1C1CCCC1 2365834 FTVVNUGFDMXOIR-UHFFFAOYSA-N 309.369 2.672 5 40 DFBB Cc1cc(NC(=O)NC[C@@H](O)c2ccccc2)ccc1[N+](=O)[O-] 97049346 RTRSHXSIRKZUBE-OAHLLOKOSA-N 315.329 2.758 5 40 DFBB COc1ccc(NC(=O)N(C)Cc2ccco2)cc1[N+](=O)[O-] 97083136 AMOCWGLBCZXWJP-UHFFFAOYSA-N 305.290 2.860 5 40 DFBB O=[N+]([O-])c1cn(Cc2ccn(-c3ccc(Cl)cc3)n2)cn1 185752494 LHSSWKPGAKMQBL-UHFFFAOYSA-N 303.709 2.679 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1-n1ccnc1 45859978 JIXVVEPDVKNKGR-UHFFFAOYSA-N 322.324 2.962 5 40 DFBB O=C(CSc1ncccn1)Nc1ccc(Cl)cc1[N+](=O)[O-] 6913777 SLASCTMCMNGMAS-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB O=[N+]([O-])c1c(F)cccc1NCCS(=O)(=O)c1ccccc1 91460465 DSIMUSWGHONFLV-UHFFFAOYSA-N 324.333 2.620 5 40 DFBB Cc1cc(C)nc(Nc2nc(-c3ccccc3[N+](=O)[O-])n[nH]2)n1 18125330 OBMNMJXCQKUTPU-UHFFFAOYSA-N 311.305 2.530 5 40 DFBB Cc1ccc(O[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)cc1 225125158 NGWGEKSKBFQEBX-HNNXBMFYSA-N 301.298 2.978 5 40 DFBB O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1ccc([N+](=O)[O-])cc1 225452412 SBNNMMXSGSEUOV-QEJZJMRPSA-N 304.346 2.813 5 40 DFBB O=C1C/C(=C/c2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1 1715315 MUUGFWCNMNYPCH-RAXLEYEMSA-N 308.293 2.942 5 40 DFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccccc1F 3460991 XMFNHZGMGANNSM-UHFFFAOYSA-N 300.245 2.530 5 40 DFBB Cc1cc(S(=O)(=O)N2CCC(C)CC2)cc([N+](=O)[O-])c1C 41096836 OAUJQGAUVHCMTP-UHFFFAOYSA-N 312.391 2.632 5 40 DFBB CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 10017763 JMKMVDNOWDOONX-MRXNPFEDSA-N 313.357 2.628 5 40 DFBB O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)c1ccc2[nH]cnc2c1 89887844 RAMPKUCBUWTFHR-UHFFFAOYSA-N 322.284 2.600 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](O)c1ccsc1 97096151 DPBJNMGCHDWDTB-CYBMUJFWSA-N 321.358 2.820 5 40 DFBB CCCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 4615006 GNTZFVDUAXXGCW-UHFFFAOYSA-N 312.269 2.710 5 40 DFBB O=[N+]([O-])c1ccc(C2=NN[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 226758850 PRYHMDUYUTYJGZ-CQSZACIVSA-N 312.285 2.942 5 40 DFBB CC(C)COC[C@@H](O)CNc1ccc([N+](=O)[O-])cc1Cl 36391482 HLQPZRIQBGJMSL-NSHDSACASA-N 302.758 2.694 5 40 DFBB O=C(COC(=O)C1CCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] 6321157 KXCRWRWOPBRNAO-UHFFFAOYSA-N 312.709 2.530 5 40 DFBB O=C(OC[C@@H]1CCCCO1)c1c[nH]c2cc([N+](=O)[O-])ccc12 71902826 UNIIHSHPVLOLBL-NSHDSACASA-N 304.302 2.802 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@H](CN2CCCC2)C1 89780842 RKGPRUMWPYYDNL-CYBMUJFWSA-N 318.377 2.544 5 40 DFBB Cc1nn(Cc2cn3cc(Cl)ccc3n2)c(C)c1[N+](=O)[O-] 5186469 HMKNMXLIOGEUTC-UHFFFAOYSA-N 305.725 2.758 5 40 DFBB Cc1cc(S(=O)(=O)N2CCCCCC2)cc([N+](=O)[O-])c1C 9061835 QGKKQLLBXGSEAB-UHFFFAOYSA-N 312.391 2.776 5 40 DFBB Cc1cccc(C(=O)NC[C@@H]2Cc3ccccc3O2)c1[N+](=O)[O-] 40509996 OBSDUHGTXAYKNI-ZDUSSCGKSA-N 312.325 2.637 5 40 DFBB O=C(Oc1ccc2sc(=O)oc2c1)c1ccc([N+](=O)[O-])cc1 480280 TZVPHBBJCNWFJA-UHFFFAOYSA-N 317.278 2.982 5 40 DFBB CC(C)CNCCOC(=O)c1ccc([N+](=O)[O-])cc1Cl 1671741 MGRKDPTYCBQAEC-UHFFFAOYSA-N 300.742 2.651 5 40 DFBB COC(=O)c1cc(OC)c(OCc2ccccc2)c([N+](=O)[O-])c1 43827444 WVMQJOCEAJWYGN-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB C[C@H]1CCCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 57389465 HCPDPAYZFIWNHZ-JTQLQIEISA-N 311.769 2.919 5 40 DFBB Cc1ccc(CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C(C)C)o1 97135144 YNGNBXQDCCNXDW-UHFFFAOYSA-N 318.333 2.524 5 40 DFBB O=C(Cc1ccccc1)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 39745675 RDRSJQLOYSLVLQ-UHFFFAOYSA-N 324.296 2.826 5 40 DFBB COc1cccc(O[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)c1 225126238 BVBZJBUYQRHYEY-OAHLLOKOSA-N 317.297 2.678 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@H](C)NC(=O)c1ccncc1F 95400419 OKFIXGFHTFXUTC-VIFPVBQESA-N 319.292 2.629 5 40 DFBB CCc1ccc(C(=O)COC(=O)c2ccc([N+](=O)[O-])o2)s1 25373962 SOXYJEPASFPQLS-UHFFFAOYSA-N 309.299 2.851 5 40 DFBB O=[N+]([O-])c1ccc(NCCN2CCCCCC2)c([N+](=O)[O-])c1 25570786 SJJLPMXBHKZFKH-UHFFFAOYSA-N 308.338 2.791 5 40 DFBB O=C(Cc1ccccc1O)Nc1cc(Cl)cc([N+](=O)[O-])c1O 95992851 JFYAFCABEYOPPJ-UHFFFAOYSA-N 322.704 2.841 5 40 DFBB O=C(Cc1ccccc1)OCc1c([N+](=O)[O-])cccc1[N+](=O)[O-] 3848123 ZLTUIRVDPINCKA-UHFFFAOYSA-N 316.269 2.789 5 40 DFBB biogenic C[C@H](OC[C@H]1CCCCO1)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 71795772 WKERCXADUMPRTR-SWLSCSKDSA-N 322.361 2.532 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 5618201 IOCVTBDTUSMFMC-VXGBXAGGSA-N 304.302 2.509 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1Nc1cnn(CC(F)(F)F)c1 92655696 PEMZZEHUPOMGHY-UHFFFAOYSA-N 301.228 2.801 5 40 DFBB Cc1cnn(CCCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 71899692 GCWWSLJFNDKTAQ-UHFFFAOYSA-N 322.752 2.573 5 40 DFBB CC(C)c1nc([C@@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)cs1 96418729 NYXFMHLAMFQVLG-SSDOTTSWSA-N 308.367 2.720 5 40 DFBB Cn1cnc([N+](=O)[O-])c1Sc1nnc(NC(C)(C)C)s1 9647533 UHHZNYGPOGUENS-UHFFFAOYSA-N 314.396 2.541 5 40 DFBB CC(C)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCCC1 24864766 CWPLBQIONYLGFQ-OAHLLOKOSA-N 320.393 2.837 5 40 DFBB COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(C)o1 76093504 PIPYDFHYRBTFQS-CYBMUJFWSA-N 318.329 2.922 5 40 DFBB O=C(O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 71979119 WWXPRKHOMXCVGH-HNNXBMFYSA-N 311.297 2.987 5 40 DFBB Cc1nn(C(C)C)c(C)c1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 96449523 AFQXEFGQJMDINE-UHFFFAOYSA-N 318.333 2.947 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@]1(O)CCCC(C)(C)C1 252493971 NHTDSYFCCWCYKV-QGZVFWFLSA-N 320.389 2.964 5 40 DFBB Cc1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)cccc1[N+](=O)[O-] 38644 FXXSORVGKIPXPK-GHMZBOCLSA-N 306.318 2.733 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1nccs1 97145786 HCDRLSHJDKXVPD-UHFFFAOYSA-N 306.347 2.990 5 40 DFBB Cc1nn(C)c(NCCc2nc3ccccc3s2)c1[N+](=O)[O-] 74726922 HCDKGUUZYZRAKV-UHFFFAOYSA-N 317.374 2.901 5 40 DFBB O=c1c2sccc2ncn1Cc1c(F)cccc1[N+](=O)[O-] 69557422 AFNAVGKHYULTHU-UHFFFAOYSA-N 305.290 2.554 5 40 DFBB O=C(Nc1nccc(-c2ccco2)n1)c1ccc([N+](=O)[O-])cc1 2791398 REIMZAXCEVTUIK-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB N=C1SCC(=O)N1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 1816924 HSWKWEIJHNYTOL-UHFFFAOYSA-N 320.355 2.733 5 40 DFBB Nc1nc(Nc2ccccc2)nc(N2CCCCC2)c1[N+](=O)[O-] 6402937 VPRCKIJXZOQXLX-UHFFFAOYSA-N 314.349 2.701 5 40 DFBB CCOC(=O)c1cnn(-c2ccccc2[N+](=O)[O-])c1C(F)F 71796349 JGRNTVFRSFOZRR-UHFFFAOYSA-N 311.244 2.895 5 40 DFBB O=C(NCc1nccc2ccccc12)c1ccc([N+](=O)[O-])c(O)c1 14390573 PWLFTJFCKZTBPA-UHFFFAOYSA-N 323.308 2.779 5 40 DFBB Cc1ccc(O[C@@H](C)C(=O)Nc2ccc(F)cc2)c([N+](=O)[O-])n1 4892158 MDWNYHHDQNYAQG-JTQLQIEISA-N 319.292 2.843 5 40 DFBB CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1noc(C)n1 95978740 GCILNHAFCXRILZ-SNVBAGLBSA-N 324.724 2.821 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CC(=O)c1ccc(Br)cc1 49418718 BYXAGRKOXXWZBG-UHFFFAOYSA-N 324.134 2.745 5 40 DFBB NC(=O)c1ccc(COC(=O)CCC2CCCC2)c([N+](=O)[O-])c1 16745470 ORLWINJUHJKKQR-UHFFFAOYSA-N 320.345 2.707 5 40 DFBB O=C1Nc2ccccc2[C@]12CCN[C@@H]2c1ccc([N+](=O)[O-])cc1 61719462 UCBLNISWHNMWHE-WBVHZDCISA-N 309.325 2.519 5 40 DFBB O=[N+]([O-])c1cc([N+](=O)[O-])c(Nc2ccccc2)c([N+](=O)[O-])n1 8435496 XLXYGJXWTQPRCP-UHFFFAOYSA-N 305.206 2.550 5 40 DFBB O=C(N[C@@H]1CCc2ccccc2C1)c1cc(O)ccc1[N+](=O)[O-] 225557871 CYOYKAWTABBLQL-CYBMUJFWSA-N 312.325 2.588 5 40 DFBB CN(c1cccc(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 150743506 RWLRHBOXAKQCTC-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB O=c1c2cc(-c3ccc([N+](=O)[O-])cc3)sc2nc2n1CCC2 478644 VHZICCSERYTUMB-UHFFFAOYSA-N 313.338 2.979 5 40 DFBB O=C(N[C@H]1CCN2CCCC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] 47264318 PCFVLLHMHNKALH-QWHCGFSZSA-N 323.780 2.605 5 40 DFBB CCCCN(C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 23991615 VJUJXNRRKHILOQ-NSHDSACASA-N 309.366 2.662 5 40 DFBB CCCNC(=O)c1cccc(Oc2c([N+](=O)[O-])c(C)nn2C)c1 95397324 PRTJEESQBQJMLS-UHFFFAOYSA-N 318.333 2.569 5 40 DFBB Cc1cccc(Cl)c1NC(=O)Cn1cc([N+](=O)[O-])nc1C 72332117 OBADQYGKPRDMGZ-UHFFFAOYSA-N 308.725 2.700 5 40 DFBB Cn1c(C(C)(C)OC(=O)Oc2ccccc2)cnc1[N+](=O)[O-] 13282235 KUOKVKLNRUSHGT-UHFFFAOYSA-N 305.290 2.779 5 40 DFBB O=C(NC(=O)N1CCCCC1)c1ccc(Cl)c([N+](=O)[O-])c1 161767 LNLLPQBLUPTBIQ-UHFFFAOYSA-N 311.725 2.584 5 40 DFBB Cn1cnc([N+](=O)[O-])c1CN1CCC(c2ccccc2)CC1 78988234 KHPUBTLMQIBMMY-UHFFFAOYSA-N 300.362 2.708 5 40 DFBB Cc1cc(C)cc(OCCCn2cc([N+](=O)[O-])ccc2=O)c1 12552536 LUMCPEQGZLPIKH-UHFFFAOYSA-N 302.330 2.842 5 40 DFBB O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N1CCCCCC1 9367133 VLGDUFBKZOPRQL-UHFFFAOYSA-N 314.345 2.797 5 40 DFBB O=C(C[C@@H]1CCCO1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 84425352 GFILZGIUARPELM-LBPRGKRZSA-N 301.302 2.651 5 40 DFBB C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)n1nnc2ccccc21 411600 FMMUQJZBEPIKRG-JTQLQIEISA-N 311.301 2.539 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]3C2=O)C42CC2)c([N+](=O)[O-])c1 4155646 JBXTZRPOFLDERS-HGSJOUDDSA-N 324.336 2.605 5 40 DFBB CCOc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 10448418 OEHNJFCPDNOMFE-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB Cc1c(Cn2c(-c3cccs3)noc2=O)cccc1[N+](=O)[O-] 58344793 XQVPKYNENMBMLX-UHFFFAOYSA-N 317.326 2.830 5 40 DFBB O=C(Nc1ncnc2sccc12)c1ccc([N+](=O)[O-])cc1 5299386 JEZTZRCTROWESG-UHFFFAOYSA-N 300.299 2.852 5 40 DFBB CCN(C[C@H](O)COc1ccc([N+](=O)[O-])cc1)C1CCCCC1 1473297 SPBKKPJOGBBWHL-INIZCTEOSA-N 322.405 2.989 5 40 DFBB O=C(NC[C@H]1COc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 26784152 WAPFWALFAXJOAG-LBPRGKRZSA-N 312.325 2.576 5 40 DFBB CCCCc1nnc(SCc2ccccc2[N+](=O)[O-])n1N 76065386 DXYSZTWHRQOTKJ-UHFFFAOYSA-N 307.379 2.535 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@@H](O)c2ccco2)c1 95445501 QQGDAVZVTHROEF-BXUZGUMPSA-N 318.329 2.738 5 40 DFBB O=[N+]([O-])c1cc(I)ccc1OC(F)F 85397038 PYOVBAKEHDVXAL-UHFFFAOYSA-N 315.013 2.801 5 40 DFBB O=C(O[C@H]1C[C@H]2CCC[C@H]12)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5409717 OPZSYSWUWGXACD-JCOFBHIZSA-N 306.274 2.848 5 40 DFBB Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 13938136 CRFIRMGKNJFNDJ-GFCCVEGCSA-N 320.370 2.943 5 40 DFBB CC[N+](C)(C)CCC(C(N)=O)(c1ccccc1)c1ccccc1 1700052 KFZMXOLSYABOSE-UHFFFAOYSA-O 311.449 2.944 5 40 DFBB in-man CC1([N+](=O)[O-])COP(=O)(N2CCCCCCCC2)OC1 1702937 HVHLKWUQCPYXPK-UHFFFAOYSA-N 306.299 2.833 5 40 DFBB Cc1cccc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)c1O 292024 VGZRHVJFJHLRFT-UHFFFAOYSA-N 315.281 2.649 5 40 DFBB Cc1ccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 7216930 QHVJKDCVHFEYQS-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1Cc1csc(-c2ccco2)n1 25451385 GOGQDPJGAITDHA-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB COc1cc(Cn2cc([N+](=O)[O-])ccc2=O)ccc1SC 68043062 CDNFFNDPWSQKBR-UHFFFAOYSA-N 306.343 2.535 5 40 DFBB Cc1cccc2[nH]cc(CCNC(=O)c3ccc([N+](=O)[O-])o3)c12 69513443 NPOXNCZYIZTAKT-UHFFFAOYSA-N 313.313 2.950 5 40 DFBB O=C(O)c1ccc(COC(=O)c2ccc([N+](=O)[O-])cc2)cc1 409204635 CDFXVBAYGNGPDL-UHFFFAOYSA-N 301.254 2.650 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc2c(c1)CCC2 7050592 IKFQEOPFLJDSPU-UHFFFAOYSA-N 318.354 2.884 5 40 DFBB COc1cc(CN(C)Cc2ccoc2C)c([N+](=O)[O-])cc1O 92451842 WZGZRFKKIAFKTB-UHFFFAOYSA-N 306.318 2.842 5 40 DFBB O=C(COc1cccc([N+](=O)[O-])c1)N(Cc1ccco1)C1CC1 31913643 UJUHWTSQSSNWND-UHFFFAOYSA-N 316.313 2.758 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)OCc1ccc([N+](=O)[O-])cc1 3248486 RMGCTWYEAMVMBE-UHFFFAOYSA-N 316.269 2.789 5 40 DFBB O=[N+]([O-])c1c(NCc2ccc3c(c2)OCO3)nc2ccccn12 58303982 UQMGMPDEGSVVHG-UHFFFAOYSA-N 312.285 2.583 5 40 DFBB CCN1CCN(c2cc(C)c3cc([N+](=O)[O-])ccc3n2)CC1 6757865 SQQHYHLKHLYOQR-UHFFFAOYSA-N 300.362 2.593 5 40 DFBB Cc1cc(NC(=O)NC[C@](C)(O)c2ccco2)ccc1[N+](=O)[O-] 97163035 HIAWBQIJBGUVEA-HNNXBMFYSA-N 319.317 2.525 5 40 DFBB COc1cccc(C(=O)N[C@@H](C)c2cncs2)c1[N+](=O)[O-] 225403247 YDYDNGOHCCAWAE-QMMMGPOBSA-N 307.331 2.551 5 40 DFBB O=[N+]([O-])c1cccnc1N1CC2(CCC2)[C@@H]1C1CCOCC1 579949778 WIWTWHYYYZHBIK-AWEZNQCLSA-N 303.362 2.775 5 40 DFBB Cc1ccccc1N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 1644321 AUDKTWWKOVYGMN-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB CC(=O)c1ccc(N2CCC(NC(C)C)CC2)c([N+](=O)[O-])c1 57838431 HCLWGWRJAVJCGH-UHFFFAOYSA-N 305.378 2.764 5 40 DFBB C[C@H]1CCC[C@](O)(CNc2nc3sccn3c2[N+](=O)[O-])C1 65566744 BUXXNDOIEOBXDL-TVQRCGJNSA-N 310.379 2.657 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)O)c1 4892441 UQCVAAQBGNNPOX-UHFFFAOYSA-N 301.258 2.937 5 40 DFBB O=C(NCc1ccc(-n2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 38756358 MEQHWCSIHLTESD-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB Cc1ccccc1S(=O)(=O)NSc1ccccc1[N+](=O)[O-] 1710878 SFFJCFGPVSQPAB-UHFFFAOYSA-N 324.383 2.889 5 40 DFBB O=[N+]([O-])c1cccc(-c2noc(CSC3=NCCS3)n2)c1 31840411 CITSUBKENVZEBV-UHFFFAOYSA-N 322.371 2.981 5 40 DFBB C[C@@H](Sc1n[nH]c(=O)n1C1CC1)c1cccc([N+](=O)[O-])c1 7776156 WAFAMWILNFAQJU-MRVPVSSYSA-N 306.347 2.668 5 40 DFBB O=[N+]([O-])c1cccnc1NCc1ccccc1Cn1cccn1 45615297 KIRPKAIKSQPBAR-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB Cc1nn(C)c(C)c1NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 32675888 YOELGXWDHJGZMC-BQYQJAHWSA-N 300.318 2.597 5 40 DFBB C[C@@H](Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])c1ccco1 32837539 PYHXOAQCJPHGCG-MRVPVSSYSA-N 300.274 2.597 5 40 DFBB CCN(CC)c1nc(N)c([N+](=O)[O-])c(Nc2ccc(F)cc2)n1 5030724 MUHHSVWDFNEHKC-UHFFFAOYSA-N 320.328 2.696 5 40 DFBB O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1)C1CCCC1 69632291 RHPXEPFCFHIJFP-UHFFFAOYSA-N 301.306 2.509 5 40 DFBB CCOc1cc(C(=O)Nc2ccccn2)c([N+](=O)[O-])cc1OC 9314244 GBLIRCFGQVDRHR-UHFFFAOYSA-N 317.301 2.649 5 40 DFBB C[C@@H](CC(=O)c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 79103269 XLINZNRHWBMESR-LBPRGKRZSA-N 312.325 2.986 5 40 DFBB O=C(c1ccccc1[N+](=O)[O-])N1CCOC[C@H]1c1ccccc1 72541120 QQFRSNSQULIRMS-INIZCTEOSA-N 312.325 2.809 5 40 DFBB Cc1ccc2c(c1)N(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1O2 15109704 RKBNZFMSXHTHIY-UHFFFAOYSA-N 320.326 2.834 5 40 DFBB CCOC(=O)CCN(C(=O)Nc1cccc([N+](=O)[O-])c1)C1CC1 58439808 ZLOPYZSCEUCZAZ-UHFFFAOYSA-N 321.333 2.544 5 40 DFBB O=[N+]([O-])c1cccc(OCCN2CCOc3ccccc32)c1 59019093 QXJJNVBTMQXMGL-UHFFFAOYSA-N 300.314 2.873 5 40 DFBB O=C(NCc1ccccc1-n1ccnc1)c1cccc([N+](=O)[O-])c1 20451884 DAOYAYKQQHVRTH-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB CCOC1=Nc2ccccc2N(c2ccc([N+](=O)[O-])nc2)CN1 28294542 KWGFGMZJGKOCEE-UHFFFAOYSA-N 313.317 2.713 5 40 DFBB CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC1 8077193 RAKFKVQKOBHLCW-UHFFFAOYSA-N 303.362 2.723 5 40 DFBB Nc1nc(NCC2(c3ccccc3)CCCC2)ncc1[N+](=O)[O-] 71951265 CDVKWHDXGPQIOX-UHFFFAOYSA-N 313.361 2.891 5 40 DFBB Cc1cc(NC(=O)c2cnsn2)c2cc([N+](=O)[O-])ccc2n1 97142417 GZMPAPLZZWVOKG-UHFFFAOYSA-N 315.314 2.555 5 40 DFBB CCc1nc(NC(=O)COc2cccc([N+](=O)[O-])c2)sc1C 40123116 JBZINZVSYASNKL-UHFFFAOYSA-N 321.358 2.940 5 40 DFBB C/C=C/C=C/C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 20854165 SCHSWEYEZMGQQN-DKHWSBQMSA-N 304.302 2.597 5 40 DFBB Cn1cnnc1-c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 32028960 HBWUSKKXIVNWIW-UHFFFAOYSA-N 323.312 2.643 5 40 DFBB Cc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1[N+](=O)[O-] 7376693 OVEISYNLHUPBKE-UHFFFAOYSA-N 324.333 2.521 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@@H](c1ccccc1)c1ccccn1 102875258 IHEZFHVOKOLKKX-AWEZNQCLSA-N 309.329 2.925 5 40 DFBB COC(=O)CCSCCNc1ccc([N+](=O)[O-])cc1Cl 72947901 TYZGZZUCMSQBSL-UHFFFAOYSA-N 318.782 2.956 5 40 DFBB O=[N+]([O-])c1cccnc1N1CCC([C@@H](O)c2ccccc2)CC1 22406204 DEDUFFJEBIBXDJ-INIZCTEOSA-N 313.357 2.940 5 40 DFBB CCn1nc(C)cc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 75127471 LUWOZPSOGIULTI-LLVKDONJSA-N 314.345 2.711 5 40 DFBB Nn1c(Sc2c(Cl)cccc2[N+](=O)[O-])nnc1C(F)F 216905026 SYZVTGCUQBZQTR-UHFFFAOYSA-N 321.696 2.642 5 40 DFBB CC(=O)N1CC[C@H](CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 245537230 YITRCDXXCWDSGP-UKRRQHHQSA-N 319.405 2.764 5 40 DFBB Cc1ccc(OCCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 5814585 QTBDPVIBTJTOCQ-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB O=C(Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)c1ccno1 10253879 VNSQOHVXXBHQTH-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB CCCc1n[nH]c(SCCOc2ccccc2[N+](=O)[O-])n1 53708888 NRXJZBDOUXDCFV-UHFFFAOYSA-N 308.363 2.837 5 40 DFBB C[C@@H]1CCCN(C(=O)CNc2ccc(Cl)c([N+](=O)[O-])c2)C1 57364154 AGQZBLFFKJWHOP-SNVBAGLBSA-N 311.769 2.919 5 40 DFBB O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F 4657104 UMTZIGJKVNAMAJ-ZJUUUORDSA-N 310.281 2.563 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCO[C@@H](c3cccc(F)c3)C2)o1 92975492 XAGFTGMDVWTAFW-CQSZACIVSA-N 306.293 2.900 5 40 DFBB C[C@@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C(C)(C)CO1 91216334 QSKRYHAAOAQUAX-SECBINFHSA-N 312.753 2.888 5 40 DFBB Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1O 3075896 XYESUTVILCOVBJ-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB CC(C)[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nccn1C 32933003 CAQZNQCOZPCYPY-ZDUSSCGKSA-N 317.349 2.847 5 40 DFBB NC(=O)c1ccc(CN(C2CCCCC2)C2CC2)c([N+](=O)[O-])c1 52664638 KQLYNHWJUHIUAO-UHFFFAOYSA-N 317.389 2.991 5 40 DFBB CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)Cc1cnn(C)c1 69389286 DKYMCNIOPQZGNX-UHFFFAOYSA-N 318.377 2.748 5 40 DFBB O=C(NCCSCc1ccco1)c1ccccc1[N+](=O)[O-] 6549109 LAEGXIQTTUQEOJ-UHFFFAOYSA-N 306.343 2.851 5 40 DFBB O=C(Nc1nc2c(s1)COCC2)c1ccc([N+](=O)[O-])cc1F 75439841 ZDNNOPGTBSWPSW-UHFFFAOYSA-N 323.305 2.515 5 40 DFBB COc1ccc(OC[C@@H](O)C[N+]2(C)CCCC2)c(C(C)(C)C)c1 226071274 BEJSTAQLGMFKBA-HNNXBMFYSA-N 322.469 2.973 5 40 DFBB CCCN(C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C1 81361227 RKBDOIZKDQCFCB-AWEZNQCLSA-N 319.405 2.707 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1ccccn1 55514832 PUBBMVJTNCVBKQ-INIZCTEOSA-N 311.341 2.896 5 40 DFBB Cc1ccc(NC(=O)[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 9114051 UGVIMKPRSVJGRL-OAHLLOKOSA-N 314.297 2.682 5 40 DFBB Cc1ncc(CN(C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1 52447225 QMGYCKZLBXHFHL-UHFFFAOYSA-N 308.319 2.904 5 40 DFBB Cc1ccc(OCC(=O)c2cc(C)n(C)c2C)c([N+](=O)[O-])n1 8687626 MTZSPKIAAWJURK-UHFFFAOYSA-N 303.318 2.515 5 40 DFBB CC1=CC[C@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3F)C(=O)[C@H]2C1 5523842 OTMTWADLLSVKQZ-MNOVXSKESA-N 304.277 2.580 5 40 DFBB Cc1ccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1 16086039 CFAIULWMMGGWBD-UHFFFAOYSA-N 307.327 2.979 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@@H]2C[C@@H]3[C@H]4C=C[C@@H]4[C@H]23)c([N+](=O)[O-])c1 45070872 SREHYKGRATYLGD-OBORUHMCSA-N 302.286 2.840 5 40 DFBB CC1=C(C)C[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]2C1 3066141 KVTACZCBHWDAQC-KBPBESRZSA-N 300.314 2.831 5 40 DFBB COc1cc(OCC(=O)Nc2ccccc2)ccc1[N+](=O)[O-] 22259261 NVRFGWOSFQDCSU-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 30758840 TYCOPGATAGSQSZ-JTQLQIEISA-N 324.333 2.773 5 40 DFBB O=C(CCOc1cccc([N+](=O)[O-])c1)NCc1ccccc1F 31491129 MQOHMAKOXVWAJH-UHFFFAOYSA-N 318.304 2.819 5 40 DFBB COc1ccccc1OCc1ccc([N+](=O)[O-])cc1C(=O)O 72209199 QDUYXCRNEDHEOX-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB C[C@H](Oc1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1 96956341 OYMONPHECZHPSA-NSHDSACASA-N 311.301 2.711 5 40 DFBB O=C(Nc1ccc(Br)cn1)c1ccc([N+](=O)[O-])o1 259778 IWEUGKPFSBXXAK-UHFFFAOYSA-N 312.079 2.598 5 40 DFBB CC(C)N(Cc1cnn(C)c1)Cc1c(F)cccc1[N+](=O)[O-] 69705889 BJZOBJYFWNKSSO-UHFFFAOYSA-N 306.341 2.878 5 40 DFBB O=C(c1cccc(Cl)c1)N1CCc2ncc([N+](=O)[O-])cc2C1 95992872 GKCODHRPPIWFDM-UHFFFAOYSA-N 317.732 2.842 5 40 DFBB Cc1ccccc1COc1cc(O)c(C(=O)O)cc1[N+](=O)[O-] 216933339 VFWOWIAJYPPHMS-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB O=[N+]([O-])c1cccc(/C=C2\CCc3cnc4scn[n+]4c32)c1 5258308 ICVYZASRGWSPMT-IZZDOVSWSA-N 311.346 2.672 5 40 DFBB Cc1cc(C(=O)O)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 13391328 KTDQOIMYQAZASS-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB O=C(NC[C@H]1OCCc2ccccc21)c1cccc([N+](=O)[O-])c1 181788 BGJXJZKBQSXJQJ-MRXNPFEDSA-N 312.325 2.639 5 40 DFBB Cc1oc(-c2ccc(Cl)cc2[N+](=O)[O-])cc1C(=O)NCCO 8021264 UYAZTQVYOWMFKR-UHFFFAOYSA-N 324.720 2.539 5 40 DFBB CC(C)C(=O)NC(=S)Nc1ccc(Cl)cc1[N+](=O)[O-] 8558173 OLHKMTOMLHPJOT-UHFFFAOYSA-N 301.755 2.717 5 40 DFBB Nc1ccccc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1O 408600026 RHMLZGCHABYPDS-UHFFFAOYSA-N 319.342 2.613 5 40 DFBB O=C(CNCc1cccs1)Nc1ccc(F)c([N+](=O)[O-])c1 3445685 YJUIYLLMACXSIC-UHFFFAOYSA-N 309.322 2.524 5 40 DFBB CCCc1[nH]nc(C(=O)Nc2cccc(C(C)=O)c2)c1[N+](=O)[O-] 70014166 CPZMLEXUWBQTPM-UHFFFAOYSA-N 316.317 2.725 5 40 DFBB O=C(c1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccccc2)C1 13012227 VNTFVVMPQSZSEV-INIZCTEOSA-N 312.325 2.809 5 40 DFBB CCN1CCN(Cc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 116128597 VLJSJFKIGHYITE-UHFFFAOYSA-N 317.311 2.751 5 40 DFBB O=C1NCCCN1c1cccc(Nc2ncccc2[N+](=O)[O-])c1 78508871 XXZQDXJPBOHVER-UHFFFAOYSA-N 313.317 2.653 5 40 DFBB Cc1noc([C@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)n1 269422949 ZUPCUNYFEMPAOZ-VIFPVBQESA-N 323.740 2.719 5 40 DFBB O=C(O[C@@H]1C[C@@H]2CCC[C@@H]21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5409720 OPZSYSWUWGXACD-AQUOVQTQSA-N 306.274 2.848 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 4839321 ZNGVWFJIYHCABA-OZVVPTBGSA-N 318.716 2.560 5 40 DFBB CC(C)N1CCC[C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 58196332 MJIMMTAVVWYQBC-ZDUSSCGKSA-N 320.393 2.837 5 40 DFBB Cn1cnc([N+](=O)[O-])c1Nc1cccc(OC[C@H]2CCCO2)c1 36397187 DIRUTBZHGTXKSB-CYBMUJFWSA-N 318.333 2.630 5 40 DFBB CC(=O)Oc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 13955093 XZCNSXJYGZGVTA-UHFFFAOYSA-N 300.270 2.772 5 40 DFBB Cc1ccc(N(C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])C2CCCCC2)nc1 71888169 BREOTGBDRONABH-KBPBESRZSA-N 303.362 2.721 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cnsn1 95997562 FTQCPDRSSFQAHP-UHFFFAOYSA-N 318.236 2.717 5 40 DFBB O=C(O[C@H]1CC[C@H]2CCC[C@@H]1C2=O)c1ccc([N+](=O)[O-])cc1 5030047 NAJGMLORGKZFRW-SWHYSGLUSA-N 303.314 2.899 5 40 DFBB Cc1ccc2[nH]c(=O)c(CNc3ncccc3[N+](=O)[O-])cc2c1 13561608 YZPAUCHYYRFYDL-UHFFFAOYSA-N 310.313 2.752 5 40 DFBB Cc1ccc(O)c(C(=O)N(C)Cc2cccc([N+](=O)[O-])c2)c1 48299823 TXYAEQUJCBOXBI-UHFFFAOYSA-N 300.314 2.881 5 40 DFBB Cc1ccc(NC(=O)CCn2cc([N+](=O)[O-])c(C)n2)cc1F 95994613 SJIQOIPDNQGKIC-UHFFFAOYSA-N 306.297 2.576 5 40 DFBB CC(=O)[C@@H](C(=O)OC(C)(C)C)c1c([N+](=O)[O-])ccc(F)c1F 44560073 FLAICFLHBGZSNN-SNVBAGLBSA-N 315.272 2.887 5 40 DFBB Cc1n[nH]c(-c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)n1 50896924 OSLBCQSKPLKWKW-UHFFFAOYSA-N 323.312 2.941 5 40 DFBB CCN(C1CC1)S(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C 84761135 WKQSNXOQMPPYMK-UHFFFAOYSA-N 318.782 2.730 5 40 DFBB COc1ccccc1CN(C)C(=O)c1ccc([N+](=O)[O-])cc1 18076230 VJCXKCNAICLWQB-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB Cc1cc(OC(=O)CCCc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 4248399 VOVYOSIBKYYSEF-UHFFFAOYSA-N 316.313 2.520 5 40 DFBB CCc1nc2ccccc2c2nc(=O)c(-c3ccccc3)nn12 24841803 OFCKSATZEPWIOU-UHFFFAOYSA-N 302.337 2.867 5 40 DFBB CSc1ccc(C(=O)O[C@H]2CCCCC2=O)cc1[N+](=O)[O-] 5425715 HJZBZUPHLFOYNG-LBPRGKRZSA-N 309.343 2.985 5 40 DFBB O=C(Nc1nonc1-c1ccccc1)c1ccccc1[N+](=O)[O-] 8869480 QKZLWEBIHFIPEN-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB CN(C[C@H]1CCOC1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 83859203 LJEBKSSPJYTZNP-SECBINFHSA-N 302.277 2.669 5 40 DFBB Cc1c(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)cnn1C 97047022 SGIUDRWRHXJNAB-UHFFFAOYSA-N 309.709 2.647 5 40 DFBB O=C(O)/C=C/C(=O)Nc1ccc2c(c1)oc(=O)c1ccccc12 1693082 HHGLRTMNBJCNJN-BQYQJAHWSA-N 309.277 2.526 5 40 DFBB O=[N+]([O-])c1cccnc1N1CCO[C@@H](c2ccc(F)cc2)C1 29528099 RLTHZIORZHWHLJ-CQSZACIVSA-N 303.293 2.707 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nc(Cc2cccs2)n[nH]1 23618284 DXEMASNFADZTBG-UHFFFAOYSA-N 319.371 2.911 5 40 DFBB COC(=O)c1ccc(-c2nc3cc([N+](=O)[O-])c(O)cc3o2)cc1 21297847 QUEPCUKXPKJVKJ-UHFFFAOYSA-N 314.253 2.895 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1CCOc1ccccc1 28004972 SVDZVGJZMQAXGN-UHFFFAOYSA-N 300.270 2.582 5 40 DFBB Cc1cc(N2CCC(n3cncn3)CC2)c(Cl)cc1[N+](=O)[O-] 80608532 BRMPLGFBBDCOPY-UHFFFAOYSA-N 321.768 2.990 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@H]1C=C[C@@H]2C12CC2 100046105 XTOIUIXMPLPZLM-JURCDPSOSA-N 324.336 2.605 5 40 DFBB O=[N+]([O-])c1ccc(C2=C[C@@H](c3ccccc3)n3nnnc3N2)cc1 100103333 NKSGGQJFOGIFQL-HNNXBMFYSA-N 320.312 2.637 5 40 DFBB COc1cccc(CS(=O)(=O)Oc2cccc([N+](=O)[O-])c2)c1 69871241 SJRCRPUPFDXZDQ-UHFFFAOYSA-N 323.326 2.512 5 40 DFBB O=C(O[C@H]1C[C@@H]2CC[C@@H]1C2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 104187031 WGQVYOZJPJVTHR-KKFJDGPESA-N 306.274 2.848 5 40 DFBB COc1ccc(C(=O)N(C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] 41686504 GGSNPGFKBSMIEC-UHFFFAOYSA-N 316.313 2.581 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(NC2CCCCC2)n1 5215315 GDGLGEQNEGYESW-UHFFFAOYSA-N 308.386 2.780 5 40 DFBB Cc1cc(NC(=O)N[C@H](CO)c2ccccc2)ccc1[N+](=O)[O-] 97163046 RWCOFBDRRRYHAH-CQSZACIVSA-N 315.329 2.758 5 40 DFBB CC(C)(C)OC(=O)N[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1 75606999 OOABVZHLYYFKSP-ZDUSSCGKSA-N 321.377 2.694 5 40 DFBB Cc1cc(N[C@@H]2CCC[C@@H]2C(N)=O)c2cccc([N+](=O)[O-])c2n1 95463619 YNAKUYOHZRALFL-NWDGAFQWSA-N 314.345 2.517 5 40 DFBB COc1ccc(C(=O)O)cc1NC(=O)c1ccccc1[N+](=O)[O-] 20140789 PINBZEJXMULIGB-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1nc(C(F)(F)F)c(Cn2nc([N+](=O)[O-])cc2C)s1 193871678 SPBFKHIHVNADJL-UHFFFAOYSA-N 306.269 2.932 5 40 DFBB CCN(c1cccc(F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 194206319 JLBWTRMAEXZNPW-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB Cc1ccc2[nH]c3nc4nonc4nc3c2c1Br 78546413 QVHRYIYKQCRULF-UHFFFAOYSA-N 304.107 2.718 5 40 DFBB COc1ccc(NC(=O)COc2cccc(C)c2)cc1[N+](=O)[O-] 6860489 FSTFBNDFGMIHIS-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB O=[N+]([O-])c1c(NC[C@H](O)c2ccccc2F)nc2sccn12 58244489 WMOJLHZVUVPKFB-JTQLQIEISA-N 322.321 2.589 5 40 DFBB C[C@H](SC1=NCCS1)C(=O)Nc1ccc([N+](=O)[O-])cc1 9500054 RUIZQVHHOLCJRZ-QMMMGPOBSA-N 311.388 2.758 5 40 DFBB CC1(C)CC(=O)[C@@H]2C(c3ccc(Cl)c([N+](=O)[O-])c3)=NN[C@H]2C1 228926772 BRPTUNKFJBLLSU-GXFFZTMASA-N 321.764 2.929 5 40 DFBB COC(=O)c1ccc(C(=O)OCc2ccccc2)cc1[N+](=O)[O-] 82046655 NKKMBOLQFWHXHE-UHFFFAOYSA-N 315.281 2.738 5 40 DFBB Cn1cccc1[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])o1 96445071 UFCYVYBPAMRECS-LBPRGKRZSA-N 303.318 2.894 5 40 DFBB CC(C)n1cnn(CN(C)Cc2ccccc2[N+](=O)[O-])c1=S 32824955 QWPVZPKTHNULHW-UHFFFAOYSA-N 321.406 2.993 5 40 DFBB COC(=O)c1c(C)cccc1NC(=O)c1ccccc1[N+](=O)[O-] 24872357 HMWFJNJSKJKTSA-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)Nc1c(F)cccc1F 9616485 CFAPMICOMIIWKD-UHFFFAOYSA-N 307.256 2.924 5 40 DFBB CCN(CCc1nccs1)C(=O)Nc1ccncc1[N+](=O)[O-] 97080975 AYYBEIQONCDENN-UHFFFAOYSA-N 321.362 2.543 5 40 DFBB CCc1onc(C)c1C(=O)OCc1ncc(C)c([N+](=O)[O-])c1C 189256021 AXVRZOQNFKCANO-UHFFFAOYSA-N 319.317 2.822 5 40 DFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)NCC(F)(F)F 32795383 CPDBJQNWVQOOEV-MRVPVSSYSA-N 305.256 2.860 5 40 DFBB O=C(Nc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2779986 HNRALAJDIKOSOJ-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB Cc1csc(COC(=O)c2cc(F)c([N+](=O)[O-])cc2F)n1 97141670 JIQKYLRVWQUABL-UHFFFAOYSA-N 314.269 2.995 5 40 DFBB COc1ccc(C(=O)Nc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] 226273536 WOJNLQQMNABJHT-SNVBAGLBSA-N 316.313 2.909 5 40 DFBB COc1ccc(C(=O)Nc2cccc(C(=O)O)c2)cc1[N+](=O)[O-] 13094551 ZBRDLIYCTIMSFK-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccccc1[N+](=O)[O-] 31662143 CUQWFTGYUUQEED-LLVKDONJSA-N 315.333 2.527 5 40 DFBB O=[N+]([O-])c1ccc(C[N+]23CCCC[C@@H]2[C@H](CO)CCC3)cc1 4083595 CGXROTBVPVPDTR-NADDXPSSSA-N 305.398 2.866 5 40 DFBB COc1ccc([N+](=O)[O-])cc1/C=C\c1onc(C)c1[N+](=O)[O-] 107783961 YCCKMGILQKZDNT-HYXAFXHYSA-N 305.246 2.978 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCCN(c2ncccn2)C1 44976657 OQSJDRRJVZXJAG-GFCCVEGCSA-N 317.324 2.605 5 40 DFBB COc1ccc(CCNc2ccc([N+](=O)[O-])cn2)cc1OC 12763893 DUFNGXLMTJZWLF-UHFFFAOYSA-N 303.318 2.662 5 40 DFBB Cc1ccc(OCc2nc(-c3cccs3)no2)c([N+](=O)[O-])n1 7229487 FXFUXNBCUPMQDL-UHFFFAOYSA-N 318.314 2.989 5 40 DFBB C[C@H]1CCN(C(=O)c2c[nH]c(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C 96011245 MHHOKEODINYRFM-WDEREUQCSA-N 314.345 2.855 5 40 DFBB O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccncc1 69484891 UZKILBWVGGYOFR-UHFFFAOYSA-N 300.318 2.821 5 40 DFBB O=[N+]([O-])c1ccc(Nc2ccc(N3CCC(O)CC3)cc2)nc1 52210932 GLMVRDCNBWEXFH-UHFFFAOYSA-N 314.345 2.695 5 40 DFBB CC1=C(C)C[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]2C1 102409675 KVTACZCBHWDAQC-OKILXGFUSA-N 300.314 2.831 5 40 DFBB C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 95412741 BAVFUGIFHPWPSB-BLLLJJGKSA-N 314.341 2.837 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@H]1COc1cccnc1[N+](C)(C)C 38600386 IGLROPQXJNNFKN-ZDUSSCGKSA-N 322.429 2.667 5 40 DFBB in-vitro C[C@@H]1Cc2ccccc2N1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 9157284 CFIOGYDXLCOIRE-LLVKDONJSA-N 311.341 2.645 5 40 DFBB COC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])o2)sc(C)c1C 4570481 VNTGBTXRWAWVDY-UHFFFAOYSA-N 324.314 2.905 5 40 DFBB Cc1ccnc(N[C@H]2CCN(c3ncccc3F)C2)c1[N+](=O)[O-] 89701877 JYIIADCCXXOWPK-NSHDSACASA-N 317.324 2.523 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@@H]2C[C@H]3[C@H]4C=C[C@@H]4[C@@H]32)c([N+](=O)[O-])c1 104286400 SREHYKGRATYLGD-JVSQWTDWSA-N 302.286 2.840 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)N(C[C@@H]1CCOC1)C1CC1 63089519 MZKQAAQMGDXWRE-GBXSZLQWSA-N 316.357 2.636 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc(-c3ccncc3)o2)nc1 409275821 XFUJZZOPADSOCE-UHFFFAOYSA-N 301.287 2.586 5 40 DFBB Cc1noc(C)c1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 71799857 CTUMTXBFRUNWEZ-SECBINFHSA-N 315.329 2.720 5 40 DFBB COc1ccc(OCc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 72209201 YCSGVOYXXDJMPU-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB COC(=O)/C=C\c1cc(Br)c(F)cc1[N+](=O)[O-] 575436656 OKHZHBDJOZFECU-IHWYPQMZSA-N 304.071 2.683 5 40 DFBB Cc1ccccc1OCCNC(=O)c1ccc([N+](=O)[O-])cc1 55954443 MEYSGVFDCMMKQM-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB Cc1cnc(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)cn1 97047017 WICBBGSHOVVWIR-UHFFFAOYSA-N 307.693 2.704 5 40 DFBB Cn1/c(=N/C(=O)c2cccc([N+](=O)[O-])c2)sc2ccccc21 4718579 NKJHDCOASSDOPW-NXVVXOECSA-N 313.338 2.889 5 40 DFBB Cn1cccc1[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 72314791 TZXQQYGTOHTBHG-LLVKDONJSA-N 305.359 2.972 5 40 DFBB CCCN(CCC)C(=O)c1cc([N+](=O)[O-])c2nsnc2c1 95983432 IUUWYPUORJLTIL-UHFFFAOYSA-N 308.363 2.862 5 40 DFBB COc1ccc(N/C=C/c2onc(C)c2[N+](=O)[O-])c(OC)c1 100334940 QPOQLECRNZUGRZ-VOTSOKGWSA-N 305.290 2.991 5 40 DFBB O=C(NCCc1ccccc1O)Nc1ccccc1[N+](=O)[O-] 40554371 WRSSSIMLVNHBEZ-UHFFFAOYSA-N 301.302 2.665 5 40 DFBB O=[N+]([O-])c1cccc(N[C@H](c2ccccc2)S(=O)(=O)O)c1 1559042 OPLPOUCFFJDJJY-ZDUSSCGKSA-N 308.315 2.593 5 40 DFBB NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 335484 HQKLBWKGOOBEQJ-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@H]1CCCOc2ccc(F)cc21 53583105 CFNIUWCNVNVURJ-NSHDSACASA-N 306.297 2.793 5 40 DFBB COc1ccccc1C[C@H]1CCCN1c1c([N+](=O)[O-])ncn1C 58545741 MEWABKMQQKCNMB-CYBMUJFWSA-N 316.361 2.548 5 40 DFBB C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCc1cscn1 71799839 CSRXARXWZYBZCB-JTQLQIEISA-N 317.370 2.962 5 40 DFBB Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@@H](C)CC(C)C 46034300 LJFJOEMYGHBWNC-LBPRGKRZSA-N 314.407 2.958 5 40 DFBB COCCN(Cc1ccco1)c1ncc([N+](=O)[O-])cc1Cl 96469352 RACRQDVNGXEUSY-UHFFFAOYSA-N 311.725 2.889 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1ncc(CO)n1C 96496693 WAECETIHWGJSCE-JTQLQIEISA-N 307.375 2.982 5 40 DFBB CCOc1ncccc1NC(=O)c1ccc([N+](=O)[O-])cc1C 65623098 XVOJSVLZXNYYBG-UHFFFAOYSA-N 301.302 2.949 5 40 DFBB CC[N+](C)(C)C[C@H]1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@@H]2CC[C@@]1(C)O[C@H]13 12865599 BGJJAOTZPPPJJJ-MDBUGZKMSA-N 322.469 2.608 5 40 DFBB biogenic CC(C)n1cnnc1SCCOc1ccccc1[N+](=O)[O-] 53221424 UCLZHQJDARDKML-UHFFFAOYSA-N 308.363 2.938 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)c1c(Cl)c(C)nn1C 4615039 JCGCUTYROJCESN-UHFFFAOYSA-N 308.725 2.851 5 40 DFBB CCCn1c(S[C@@H](C)c2cccc([N+](=O)[O-])c2)n[nH]c1=O 7364789 UGLNETQVOZXISO-VIFPVBQESA-N 308.363 2.743 5 40 DFBB Cc1csc2nc(COc3cccc([N+](=O)[O-])c3)cc(=O)n12 16209453 KRXMAEWDQWJACK-UHFFFAOYSA-N 317.326 2.552 5 40 DFBB Cc1cc(NC(=O)Cc2ccon2)c2cc([N+](=O)[O-])ccc2n1 97142400 CWOSKNCAVKCBLC-UHFFFAOYSA-N 312.285 2.621 5 40 DFBB CC(C)Cn1ccc2cc(NC(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])ccc21 84575374 BMQRJUMQBRKSFM-HIFRSBDPSA-N 301.346 2.901 5 40 DFBB CCc1nnc(SCC(=O)c2cccc([N+](=O)[O-])c2)n1CC 216100919 YBIYPNISFXGEFO-UHFFFAOYSA-N 320.374 2.744 5 40 DFBB Cc1cccc(C(=O)N(C)CCCn2ccnc2C)c1[N+](=O)[O-] 130813269 OXQKODCGJYSDSR-UHFFFAOYSA-N 316.361 2.570 5 40 DFBB CN(Cc1ccc([N+](=O)[O-])cc1Cl)C1CCS(=O)CC1 97238697 BHOKBSFLVOBGOB-UHFFFAOYSA-N 316.810 2.591 5 40 DFBB O=[N+]([O-])c1ccccc1CC1=NCCc2cc3c(cc21)OCO3 5004199 PISSJJSAJXXJEU-UHFFFAOYSA-N 310.309 2.911 5 40 DFBB CCCCNc1c([N+](=O)[O-])cc(C(=O)OCC)cc1[N+](=O)[O-] 26509042 CXIBXVUIEVLMMI-UHFFFAOYSA-N 311.294 2.892 5 40 DFBB COc1ccc(NC(=O)c2coc3ccc([N+](=O)[O-])cc23)cn1 408965487 HXNAHCIBQQRPSG-UHFFFAOYSA-N 313.269 2.997 5 40 DFBB O=C(NC1CC1)[C@@H](Oc1ccccc1[N+](=O)[O-])c1ccccc1 8291262 ZFWUIRUMSNPCKH-INIZCTEOSA-N 312.325 2.994 5 40 DFBB C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1COc2ccccc21 95438295 IDBKDWGBSDZNGY-BXUZGUMPSA-N 312.325 2.889 5 40 DFBB CCOc1cccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)n1 95963006 SALTYEVCHHESEA-UHFFFAOYSA-N 317.301 2.649 5 40 DFBB O=[N+]([O-])c1cc2nc(NCc3ccccc3)[nH]c2cc1[N+](=O)[O-] 5531722 SNEUDLXLKRUYSJ-UHFFFAOYSA-N 313.273 2.991 5 40 DFBB CC(=O)c1c[nH]c(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 7949406 SZEOHJHVZUTCOB-JTQLQIEISA-N 315.329 2.959 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1N(C)C 31702058 RXDBDGKZHFDXJL-UHFFFAOYSA-N 300.318 2.617 5 40 DFBB Cc1cccc(N2CCC(OC[C@@H]3CCOC3)CC2)c1[N+](=O)[O-] 225459964 HETJWCKYTPZXPU-CQSZACIVSA-N 320.389 2.925 5 40 DFBB O=C(O)[C@@H]1CS[C@@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 83237252 JQYLQCWCUUOGKX-GWCFXTLKSA-N 320.326 2.643 5 40 DFBB COc1ccc(OCc2noc(-c3ccco3)n2)c([N+](=O)[O-])c1 30618168 WJEIUKGNAIBGOP-UHFFFAOYSA-N 317.257 2.825 5 40 DFBB C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCc2ccccc21 12638012 WOIDRDRCNDFEIX-GFCCVEGCSA-N 311.341 2.985 5 40 DFBB Cc1nn(C)c2nc(-c3cccc([N+](=O)[O-])c3)cc(C(=O)O)c12 4294508 YOWBTPGRPOSMEB-UHFFFAOYSA-N 312.285 2.550 5 40 DFBB O=[N+]([O-])c1ccc([C@@H]2CC(c3cccc([N+](=O)[O-])c3)=NN2)cc1 4359646 BXVPNPDHHLGLQY-AWEZNQCLSA-N 312.285 2.942 5 40 DFBB COc1ccc(NC(=O)[C@@H](OC)c2ccccc2)c([N+](=O)[O-])c1 4617023 LHCOXGZPORSDIP-HNNXBMFYSA-N 316.313 2.930 5 40 DFBB COc1ccccc1C[C@@H]1CCCN1c1c([N+](=O)[O-])ncn1C 69714431 MEWABKMQQKCNMB-ZDUSSCGKSA-N 316.361 2.548 5 40 DFBB O=C1CS/C(=C\[N+](=O)[O-])N1c1ccc(OC(F)(F)F)cc1 5944965 WNKXFHNFLLQNDF-YHYXMXQVSA-N 320.248 2.741 5 40 DFBB CCOc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C/C(N)=O)o1 226257782 VIKSADWNSXPYTC-VMPITWQZSA-N 302.286 2.752 5 40 DFBB Cc1cc(C(=O)NCCN2CCCCCC2)ccc1[N+](=O)[O-] 32817500 OTOHINNMRHNYPX-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB COCc1ccccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] 25304453 ZWGCJPULGDXLNV-UHFFFAOYSA-N 314.341 2.600 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1 12898079 FTSYDYZEKCHNAX-UHFFFAOYSA-N 318.354 2.620 5 40 DFBB COc1ccc(Sc2nc(C(F)(F)F)n[nH]2)c([N+](=O)[O-])c1 78406546 IXBHULBEINBTMK-UHFFFAOYSA-N 320.252 2.892 5 40 DFBB Cc1cc(NC(=O)c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] 75283614 RUKWALJYTNDBRN-UHFFFAOYSA-N 300.270 2.884 5 40 DFBB O=C(Nc1cccc(CO)c1)c1cccc(Cl)c1[N+](=O)[O-] 155971960 UANVZQUOAFRECW-UHFFFAOYSA-N 306.705 2.993 5 40 DFBB COc1ccc(CN(C)C(=O)[C@H]2C[C@H]3C=C[C@H]2C3)cc1[N+](=O)[O-] 100794266 NKXDQNROEDBBPO-UBHSHLNASA-N 316.357 2.774 5 40 DFBB CC(C)OCCCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 6345532 HKDRPJCUUIDJHO-UHFFFAOYSA-N 300.742 2.793 5 40 DFBB C[C@@H]1CCCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 32770562 KROSHVUWLVSNKS-SECBINFHSA-N 318.782 2.811 5 40 DFBB COc1cc([N+](=O)[O-])c(C(=O)NCc2ccoc2)cc1SC 69382477 HQLLULHMUIBKNF-UHFFFAOYSA-N 322.342 2.848 5 40 DFBB CC1CCN(c2c([N+](=O)[O-])c(=O)n(C)c3ccccc23)CC1 5561674 JJVWETTWFIFPHZ-UHFFFAOYSA-N 301.346 2.683 5 40 DFBB C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 8520175 YCKAIEFXPAHMOI-GFCCVEGCSA-N 320.370 2.977 5 40 DFBB CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2C1 69775075 BNKJFBRMQBNGRY-UHFFFAOYSA-N 311.341 2.687 5 40 DFBB COCC[C@H](C)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 80108155 SIDGHQOPSFMSIG-NSHDSACASA-N 309.366 2.554 5 40 DFBB Cc1cnn(CC(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)c1 72288218 LVSIMAFNGHKGKN-UHFFFAOYSA-N 308.725 2.700 5 40 DFBB Cc1nc(Cn2cnc([N+](=O)[O-])n2)oc1-c1ccc(Cl)cc1 84853261 UWTDJDPOOGYQCI-UHFFFAOYSA-N 319.708 2.851 5 40 DFBB CC1CCC(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 32724501 AESPESCMYCKYDI-UHFFFAOYSA-N 312.391 2.794 5 40 DFBB O=C(COc1cccc([N+](=O)[O-])c1)Nc1nc(C2CC2)cs1 29685729 XPCQVTJGTACHNF-UHFFFAOYSA-N 319.342 2.946 5 40 DFBB O=[N+]([O-])c1ccc(/C=C2\SC(=S)N=C2O)c([N+](=O)[O-])c1 20413002 ZRMFOBHNFMVUBX-BAQGIRSFSA-N 311.300 2.832 5 40 DFBB Cc1cccc(NC(=O)CCNc2ccc([N+](=O)[O-])cc2)n1 91463439 UVFVSPFJNDARJS-UHFFFAOYSA-N 300.318 2.739 5 40 DFBB CC(=O)c1ccc(CNc2ncc([N+](=O)[O-])cc2C)nc1C 91624092 OCFZWOWVXMIJEZ-UHFFFAOYSA-N 300.318 2.816 5 40 DFBB Cc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cn1 71899707 JTXFTCIDJFWUKC-UHFFFAOYSA-N 319.748 2.924 5 40 DFBB Cc1cc(N[C@H](CO)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] 97049823 YHHKILWDZRWBJV-AWEZNQCLSA-N 302.330 2.624 5 40 DFBB Cc1cccc(C(=O)NC[C@H]2Cc3ccccc3O2)c1[N+](=O)[O-] 40509998 OBSDUHGTXAYKNI-CYBMUJFWSA-N 312.325 2.637 5 40 DFBB Cc1nn(C)c(NCc2ccccc2OC(F)F)c1[N+](=O)[O-] 51622310 IFOTVUBWJISCGU-UHFFFAOYSA-N 312.276 2.850 5 40 DFBB CCNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 52931470 KRULOBGNMPKFQB-NSHDSACASA-N 314.345 2.913 5 40 DFBB Cn1nnnc1SCc1cc(=O)oc2ccc3ccccc3c12 3286522 JLAFZCIEIATIKP-UHFFFAOYSA-N 324.365 2.762 5 40 DFBB O=C(NCCc1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1Cl 44979315 VJFKRXHTKMFJBA-UHFFFAOYSA-N 320.732 2.926 5 40 DFBB O=C(O[C@@H]1C[C@@H]2CC[C@@H]1C2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 104187029 WGQVYOZJPJVTHR-JRKPZEMJSA-N 306.274 2.848 5 40 DFBB O=C(NCc1ccccc1)c1cc(Cl)cc([N+](=O)[O-])c1O 57294248 KHNMCPNKIWNDAP-UHFFFAOYSA-N 306.705 2.884 5 40 DFBB COc1ccccc1CNCCNc1ccc([N+](=O)[O-])cc1 7276421 JLZBUJDRSLCGOJ-UHFFFAOYSA-N 301.346 2.805 5 40 DFBB Cc1cc(NC(=O)COc2c(C)ccc([N+](=O)[O-])c2C)no1 29750889 MXYTXPJQUPLWNH-UHFFFAOYSA-N 305.290 2.526 5 40 DFBB CN(Cc1ccc(CO)o1)Cc1cc([N+](=O)[O-])ccc1Cl 179788230 PCKRCXFQAKKVBA-UHFFFAOYSA-N 310.737 2.966 5 40 DFBB CN(C)C1(CNC(=O)Nc2cccc([N+](=O)[O-])c2)CCCCC1 18178882 IGWGHHAUCYIDSV-UHFFFAOYSA-N 320.393 2.981 5 40 DFBB C[C@H](OC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 7975343 MUAKDWXFRICQNM-NSHDSACASA-N 314.297 2.779 5 40 DFBB CC[C@@H]1C[N@+]2(C)CCc3cc(OC)c(OC)cc3[C@H]2CC1=O 247694115 YQACESCIPWFYQC-PEELUZDISA-N 304.410 2.747 5 40 DFBB O=C(CSc1ncccn1)Nc1ccc([N+](=O)[O-])cc1Cl 6910787 XAPXMTDDMFMMNN-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB O=C(NCCOc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 22479878 SGONDCUYEFAACR-UHFFFAOYSA-N 304.277 2.543 5 40 DFBB Cc1ccc(O[C@H](C)C(=O)Nc2cc(C)on2)c([N+](=O)[O-])c1 7821618 CVHQYJUVTIIXHA-SNVBAGLBSA-N 305.290 2.606 5 40 DFBB CSc1nc2ncnc(Oc3cccnc3[N+](=O)[O-])c2s1 92582282 REUKMMWYUYBADN-UHFFFAOYSA-N 321.343 2.904 5 40 DFBB CC(C)[C@@H](Nc1ccccc1[N+](=O)[O-])c1nnc2n1CCC2 89801908 CUDBRJMIHFEVNF-CQSZACIVSA-N 301.350 2.942 5 40 DFBB Cc1ccccc1/N=c1\oc2ccc([N+](=O)[O-])cc2cc1C(N)=O 100086514 DAQYCIKESYJZAQ-ZPHPHTNESA-N 323.308 2.981 5 40 DFBB CC[C@@H](NC(=O)C=C1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 96012445 QEODTMWSSGUJFP-MRXNPFEDSA-N 317.389 2.814 5 40 DFBB CC1CCC(OC2CCN(c3c([N+](=O)[O-])ncn3C)CC2)CC1 71888387 JGDODNKMSGRMEJ-UHFFFAOYSA-N 322.409 2.892 5 40 DFBB C[C@]1(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)CCCS1 96467026 ALPJVUOTQQFUHH-CQSZACIVSA-N 309.391 2.680 5 40 DFBB Cc1cccc(C)c1-n1c2nc(=O)[nH]c(=O)c-2cc2ccccc21 59484171 JXXIJOMDWRQZIH-UHFFFAOYSA-N 317.348 2.796 5 40 DFBB Cc1ccc(-n2c3nc(=O)[nH]c(=O)c-3cc3ccccc32)c(C)c1 521972 ORTSIKNVCAERPM-UHFFFAOYSA-N 317.348 2.796 5 40 DFBB COc1ccc(OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 5661640 VOQMMPGQOQQNIM-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB O=C1CCCN1c1ccc(NCc2cccc([N+](=O)[O-])c2)nc1 95430380 PMRNOVQQCNFJNI-UHFFFAOYSA-N 312.329 2.729 5 40 DFBB O=C(COc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC1 95977366 BDNUPFXDKXJUTG-UHFFFAOYSA-N 318.251 2.615 5 40 DFBB CCOCCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 43331640 NDZXMOJIKOQBNO-UHFFFAOYSA-N 301.730 2.796 5 40 DFBB Nc1nnc(Sc2ccc([N+](=O)[O-])c3ncccc23)s1 2503746 YBYKDLGNWBJBDT-UHFFFAOYSA-N 305.344 2.728 5 40 DFBB COc1ccc(C(=O)NCc2ccc(C)cc2)cc1[N+](=O)[O-] 482987 DXFWVKYUDBOMDQ-UHFFFAOYSA-N 300.314 2.842 5 40 DFBB CN(Cc1ccccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 3325697 QEWLDXMANJGGBW-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB Nc1ccc(C(=O)NCCCOC2CCCCC2)cc1[N+](=O)[O-] 10738410 FPCKTVCZACBADY-UHFFFAOYSA-N 321.377 2.646 5 40 DFBB CC(C)C(=O)Nc1cccc(CNc2c([N+](=O)[O-])ncn2C)c1 24211617 YOLXTUSPZNBYQU-UHFFFAOYSA-N 317.349 2.535 5 40 DFBB Cc1ccc(O[C@H](C)C(=O)Nc2ccccc2F)c([N+](=O)[O-])n1 5970201 BHBUILFRLDNHNL-SNVBAGLBSA-N 319.292 2.843 5 40 DFBB Cc1nc(C)c(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)s1 78713599 ZYWLYCGEXKVDJG-UHFFFAOYSA-N 319.386 2.570 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCO[C@@]2(CCSC2)C1 96481074 JLDKKQAJHWEJPT-RISCZKNCSA-N 309.391 2.765 5 40 DFBB Cc1cc([N+](=O)[O-])sc1N1CCN(Cc2ccco2)CC1 65523954 RVAKBEWXSHKOCE-UHFFFAOYSA-N 307.375 2.880 5 40 DFBB CSc1ncccc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] 32816863 KQYORCFNXSCFTF-UHFFFAOYSA-N 317.370 2.984 5 40 DFBB Cc1nc(C(=O)Nc2ccccc2)nn1-c1ccc([N+](=O)[O-])cc1 1397417 QRPGLJHWDAMCNW-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccccc1F 6123727 RXFDFXLPZFASHA-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB O=C(O)COc1ccc(/C=C/c2ccc([N+](=O)[O-])cn2)cc1 84503272 HBXRMMQLAQUNKF-DAFODLJHSA-N 300.270 2.624 5 40 DFBB CCc1ccc(NC(=O)NC[C@H](C)C[C@@H](C)O)cc1[N+](=O)[O-] 77677196 LNMQDWHKWGWECS-GHMZBOCLSA-N 309.366 2.686 5 40 DFBB COc1cccc2nc3ccc(Br)cc3[n+]([O-])c12 76495145 PBBJSNKLMYPUOR-UHFFFAOYSA-N 305.131 2.793 5 40 DFBB CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ccccn1 96437084 KSHAAWPFHKGNHD-HNNXBMFYSA-N 315.329 2.823 5 40 DFBB C[C@H]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 4902663 QCMXOCZIINIRHH-JTQLQIEISA-N 311.769 2.919 5 40 DFBB CN(c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CCCCC1 4905331 YZFXTMNGYZWATA-UHFFFAOYSA-N 312.391 2.767 5 40 DFBB Cc1cnc(N[C@H](c2nnc3n2CCC3)C(C)C)c([N+](=O)[O-])c1 95415007 UIINIINERZTKMV-ZDUSSCGKSA-N 316.365 2.645 5 40 DFBB S=C(Nc1cc2ccncc2c2ncccc12)N1CCOCC1 408976426 QXGNDCLRIOEQQL-UHFFFAOYSA-N 324.409 2.812 5 40 DFBB CC(C)(C)OC(=O)N1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1 29753818 CHCGPJMKOXMMGK-UHFFFAOYSA-N 321.333 2.593 5 40 DFBB O=C(CNCc1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] 52537313 JQDOYLRIEYBXQA-UHFFFAOYSA-N 319.748 2.977 5 40 DFBB O=C(NC1CC1)c1ccc(Nc2cccc(O)c2)c([N+](=O)[O-])c1 96361330 WRZFFHZAJWSDCZ-UHFFFAOYSA-N 313.313 2.936 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnc(C(C)C)s1 72313762 LAKFNEJCDHZENY-UHFFFAOYSA-N 320.374 2.808 5 40 DFBB CS(=O)(=O)c1ccc(NCCc2ccccc2)c([N+](=O)[O-])c1 8055724 ABLUATAGTNWCAX-UHFFFAOYSA-N 320.370 2.653 5 40 DFBB Cc1cccnc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 9741158 NCIDFIJVYOJJIG-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3232957 UTXNEUJORJRSRZ-RYUDHWBXSA-N 320.345 2.541 5 40 DFBB C[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)Cn1ccnc1 81801660 PGTCCHVQMWUKDX-SNVBAGLBSA-N 322.752 2.511 5 40 DFBB COc1cc(Cl)c(I)c([N+](=O)[O-])c1 216842673 HBYCFARCJXVMKI-UHFFFAOYSA-N 313.478 2.861 5 40 DFBB COc1ccc(NC(=O)C(Cl)(Cl)Cl)cc1[N+](=O)[O-] 9141525 DOYXTYGIQBNLSG-UHFFFAOYSA-N 313.524 2.912 5 40 DFBB CCC(CC)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])cn2)CC1 52472993 FWBKOJRZPJMTKA-UHFFFAOYSA-N 320.393 2.829 5 40 DFBB CN(CC(=O)Nc1ccccc1[N+](=O)[O-])c1c(F)cccc1F 58157818 HBXAEZULNCKZHB-UHFFFAOYSA-N 321.283 2.948 5 40 DFBB Cn1cnc([N+](=O)[O-])c1NCc1cccc(CN2CCCC2)c1 36391989 AKDXMRNIEGAUCT-UHFFFAOYSA-N 315.377 2.536 5 40 DFBB C[C@@H]1CCCC[C@H]1NC(=O)CSc1ccc([N+](=O)[O-])cn1 178753118 BIZJJGYGOFEJIK-ZYHUDNBSSA-N 309.391 2.777 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 568368 JZMKSXFWLYHULA-UHFFFAOYSA-N 304.233 2.715 5 40 DFBB Cc1cc(C)n(CCOC(=O)c2cccc([N+](=O)[O-])c2C)n1 42776995 VKPQFXZKKKNIGR-UHFFFAOYSA-N 303.318 2.574 5 40 DFBB COC1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 69517000 UIGKOPDCCGOXNM-UHFFFAOYSA-N 308.378 2.993 5 40 DFBB C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1 5966583 WMVYFALSUCDEBM-NSHDSACASA-N 314.297 2.779 5 40 DFBB CCOc1ncccc1C(=O)Nc1ccc([N+](=O)[O-])cc1C 19161838 YKKIPLXZXTUQKH-UHFFFAOYSA-N 301.302 2.949 5 40 DFBB CCCOC(=O)c1ccc(Sc2nc(C)n[nH]2)c([N+](=O)[O-])c1 70462354 USVGVIYGYBFNIF-UHFFFAOYSA-N 322.346 2.739 5 40 DFBB CC[C@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 7736351 XMRSHCTUIDZUEB-NSHDSACASA-N 312.391 2.767 5 40 DFBB COc1ccc(C)cc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 4677630 VRKSKSRELJQSLL-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB Cc1nn(C)c(C)c1[C@@H](C)C(=O)Nc1ccc(F)cc1[N+](=O)[O-] 71857392 VEWHBQSDWLXNSB-MRVPVSSYSA-N 320.324 2.826 5 40 DFBB Cc1ccc([C@@H](C)NC(=O)c2ccncc2F)cc1[N+](=O)[O-] 96454701 CJXWTECMQHCMCR-SNVBAGLBSA-N 303.293 2.928 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@H](c2ccccc2)C1 13011794 AQSAYGSFWCVMGU-INIZCTEOSA-N 312.325 2.809 5 40 DFBB C[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)NCc1cccs1 8072872 FHDGZAZMQQTRPD-JTQLQIEISA-N 306.343 2.740 5 40 DFBB COc1ccc(/C=C(\CCCOC(C)=O)[N+](=O)[O-])cc1OC 4963454 AQHFPDAQGNZFJD-UKTHLTGXSA-N 309.318 2.665 5 40 DFBB C[C@@H]1[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]2C[C@H]1C2(C)C 102595707 NUHDHPGTPBVBFT-UNJBNNCHSA-N 321.377 2.795 5 40 DFBB CC(C)C[C@@]1(C)NC(=O)N(Cc2csc([N+](=O)[O-])c2)C1=O 54421943 SQSKCBXJMAYVHV-CYBMUJFWSA-N 311.363 2.513 5 40 DFBB CC(=O)N(CC(=O)Oc1ccccc1[N+](=O)[O-])c1ccccc1 1006359 QXKZSMAAFNCBLF-UHFFFAOYSA-N 314.297 2.553 5 40 DFBB CCOc1ccccc1COC(=O)c1cc([N+](=O)[O-])ccc1N 16814308 AFIWEJXQEIRSOQ-UHFFFAOYSA-N 316.313 2.933 5 40 DFBB O=c1oc2ccc(Cl)cc2c(=O)n1-c1ccc([N+](=O)[O-])cc1 4486910 MZVNSIAWBFQMCS-UHFFFAOYSA-N 318.672 2.506 5 40 DFBB CC(C)Cn1ccnc1CNc1nc2sccn2c1[N+](=O)[O-] 78336744 KOCMNSRRDNKUSM-UHFFFAOYSA-N 320.378 2.769 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1 1556251 GIZAKCFKYXAIAU-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB O=[N+]([O-])c1ccc(OCc2nc(-c3ccco3)no2)c(F)c1 47354898 ALBPMTZGBJWVRF-UHFFFAOYSA-N 305.221 2.956 5 40 DFBB O=Cc1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 3043973 SGNIGNHTPGVKCH-UHFFFAOYSA-N 316.225 2.535 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)Cc1ccc(O)cc1 95427608 IGEBWOFGTAQUQX-GFCCVEGCSA-N 314.341 2.970 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])ccc1NCCc1ccc(O)cc1 315218589 JNYKXSWSXRONPO-UHFFFAOYSA-N 302.286 2.653 5 40 DFBB Cc1ccc(NC(=O)CCn2nc([N+](=O)[O-])cc2C)cc1F 195562223 OEFNCLFNBSYALY-UHFFFAOYSA-N 306.297 2.576 5 40 DFBB Cc1ccc(O)c(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 390834313 WCTBLPDPPYYTQQ-UHFFFAOYSA-N 316.269 2.590 5 40 DFBB O=[N+]([O-])c1cc(Br)cc([C@H](O)C(F)(F)F)c1 1857793230 RFQAGULHLKWJLB-ZETCQYMHSA-N 300.030 2.953 5 40 DFBB CCOc1ccccc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 5199939 UYCOSTRJOUPLTR-UHFFFAOYSA-N 301.302 2.828 5 40 DFBB CCN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 32721981 QAGZHHKCQSDCPX-UHFFFAOYSA-N 314.297 2.990 5 40 DFBB O=[N+]([O-])c1cn(Cc2cc(Cl)c3c(c2)OCCCO3)cn1 25451721 XWBOPSWINYOJLB-UHFFFAOYSA-N 309.709 2.654 5 40 DFBB Cc1nc(-c2ccccn2)n(Cc2ccc([N+](=O)[O-])cc2F)n1 97227955 QMZIBRQPASPNRR-UHFFFAOYSA-N 313.292 2.744 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(n2ccnc2)CC1 58158529 POJYAHGAJGISGH-UHFFFAOYSA-N 315.333 2.660 5 40 DFBB C[C@H](CC(=O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])o1 95979588 ADQSGHLTEKUJQJ-MRVPVSSYSA-N 308.315 2.641 5 40 DFBB C[C@@H]1CCc2noc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 8612413 LTSFWTHSANWTTH-SECBINFHSA-N 301.302 2.960 5 40 DFBB Cc1cnc(C(=O)Nc2cc(C)nc3ccc([N+](=O)[O-])cc23)cn1 97142411 OELAYEBRRHXKNA-UHFFFAOYSA-N 323.312 2.802 5 40 DFBB Cc1nc(C)c(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc23)s1 89421230 KMXHFRLGRWXICZ-UHFFFAOYSA-N 317.330 2.797 5 40 DFBB COc1cc2c(=O)n(C)c3nc4ccccc4nc3c2cc1OC 222376839 QEIFJSOKEOOZGF-UHFFFAOYSA-N 321.336 2.652 5 40 DFBB O=C(O)c1ccccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1600148 GXWBOXHJWIENMO-UHFFFAOYSA-N 304.214 2.994 5 40 DFBB CNc1ccc([C@H]2Nc3ccccc3C(=O)N2C)cc1[N+](=O)[O-] 20936341 HNKONLHVABKJHM-HNNXBMFYSA-N 312.329 2.833 5 40 DFBB Cc1cc(OCC(=O)Nc2ccnn2C(C)C)ccc1[N+](=O)[O-] 23080026 DPUXKCZYDKOTGU-UHFFFAOYSA-N 318.333 2.698 5 40 DFBB O=c1ccc(F)cn1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 190753211 VAMWETUFRRSLCT-UHFFFAOYSA-N 315.260 2.599 5 40 DFBB N[C@H](c1ccc(F)cc1)c1n[nH]c(-c2ccc([N+](=O)[O-])cc2)n1 95533260 MKCVYQSZFKNRBW-CYBMUJFWSA-N 313.292 2.567 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)OCO2 536273 LFOWBKGWFWWTCI-UHFFFAOYSA-N 316.269 2.584 5 40 DFBB CC(C)[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nccn1C 32933002 CAQZNQCOZPCYPY-CYBMUJFWSA-N 317.349 2.847 5 40 DFBB O=[N+]([O-])c1c(F)cccc1NCc1nnc2n1CCCCC2 96482662 MHYDRWDHXHKMPN-UHFFFAOYSA-N 305.313 2.664 5 40 DFBB C[C@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 4950326 LCPDEFCQVGINRA-VIFPVBQESA-N 318.782 2.669 5 40 DFBB O=C(Nc1nnc(-c2ccccc2[N+](=O)[O-])o1)c1ccccc1 20496203 ZVSDZVFMQIUJEN-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB COc1cc(NCc2cccnc2N(C)C)ccc1[N+](=O)[O-] 95403073 NKGMWCZLJFZTNC-UHFFFAOYSA-N 302.334 2.677 5 40 DFBB CSc1nnc(NC(=O)c2cccc([N+](=O)[O-])c2C)s1 7319478 VRLZMUMXPYAZRT-UHFFFAOYSA-N 310.360 2.729 5 40 DFBB O=[N+]([O-])c1cnc2ccc(NCC3(c4ccccc4)CC3)nn12 89827710 ZUNFHOLMVBXWNT-UHFFFAOYSA-N 309.329 2.781 5 40 DFBB O=[N+]([O-])c1cnn(C[C@@H](O)c2ccc(C(F)(F)F)cc2)c1 95974746 ABKMETTWTPERLJ-LLVKDONJSA-N 301.224 2.544 5 40 DFBB Cc1ncc([N+](=O)[O-])cc1C(=O)N(Cc1cccnc1)C(C)C 89534641 HUYHQGJKDPRKLH-UHFFFAOYSA-N 314.345 2.744 5 40 DFBB O=C(Cc1cccc(F)c1)NCCNc1ccc([N+](=O)[O-])cc1 8175265 YKFHNLDWUIJNCX-UHFFFAOYSA-N 317.320 2.505 5 40 DFBB Cc1ccc([N+](=O)[O-])c(N2CCC(NC(=O)C3CCC3)CC2)c1 88718616 RONYTQKTJRSQOK-UHFFFAOYSA-N 317.389 2.788 5 40 DFBB COc1ccc(C(=O)Nc2cccc([C@@H](C)O)c2)cc1[N+](=O)[O-] 226274656 ODLHIEDWRIUCKJ-SNVBAGLBSA-N 316.313 2.909 5 40 DFBB CCS[C@@H]1CCC[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 96450511 LTTSQBUCCBYJIJ-UONOGXRCSA-N 308.403 2.928 5 40 DFBB O=C1OCCN1c1cccc(Nc2ncccc2[N+](=O)[O-])c1 46478940 JZLMEWFTNNOPAS-UHFFFAOYSA-N 300.274 2.690 5 40 DFBB Cc1cc(N2CC[C@@H](N3CC=CC3)C2)c2cc([N+](=O)[O-])ccc2n1 102095948 CJGCHVLJWAHYAT-OAHLLOKOSA-N 324.384 2.902 5 40 DFBB O=C1c2cccc3c([N+](=O)[O-])ccc(c23)C(=O)N1c1ccccn1 992633 VKPMTGRKRHPLGR-UHFFFAOYSA-N 319.276 2.944 5 40 DFBB O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=CC[C@H]1C(=O)O 2739974 ODYLVNNFONTPPI-VHSXEESVSA-N 324.720 2.854 5 40 DFBB CN(Cc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(F)cc1 12904848 VUSFNCUUSQLLEZ-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB CCC(C)(C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 65402318 FPENUQFMBSTFEP-UHFFFAOYSA-N 302.334 2.699 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(=O)O 4600570 UPNNOOAADGYKFC-JXMROGBWSA-N 312.281 2.945 5 40 DFBB COc1cccc(OC)c1C(=O)Nc1ccccc1[N+](=O)[O-] 5514840 LDEDEVCWBADYEC-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB Cc1cc(NC(=O)[C@H]2CCO[C@H]2C)c2cc([N+](=O)[O-])ccc2n1 97142439 QBAOMWNSAOIUPX-JQWIXIFHSA-N 315.329 2.815 5 40 DFBB Cc1ccc([N+](=O)[O-])c(N2CCO[C@H](c3cccc(O)c3)C2)n1 89601905 IUVYXZUDHBJTOQ-HNNXBMFYSA-N 315.329 2.582 5 40 DFBB CO[C@@]1(C)C[C@@H](N(C)c2nc3ccccn3c2[N+](=O)[O-])C1(C)C 76093043 XZTMPNXCENHCTB-BZNIZROVSA-N 318.377 2.882 5 40 DFBB COc1ccccc1C1=N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)O1 297399 PQQQXERFRLNLLG-GXDHUFHOSA-N 324.292 2.948 5 40 DFBB Cc1csc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)n1 21143296 CRGXDEDWTWHDHD-UHFFFAOYSA-N 307.331 2.686 5 40 DFBB COc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])o2)cc1F 24311766 FOXQOSKBKDBQQT-QMMMGPOBSA-N 308.265 2.827 5 40 DFBB O=[N+]([O-])c1ccc([C@H](O)CNc2cnc3ccccc3n2)cc1 26134735 RRCSFRFSEKKQHI-OAHLLOKOSA-N 310.313 2.684 5 40 DFBB COc1cccc(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 16600528 FCOZYQODNKSTTA-UHFFFAOYSA-N 300.314 2.842 5 40 DFBB CCCc1ccc(-c2cc(NC(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])[nH]n2)cc1 57205611 QSETWVXEHOCNHR-OCCSQVGLSA-N 314.345 2.633 5 40 DFBB CC(C)Cc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1 5384347 MLWSJFXAKHKOMY-UHFFFAOYSA-N 306.347 2.897 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H](CC4)[C@@H]3C2=O)c([N+](=O)[O-])c1 169302108 BVUUQMPZCQAOIE-FIXIBIHLSA-N 312.325 2.605 5 40 DFBB CO[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 56471879 OGWMHJHODNOBRH-MRXNPFEDSA-N 314.341 2.641 5 40 DFBB Cn1nccc1[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 84303748 UMCWDUBZQJJOCP-HNNXBMFYSA-N 314.389 2.750 5 40 DFBB CC[C@H]1COCCN1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 96455217 HFQRNGPTQPNQRV-OCCSQVGLSA-N 321.377 2.785 5 40 DFBB O=C(Oc1ccccc1/C=C/[N+](=O)[O-])c1ccc2c(c1)OCO2 6473553 JFHYKCIFSLBMMY-BQYQJAHWSA-N 313.265 2.882 5 40 DFBB CNc1ccc([N+](=O)[O-])c2c(NCCCN(C)C)ccnc12 28772253 VTFJIBDXUTYEKS-UHFFFAOYSA-N 303.366 2.548 5 40 DFBB CC(=O)c1ccc(Sc2nnc3ccccn23)c([N+](=O)[O-])c1 7982244 ZUXFCWFXRVILGF-UHFFFAOYSA-N 314.326 2.991 5 40 DFBB O=C(CSc1ncccn1)Nc1cc(Cl)ccc1[N+](=O)[O-] 8127905 FADBHQBFQPVVKF-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB CCC(CC)N(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 12863868 AYYXNNBSUWABEZ-UHFFFAOYSA-N 300.380 2.712 5 40 DFBB Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 5543881 VGUUNYABQWXRJA-UHFFFAOYSA-N 315.285 2.741 5 40 DFBB O=C1Nc2ccc([N+](=O)[O-])cc2/C1=C\c1ccc([N+](=O)[O-])cc1 96991081 PYEIYZSEYUCMHG-NTUHNPAUSA-N 311.253 2.996 5 40 DFBB CC1(C)CN=C(N2CCN(c3ccccc3[N+](=O)[O-])CC2)S1 79064087 UCYQFENIXZVEMA-UHFFFAOYSA-N 320.418 2.598 5 40 DFBB COc1cc(I)c(Cl)c([N+](=O)[O-])c1 216843154 JQZGKDGMQGFYAH-UHFFFAOYSA-N 313.478 2.861 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@H](C3OCCO3)C2)c(Cl)c1 60362982 VXTBZKPCBKKGMN-JTQLQIEISA-N 312.753 2.838 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccccc1 22085972 VEKOICOQIMLTRN-NEPJUHHUSA-N 315.329 2.635 5 40 DFBB O=C1CN(c2ccccc2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1 47170676 AKLPYWKTERUSEJ-UHFFFAOYSA-N 311.297 2.564 5 40 DFBB O=C(O)c1cn(Cc2ccc(Cl)cc2Cl)nc1[N+](=O)[O-] 408717374 ZAGRRZATAWAHRI-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB CC(C)(C)c1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)on1 5280819 URGBPMKRYFGRDB-UHFFFAOYSA-N 319.317 2.898 5 40 DFBB O=C(Oc1cc(=O)oc2ccccc12)c1ccccc1[N+](=O)[O-] 551251 GHHRPJRMBXDJGI-UHFFFAOYSA-N 311.249 2.920 5 40 DFBB Cc1nn(C)cc1[C@@H](C)Nc1nc2sccn2c1[N+](=O)[O-] 75138143 VZVYXXWHRGHJRP-SSDOTTSWSA-N 306.351 2.519 5 40 DFBB CC(C)(CNc1ccc([N+](=O)[O-])cc1Cl)N1CCOCC1 23295807 LMOGJKSTJHQSCH-UHFFFAOYSA-N 313.785 2.771 5 40 DFBB Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)c1ccccc1F 58162139 LLXXQQQLRWBZQR-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB O=[N+]([O-])c1ccc(N(CCO)Cc2ccccc2)c([N+](=O)[O-])c1 4409617 PFECLVYMQFPSHP-UHFFFAOYSA-N 317.301 2.502 5 40 DFBB COc1ccc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)cc1[N+](=O)[O-] 97083133 LOKOMLZLRXYNDF-QWRGUYRKSA-N 305.334 2.867 5 40 DFBB O=[N+]([O-])c1c(N[C@H](CCO)c2cccs2)nc2sccn12 77236117 CJDYNOVSNIOTSU-MRVPVSSYSA-N 324.387 2.901 5 40 DFBB O=c1cc(CSc2sccc2[N+](=O)[O-])nc2ccccn12 96492794 APQXHELDEHRDPN-UHFFFAOYSA-N 319.367 2.957 5 40 DFBB COc1cc(-c2nc(O)c3ccccc3n2)cc([N+](=O)[O-])c1O 575410884 IZJORTXSCZVFQX-UHFFFAOYSA-N 313.269 2.625 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)c2cccc(F)c2)cc1[N+](=O)[O-] 150745058 FWQUPHQDEHMPEF-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccs1 19902104 FNWGSKICNPZGJG-CYBMUJFWSA-N 319.386 2.689 5 40 DFBB CC[N+](C)(C)C[C@@H]1C(=O)O[C@@]23[C@@H](CC[C@@]4(C)O[C@H]42)[C@H](C)CC[C@@H]13 4073588 BGJJAOTZPPPJJJ-FHBJCVGMSA-N 322.469 2.608 5 40 DFBB biogenic CC1(NC(=O)Cc2ccccc2[N+](=O)[O-])Cc2ccccc2C1 92593966 GRYBSAWBPMWQDR-UHFFFAOYSA-N 310.353 2.811 5 40 DFBB Cc1cc(C)c(C)c(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1C 37077271 NLCIAMLPEQRFCC-UHFFFAOYSA-N 314.341 2.873 5 40 DFBB Cc1csc([C@H](Nc2c([N+](=O)[O-])c(C)nn2C)C2CC2)n1 78381467 HIVSVEGSQLLQRV-SNVBAGLBSA-N 307.379 2.965 5 40 DFBB O=[N+]([O-])c1cc2[nH]cnc2c([N+](=O)[O-])c1NCc1ccccc1 5385797 MAVJXFRWYVFLNB-UHFFFAOYSA-N 313.273 2.991 5 40 DFBB O=C(O)/C(=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1C(=O)O 4701676 FAEALMZEEPUTRR-NTEUORMPSA-N 313.265 2.918 5 40 DFBB O=[N+]([O-])c1ccccc1CN1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 4725192 HUYZTWXQPXNEDQ-DAYGRLMNSA-N 315.417 2.901 5 40 DFBB COc1ccc([C@@H]2CCCCCN2C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])cc1 44372936 BLQLNMFULDYFFU-JYJNAYRXSA-N 318.373 2.804 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1ccccc1F 44912086 HOPXNHDWYFFMPB-UHFFFAOYSA-N 302.305 2.935 5 40 DFBB O=[N+]([O-])c1cc(Cl)cc2[nH]nc(I)c12 14983711 FADCULZWTHEJND-UHFFFAOYSA-N 323.477 2.729 5 40 DFBB O=C(Cc1ccccc1)Nc1nnc(-c2ccccc2[N+](=O)[O-])o1 20496232 CGOCXDXRPXIJLH-UHFFFAOYSA-N 324.296 2.826 5 40 DFBB O=C(NC[C@H]1CCOCO1)c1cc2ccccc2c2cccnc12 95427589 CNNKZXVKEAZTEW-CQSZACIVSA-N 322.364 2.881 5 40 DFBB Cc1ccc(C)c(C(=O)COC(=O)c2cc([N+](=O)[O-])cn2C)c1 21839913 RNBNVZBAHGAWGI-UHFFFAOYSA-N 316.313 2.590 5 40 DFBB O=[N+]([O-])c1ccc(OC[C@@H](O)CC(F)(F)F)c2cccnc12 189428501 KRUNPRAGIIDVHK-QMMMGPOBSA-N 316.235 2.835 5 40 DFBB CCOc1ccc(Br)cc1C[N+]1(C)CCOCC1 544622 KZKJDHMVVAWNFW-UHFFFAOYSA-N 315.231 2.825 5 40 DFBB COc1cc(Cl)c(I)cc1[N+](=O)[O-] 97756588 QIBRDROGJDZGHT-UHFFFAOYSA-N 313.478 2.861 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@@H]2OCCC[C@@H]2C1 97095522 PUOZPFAOJNSRAO-RISCZKNCSA-N 324.764 2.889 5 40 DFBB CCCCSc1ncc(OCc2ncc([N+](=O)[O-])n2C)cn1 2506205 UIYJVQGACVFUQF-UHFFFAOYSA-N 323.378 2.590 5 40 DFBB O=C(NC[C@H](O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 32760804 UPFIMGVLQXBXAI-AWEZNQCLSA-N 320.732 2.712 5 40 DFBB CC[N+](C)(C)C[C@H]1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@H]2CC[C@@]1(C)O[C@H]13 36511659 BGJJAOTZPPPJJJ-QXFUVKNKSA-N 322.469 2.608 5 40 DFBB Cc1nnc([C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])o1 89736290 UKWVPEJGBMYGSA-ZDUSSCGKSA-N 318.333 2.502 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(Nc2cccc(F)c2)n1 4306349 XPUKYGQRWJOIBF-UHFFFAOYSA-N 320.328 2.918 5 40 DFBB O=C(c1cccs1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 9157387 XLBSSYIKVAENIZ-UHFFFAOYSA-N 317.370 2.619 5 40 DFBB O=C(O)C1=NN(c2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 71979026 UDGGDSXHFPMUCZ-OAHLLOKOSA-N 311.297 2.987 5 40 DFBB C[C@H]1CCO[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 225574972 HELIPBIJOPGYHV-LKFCYVNXSA-N 301.302 2.507 5 40 DFBB Cc1nc(NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])sc1-c1ccccc1 44492453 PEOQSCKWJAIQNQ-WDEREUQCSA-N 303.343 2.722 5 40 DFBB Cc1cc(C(=O)O)ccc1NC(=O)c1ccccc1[N+](=O)[O-] 13391020 XWNHYGQRNIHSON-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB O=C1[C@H]2CCCC[C@@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 13603358 LLGYMIYRWVKWTJ-UWVGGRQHSA-N 308.721 2.928 5 40 DFBB CCOc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2)c1 30863630 FFSPBAHPHLOWAB-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB COc1ccccc1OCC(=O)Oc1ccccc1[N+](=O)[O-] 358734 YKZXQVSUXWQTDA-UHFFFAOYSA-N 303.270 2.588 5 40 DFBB CC[N+](C)(C)C[C@H]1C(=O)O[C@@]23[C@@H]1CC[C@@H](C)[C@H]2CC[C@@]1(C)O[C@H]13 9329324 BGJJAOTZPPPJJJ-AEZJXXPFSA-N 322.469 2.608 5 40 DFBB Cc1ccc(OCCN(C)C(=O)c2ccc([N+](=O)[O-])o2)cc1 24388902 BNOAEILGTFYGMO-UHFFFAOYSA-N 304.302 2.647 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 72295040 CPUMGJMLHVPDGN-YUTCNCBUSA-N 319.361 2.838 5 40 DFBB CCc1cccc(N(C#N)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 89289525 QKUCFVYFHTXCCH-UHFFFAOYSA-N 324.340 2.744 5 40 DFBB Cc1nn(C)cc1[C@H](C)Nc1nc2sccn2c1[N+](=O)[O-] 75138145 VZVYXXWHRGHJRP-ZETCQYMHSA-N 306.351 2.519 5 40 DFBB Cc1cc(SCc2ccc([N+](=O)[O-])cc2)n2ncnc2n1 315913 NEJBFRYCTVHKFI-UHFFFAOYSA-N 301.331 2.633 5 40 DFBB Cc1nc(N2CCO[C@H](c3cccc(O)c3)C2)ccc1[N+](=O)[O-] 89602226 JRDCGDUTALWMNS-HNNXBMFYSA-N 315.329 2.582 5 40 DFBB COc1ccc(C)cc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 3031158 UIXLQUKGHGXMPK-UHFFFAOYSA-N 312.281 2.712 5 40 DFBB O=C(CSc1nc2ncccc2[nH]1)c1cccc([N+](=O)[O-])c1 8682474 QYHHMCXXORAEJE-UHFFFAOYSA-N 314.326 2.841 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@H](C)NC(=O)[C@H](C)OCC1CC1 71830668 KCIHECUTHOOUNT-QWRGUYRKSA-N 322.361 2.596 5 40 DFBB O=[N+]([O-])c1cnn(CCSc2nc3ncc(Cl)cc3[nH]2)c1 74782999 ZILCPVNMJBAUJI-UHFFFAOYSA-N 324.753 2.508 5 40 DFBB O=[N+]([O-])c1ccc(CSc2ncn[nH]2)c(Br)c1 73639579 PXAZYOZJNBHKNX-UHFFFAOYSA-N 315.152 2.768 5 40 DFBB CNc1ccc(C(=O)Nc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 4895852 XNDALPYPTIMWPI-UHFFFAOYSA-N 315.285 2.618 5 40 DFBB Cc1ccc(C(=O)NCCOCc2ccccc2)cc1[N+](=O)[O-] 177080447 VXDANISELXUXDU-UHFFFAOYSA-N 314.341 2.850 5 40 DFBB O=C(Oc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 10272142 CHOOTJDIABKERW-UHFFFAOYSA-N 311.249 2.920 5 40 DFBB C[C@@H]1CCC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1C 5109422 GCXCZOHOPBMYLM-JHJVBQTASA-N 306.362 2.915 5 40 DFBB CCc1cc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)on1 72295044 URWROTMINUPRIE-UHFFFAOYSA-N 304.306 2.775 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc(C(F)F)[nH]2)c([N+](=O)[O-])c1 216903611 GQQFQVPCWRGJBE-UHFFFAOYSA-N 317.233 2.710 5 40 DFBB CN(c1ccc(F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 194203695 UWPKOBGJUFKXCO-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB O=c1cc2sc3ccccc3c(=O)n2nc1-c1ccccc1 343947 JLSFJZPHWIXALT-UHFFFAOYSA-N 306.346 2.936 5 40 DFBB NC(=O)c1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 3061379 IQISWNBHSDSZAQ-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB C[C@@H](Nc1nc(Cl)nc(N)c1[N+](=O)[O-])[C@@H]1C[C@H]2CC[C@H]1C2 110552203 FOHGDLUCLPXOLZ-XGEHTFHBSA-N 311.773 2.857 5 40 DFBB C[C@@H]1CCCC[C@H]1NC(=O)NCCNc1ccccc1[N+](=O)[O-] 12642045 SSXCYYNRGIPZMF-CHWSQXEVSA-N 320.393 2.885 5 40 DFBB CSc1ccc(C(=O)NCc2ccccn2)cc1[N+](=O)[O-] 6821570 FZQPRSCTJRMSFS-UHFFFAOYSA-N 303.343 2.642 5 40 DFBB CCc1ccc(NC(=O)N2CCC[C@@H]([C@@H](C)O)C2)cc1[N+](=O)[O-] 95972423 FXVJNTGIFUMDQW-DGCLKSJQSA-N 321.377 2.782 5 40 DFBB C[C@](O)(CNc1ccncc1[N+](=O)[O-])c1ccc(F)cc1F 79311316 ZKBCABJUBOSXRA-AWEZNQCLSA-N 309.272 2.588 5 40 DFBB C[C@@H]1CCO[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 225574880 HELIPBIJOPGYHV-OTYXRUKQSA-N 301.302 2.507 5 40 DFBB Cc1cc(NC(=O)N2CC[C@H]3OCCC[C@@H]3C2)ccc1[N+](=O)[O-] 97095982 GJCOYWCVWGYGKW-IUODEOHRSA-N 319.361 2.936 5 40 DFBB O=[N+]([O-])c1ccc(-c2nnn(Cc3ccccc3Cl)n2)cc1 4973959 YKFGSFAYHMJRGY-UHFFFAOYSA-N 315.720 2.950 5 40 DFBB COc1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1[N+](=O)[O-] 354892 MVUBWJHIBMVYMD-LCYFTJDESA-N 324.292 2.948 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccccc1C(C)C 65712535 BBGWLYLPENIPNE-UHFFFAOYSA-N 302.334 2.862 5 40 DFBB C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCc1cscn1 71799838 CSRXARXWZYBZCB-SNVBAGLBSA-N 317.370 2.962 5 40 DFBB O=C(Cc1noc2ccccc12)NCc1ccc([N+](=O)[O-])cc1 55797763 JDBNVILUQDUJAT-UHFFFAOYSA-N 311.297 2.595 5 40 DFBB CSC[C@H](C)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 68103361 VMQZKTKRHGXWAI-JTQLQIEISA-N 320.374 2.718 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC[C@@H]1c1ccncc1 97097068 STCVFTWOXQSYQJ-CQSZACIVSA-N 313.313 2.673 5 40 DFBB N[C@@H](Cc1ccccc1)c1n[nH]c(Cc2ccc([N+](=O)[O-])cc2)n1 95534898 XRLLQSZOMQTWBB-HNNXBMFYSA-N 323.356 2.546 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])s1)Nc1ccccc1F 3496605 MBMMDEXHPLFSNO-UHFFFAOYSA-N 324.289 2.591 5 40 DFBB O=[N+]([O-])c1ccc(Cl)cc1OCCOC[C@@H]1CCCO1 76065302 YEGSKYAZRAYHAL-NSHDSACASA-N 301.726 2.823 5 40 DFBB O=Cc1cc([N+](=O)[O-])ccc1Sc1nc(-c2ccco2)n[nH]1 409274598 QCGRITOIYOFENJ-UHFFFAOYSA-N 316.298 2.937 5 40 DFBB CSc1ccc(OCCn2cccc([N+](=O)[O-])c2=O)cc1 96430159 JVRLAEAJXRPXER-UHFFFAOYSA-N 306.343 2.557 5 40 DFBB Cc1c(C(=O)NCCCN2CCCCCC2)cccc1[N+](=O)[O-] 13675576 QRNHUHSWTKUKLK-UHFFFAOYSA-N 319.405 2.899 5 40 DFBB O=c1ccc(-c2cccs2)nn1Cc1cccc([N+](=O)[O-])c1 5388087 PJXDWAKMPHNAKZ-UHFFFAOYSA-N 313.338 2.928 5 40 DFBB O=c1c(Cl)c(Cl)cnn1Cc1ccccc1[N+](=O)[O-] 28787810 ODBQLQIQLGZFIJ-UHFFFAOYSA-N 300.101 2.507 5 40 DFBB CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NOCc1ccccc1 8096968 SDWLEIBNPYEPID-UHFFFAOYSA-N 315.329 2.522 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)[C@@H](O)c1cc(Cl)ccc1O 104063524 UGMYLZWPXKIKIX-AWEZNQCLSA-N 307.689 2.870 5 40 DFBB Cn1cnc([N+](=O)[O-])c1NCCOc1ccc2ccccc2c1 8375744 QSRCIXJOZHCKOT-UHFFFAOYSA-N 312.329 2.972 5 40 DFBB CCN(CC)C(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408534253 UNKQQCHZLTVJGJ-UHFFFAOYSA-N 300.318 2.534 5 40 DFBB CN(Cc1ccc(F)cc1)C(=O)Nc1ccncc1[N+](=O)[O-] 97080964 CVXJUNKONDDMIW-UHFFFAOYSA-N 304.281 2.793 5 40 DFBB O=[N+]([O-])c1cc(NS(=O)(=O)CCC2CC2)ccc1Cl 95441736 SZFJIFWPPFPSOO-UHFFFAOYSA-N 304.755 2.790 5 40 DFBB Cc1n[nH]c(C)c1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl 78806384 SEICSRLLGVTCSZ-UHFFFAOYSA-N 308.725 2.518 5 40 DFBB O=[N+]([O-])c1ccc(-c2nnc3n2N[C@H](c2ccco2)S3)cc1 3843222 JESZIPPBUBXUPT-LBPRGKRZSA-N 315.314 2.794 5 40 DFBB biogenic O=C(OC1CCSCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2180782 XPJAIYLVZWDGQF-UHFFFAOYSA-N 312.303 2.555 5 40 DFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])Oc1ccc2c(c1)OCO2 3322984 QTRFXQCTDRXJBN-VMPITWQZSA-N 313.265 2.942 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(SC)nc2)c1 69625733 CPERNWPMYXYFJJ-UHFFFAOYSA-N 319.342 2.973 5 40 DFBB C[C@H](NCc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccncc1 95385689 FAKIPQKCIGTQAD-JTQLQIEISA-N 301.302 2.569 5 40 DFBB Cc1cnc(COC(=O)c2csnc2C)c(C)c1[N+](=O)[O-] 191369354 JVLYYNIUYCSJNU-UHFFFAOYSA-N 307.331 2.729 5 40 DFBB Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@H]2C=C[C@@H]3C23CC3)cc1[N+](=O)[O-] 101024774 OJTCDNPDVDMLQF-JURCDPSOSA-N 324.336 2.605 5 40 DFBB C[C@@H](NC[C@H](O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 6007937 YJRADHWTWDJRKO-CJNGLKHVSA-N 316.357 2.685 5 40 DFBB CC(C)C(=O)NC(=S)Nc1ccc(Cl)c([N+](=O)[O-])c1 8558131 WRPUZHDQWJWUQG-UHFFFAOYSA-N 301.755 2.717 5 40 DFBB O=C1OCCN1c1cccc(CNc2ncccc2[N+](=O)[O-])c1 47253076 BHEGFJNGISYLCO-UHFFFAOYSA-N 314.301 2.559 5 40 DFBB CN(C)c1cc(Nc2ccc(O)cc2)c([N+](=O)[O-])c2nonc12 5024892 PLZALTUDBFCCIC-UHFFFAOYSA-N 315.289 2.646 5 40 DFBB CN(c1cccc(F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 225006776 RIOHGLCELZZRPV-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB Cc1cc(=O)n(Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] 96474512 KMGCGAHATUCVEW-UHFFFAOYSA-N 317.326 2.830 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1C=O 91293266 LWGJQPWXRWQCQL-UHFFFAOYSA-N 301.254 2.986 5 40 DFBB in-vitro CC(C)C[C@](C)(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 5421267 NTLWYDBVHFPHOF-ZDUSSCGKSA-N 311.294 2.804 5 40 DFBB COC(=O)[C@@H](CC(C)C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 32265663 UQPMCWKMIOEENR-LLVKDONJSA-N 311.294 2.503 5 40 DFBB Cc1nn([C@H](C)C(=O)Nc2ccc(F)cc2)c(C)c1[N+](=O)[O-] 2640288 SXJNSKKDJHHOEU-SNVBAGLBSA-N 306.297 2.747 5 40 DFBB CC(C)[C@@H](CNc1c([N+](=O)[O-])ncn1C)N1CCCCCC1 24203805 HXZRAOMIMLBFKW-CYBMUJFWSA-N 309.414 2.641 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(F)ccc2F)cc1 7405079 SFPGSXBFJAOWED-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB CCC(CC)(CO)NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 72313536 HHDMCVQCEJKGGO-UHFFFAOYSA-N 315.757 2.921 5 40 DFBB COc1ccc(C(=O)O)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 5720673 ZIKXTYNTHKXVDW-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1ccc(Cl)cc1NC(=O)COc1cccnc1[N+](=O)[O-] 12634557 VGHHWHIEIXGJJL-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB COc1ccccc1[C@@H]1NC[C@H](c2ccc([N+](=O)[O-])cc2)O1 19805530 RUPFSSOHHXJTKI-HZPDHXFCSA-N 300.314 2.963 5 40 DFBB COc1ccc(C(=O)Nc2cc(OC)cc([N+](=O)[O-])c2)cc1 3141650 KFWPAVGRCGCPFV-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB Cc1ccc(S(=O)(=O)[C@H](C[N+](=O)[O-])c2ccccc2)cc1 7966303 LYHUVMDNSSMZFF-OAHLLOKOSA-N 305.355 2.787 5 40 DFBB CCOC(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 32815009 PAVKWPBANKLJPB-UHFFFAOYSA-N 311.313 2.767 5 40 DFBB O=C(Nc1cccc(-c2nnco2)c1)c1ccccc1[N+](=O)[O-] 24737146 GJRGDZBOBJBBHB-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB O=C(COC(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 5061990 CGQVMNYTUVQUBZ-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB O=C(O)c1ccc(Oc2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1 1689775 YCUJRFCEUIPBKZ-UHFFFAOYSA-N 304.214 2.994 5 40 DFBB C[C@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 6124175 QATJADQOHVAYNF-CYBMUJFWSA-N 314.341 2.894 5 40 DFBB Cc1ccc(NC(=O)[C@H](C)OC[C@@H]2CCCCO2)cc1[N+](=O)[O-] 58431471 DLWKREZGDRDRMF-JSGCOSHPSA-N 322.361 2.816 5 40 DFBB Cc1ccc(C)c(N(C(=O)Cn2ccc([N+](=O)[O-])n2)C(C)C)c1 69528044 MQAFMBUEUHGWKX-UHFFFAOYSA-N 316.361 2.850 5 40 DFBB COc1ccc(C(=O)[C@H](C)Oc2cccnc2[N+](=O)[O-])cc1 5971298 YQIPBYAVHRPPHY-JTQLQIEISA-N 302.286 2.649 5 40 DFBB CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 10017762 JMKMVDNOWDOONX-INIZCTEOSA-N 313.357 2.628 5 40 DFBB Cc1ccc(C(=O)N2CCN=Cc3cc([N+](=O)[O-])ccc32)cc1 73642278 QGDXJTBGIXUCIK-UHFFFAOYSA-N 309.325 2.983 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN1c1nccs1 95948743 BZBAZAQUHDHIBB-LBPRGKRZSA-N 318.358 2.659 5 40 DFBB O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC1CCCCC1 2512858 QMZULJCUFXOVHQ-UHFFFAOYSA-N 318.782 2.859 5 40 DFBB O=[N+]([O-])c1cccc([C@H]2C=C(c3ccccc3)Nc3nnnn32)c1 101038337 PFFMMLVDTRUIGI-OAHLLOKOSA-N 320.312 2.637 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cn1)Nc1cc([N+](=O)[O-])ccc1F 4773527 HJXRYPVUFNEHMY-UHFFFAOYSA-N 321.224 2.681 5 40 DFBB NC(=O)c1ccc(Cn2cc(-c3ccccc3)cn2)c([N+](=O)[O-])c1 71905453 NPNSURTZVRURNN-UHFFFAOYSA-N 322.324 2.606 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)nc2)c1 69844793 JCUKGWUYPYKEKR-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB CCc1ccc(C(=O)O[C@@H](C)c2nnc(C)o2)cc1[N+](=O)[O-] 96446380 BZYHEJLQIUMCDG-QMMMGPOBSA-N 305.290 2.767 5 40 DFBB O=C(NCCCN1CCCCCC1)c1ccc([N+](=O)[O-])cc1 10111081 NJRWDFNTBIOZQK-UHFFFAOYSA-N 305.378 2.591 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)c1cn(C)nc1C 69567889 FWZHQMLRLUGRCO-JTQLQIEISA-N 317.349 2.828 5 40 DFBB O=C(O)CCCCC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 4832859 GZFNLWXKUDUFFH-UHFFFAOYSA-N 323.330 2.788 5 40 DFBB O=[N+]([O-])c1ccc(N[C@H]2CCN3CCCC[C@H]23)c([N+](=O)[O-])c1 36389626 OJHNUMDCGWTBNO-QWHCGFSZSA-N 306.322 2.542 5 40 DFBB O=[N+]([O-])c1cccc(CN[C@@H](Cn2cncn2)c2ccccc2)c1 77404706 DNILUYIBLIGTBC-KRWDZBQOSA-N 323.356 2.717 5 40 DFBB CCc1ccc(NC(=O)NC[C@H](C)C[C@H](C)O)cc1[N+](=O)[O-] 77677201 LNMQDWHKWGWECS-MNOVXSKESA-N 309.366 2.686 5 40 DFBB O=c1ccc2nc3ccc(N[C@H]4CN5CCC4CC5)cc3oc-2c1 1857775619 KUYKROXIBSSIQM-KRWDZBQOSA-N 321.380 2.799 5 40 DFBB O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCCCCC1 32770494 FSGPOSTXMASYCL-UHFFFAOYSA-N 318.782 2.813 5 40 DFBB Cc1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)cc1 3383764 USMMHNHPXFBRBC-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccc(F)cc1 46644681 VXXWAJDHMKKNKM-LLVKDONJSA-N 320.324 2.540 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCC1(O)CCOCC1 69978157 MFRXGSPJEIEXQX-UHFFFAOYSA-N 320.267 2.567 5 40 DFBB Cc1noc(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)n1 95403135 SNSFRUBLJAFUIN-UHFFFAOYSA-N 314.248 2.542 5 40 DFBB CNS(=O)(=O)c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1 8146758 UUVCNPPCRVSITJ-UHFFFAOYSA-N 324.383 2.654 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1[N+](=O)[O-] 253669 PMIDROXZNFCCLL-VXGBXAGGSA-N 304.302 2.509 5 40 DFBB CCOC(=O)CC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 8700385 XJTZLTFXRMUYNO-UHFFFAOYSA-N 303.270 2.991 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1ncccc1OC(F)F 57698404 SOIMMXIZRBYJAC-UHFFFAOYSA-N 323.255 2.772 5 40 DFBB COC(=O)c1cc(N(C)Cc2ccncc2)cc(C)c1[N+](=O)[O-] 89587376 JUKPYDMOYWZGOO-UHFFFAOYSA-N 315.329 2.721 5 40 DFBB CCOc1cc([N+](=O)[O-])ccc1-c1ccc(C(=O)NC(C)=O)o1 85346803 XCTNJMQZDCZMRG-UHFFFAOYSA-N 318.285 2.530 5 40 DFBB COc1ccc(CCCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 13631918 MHYBZCJJMRZWSJ-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB Cc1ccccc1OCCNC(=O)c1cccc([N+](=O)[O-])c1 55955021 JRPFHJNSILBYAW-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB O=C(NCCCc1nc2ccccc2[nH]1)c1ccc([N+](=O)[O-])cc1 3136142 XTYHHFRSFDBNBD-UHFFFAOYSA-N 324.340 2.834 5 40 DFBB CSc1ccc(C(=O)NCc2ccncc2)cc1[N+](=O)[O-] 5689680 QKGFQEZLADCSRK-UHFFFAOYSA-N 303.343 2.642 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC[C@H]1c1ccncc1 97097070 STCVFTWOXQSYQJ-AWEZNQCLSA-N 313.313 2.673 5 40 DFBB Cc1ccc2c(c1)CCCN2C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 64335799 WJXXZEPDSMLVBO-UHFFFAOYSA-N 300.318 2.528 5 40 DFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cccc(F)c1 7706627 DDICQYDBSVORMN-UHFFFAOYSA-N 300.245 2.530 5 40 DFBB Cc1ccc([C@H](C)NC(=O)c2ccncc2F)cc1[N+](=O)[O-] 96454702 CJXWTECMQHCMCR-JTQLQIEISA-N 303.293 2.928 5 40 DFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])OC1([C@@H]2CCOC2)CC1 96442322 ORWQLYUSNKNFSE-URWSZGRFSA-N 303.314 2.720 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H](CC3)[C@H]2C1=O 169703828 BPBSXZMLLWDWFB-FKGLVLAHSA-N 312.325 2.605 5 40 DFBB O=C(NCCCn1cnc2ccccc21)c1cccc([N+](=O)[O-])c1 12490064 BNALAWTUFZRIBG-UHFFFAOYSA-N 324.340 2.765 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)n[nH]2)c1 69454891 HDFSJULRFHXRQS-UHFFFAOYSA-N 318.333 2.876 5 40 DFBB O=C(N[C@H]1CCCSC1)N1CCc2c(cccc2[N+](=O)[O-])C1 95975619 RBQGGCPUWJNANB-LBPRGKRZSA-N 321.402 2.558 5 40 DFBB O=C(CSCc1cccc([N+](=O)[O-])c1)Nc1cccnc1 408725278 DUBKJNSVWSWWLY-UHFFFAOYSA-N 303.343 2.862 5 40 DFBB Cc1ccc(OS(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)cc1 226862727 SYQJUZNYEKNKTI-UHFFFAOYSA-N 311.290 2.810 5 40 DFBB CC(C)OC(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2N)CC1 390822531 BZODBYDUSANGEK-UHFFFAOYSA-N 322.365 2.598 5 40 DFBB C[C@H](OC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 5721773 PPTUBSSINJWZBK-BPNCWPANSA-N 319.313 2.866 5 40 DFBB CCN(CC)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 4182324 SAPCUOAGJIIDAQ-ZDUSSCGKSA-N 305.378 2.680 5 40 DFBB Cc1cc(NC(=O)NCc2c(C)noc2C)ccc1[N+](=O)[O-] 97163065 XSNGSAVODAGYQT-UHFFFAOYSA-N 304.306 2.830 5 40 DFBB CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1noc(C)n1 95978739 GCILNHAFCXRILZ-JTQLQIEISA-N 324.724 2.821 5 40 DFBB COC(=O)[C@H](C)c1c(C)nn(Cc2cccc([N+](=O)[O-])c2)c1C 89520838 QUGURHVLGXBCHH-SNVBAGLBSA-N 317.345 2.733 5 40 DFBB CCCN1C(=O)N/C(=C/c2cc([N+](=O)[O-])ccc2Cl)C1=O 409241825 OWOBTTQAMVJEGC-YRNVUSSQSA-N 309.709 2.551 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCO[C@]2(CCSC2)C1 96481070 JLDKKQAJHWEJPT-BXUZGUMPSA-N 309.391 2.765 5 40 DFBB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl 47264448 QATQJSVIQADQPS-ZIAGYGMSSA-N 323.780 2.605 5 40 DFBB CCc1cnc([C@@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])s1 97050649 VYJVWEACUMYMDJ-MRVPVSSYSA-N 320.374 2.687 5 40 DFBB CS[C@@H]1CCC[C@@H]1N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] 107146024 OWZLWCLNRNUOOF-UONOGXRCSA-N 323.418 2.749 5 40 DFBB CCc1nnc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)s1 1513881 RAUOMGKLVVHORO-UHFFFAOYSA-N 312.738 2.914 5 40 DFBB O=C(COC(=O)c1ccco1)Nc1cc(Cl)ccc1[N+](=O)[O-] 5080141 XJTFPSDZPFPMCE-UHFFFAOYSA-N 324.676 2.637 5 40 DFBB CCc1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 5260026 DAIYDPLPKMMXKK-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccco1 7038717 GZRAQFYCLIKWOB-SNVBAGLBSA-N 306.343 2.985 5 40 DFBB C[C@H]1C[C@@H](C)CN(CCCCNC(=O)c2ccc([N+](=O)[O-])o2)C1 40535196 ZJDJJFFYLWJFMX-BETUJISGSA-N 323.393 2.676 5 40 DFBB COc1cc(C=O)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 225545 LPTOFQVNTLGCHO-UHFFFAOYSA-N 301.254 2.635 5 40 DFBB biogenic O=C(c1ccoc1)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 24206636 QUADWZPJBHPQRQ-UHFFFAOYSA-N 315.329 2.905 5 40 DFBB COC(=O)c1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1 9364978 OWQNWJPLMHWHSM-UHFFFAOYSA-N 300.270 2.634 5 40 DFBB biogenic COc1ccccc1O[C@H](C)CNc1c([N+](=O)[O-])c(C)nn1C 78504443 VRPHOPMQVBSSEF-SNVBAGLBSA-N 320.349 2.525 5 40 DFBB C[C@H](OC(=O)[C@H]1C[C@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])cc1 248287909 HANZSBWKEKJQSI-LKTVYLICSA-N 315.329 2.736 5 40 DFBB COc1cc2c(=O)[nH]c3cc([N+](=O)[O-])ccc3c2cc1[N+](=O)[O-] 16926715 BQSWRNVGLGMTFD-UHFFFAOYSA-N 315.241 2.506 5 40 DFBB O=C1O[C@H](c2ccc([N+](=O)[O-])cc2C(=O)O)Nc2ccccc21 4708788 BZRSFRGJWRPFEA-CYBMUJFWSA-N 314.253 2.574 5 40 DFBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(Sc3ccccc3)cc21 12428001 WJDDCAOLCNZIMO-UHFFFAOYSA-N 315.354 2.936 5 40 DFBB CCOc1ccccc1OC(=O)COc1ccc([N+](=O)[O-])cc1 148518 UJSGENIGXGZJHL-UHFFFAOYSA-N 317.297 2.978 5 40 DFBB C[C@H]1CC(=O)Nc2ccc([N+](=O)[O-])cc2N1CC(F)(F)F 4004770 PMFBHLWFEFXFMM-ZETCQYMHSA-N 303.240 2.694 5 40 DFBB O=C(COc1cccc([N+](=O)[O-])c1)N1CCc2sccc2C1 21970200 ITNARPHFIBKPQJ-UHFFFAOYSA-N 318.354 2.620 5 40 DFBB O=[N+]([O-])c1ccccc1OCCn1nccc1-c1ccncc1 96007394 ADXDVNHALKUVME-UHFFFAOYSA-N 310.313 2.932 5 40 DFBB O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)c1cc(Cl)ccn1 89421204 OWZIRKRUJLGSKJ-UHFFFAOYSA-N 317.692 2.772 5 40 DFBB Cc1cc(Cc2nc3ccsc3c(=O)[nH]2)ccc1[N+](=O)[O-] 84101499 KCTLVZPQVVGDAL-UHFFFAOYSA-N 301.327 2.792 5 40 DFBB Cc1ccc([C@@H](C)NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 13938174 WSDWLLVCHKXCGR-GFCCVEGCSA-N 320.370 2.943 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)N1CCCc2ccccc21 7954293 XYESOVUMAGDAGI-UHFFFAOYSA-N 311.341 2.986 5 40 DFBB CN(C)C1(CNC(=O)/C=C/c2ccccc2[N+](=O)[O-])CCCC1 47388259 JIXYLTKPLYHYKD-MDZDMXLPSA-N 317.389 2.599 5 40 DFBB CO[C@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1 119833666 INCMXBABFSGAJC-LBPRGKRZSA-N 307.350 2.854 5 40 DFBB O=C(Cc1ccccc1)NC(=S)Nc1ccc([N+](=O)[O-])cc1 4608197 VCSYGLUXJBDWKY-UHFFFAOYSA-N 315.354 2.651 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C2=O)c([N+](=O)[O-])c1 15220025 BVUUQMPZCQAOIE-JLUCKKNBSA-N 312.325 2.605 5 40 DFBB O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)C1CCC1 95350484 ZBMZMTGVVDHYDS-UHFFFAOYSA-N 319.361 2.550 5 40 DFBB O=[N+]([O-])c1ccc(-c2nsc3c(O)nc(S)nc23)cc1 575362685 AMBMETVMIMJLNH-UHFFFAOYSA-N 306.328 2.656 5 40 DFBB O=C1NC(=O)/C(=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)S1 3208659 DHUMWXQIWNPCIX-XYOKQWHBSA-N 315.310 2.709 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 5618206 IOCVTBDTUSMFMC-RYUDHWBXSA-N 304.302 2.509 5 40 DFBB COc1ccccc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 89471627 HLSYYMKVPCTZPR-UHFFFAOYSA-N 312.285 2.732 5 40 DFBB Cc1cccc(C(=O)NCc2nc(C)n3ccccc23)c1[N+](=O)[O-] 89688880 SASVHAVATGQUHW-UHFFFAOYSA-N 324.340 2.789 5 40 DFBB Cc1c(C(=O)N(C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)cccc1[N+](=O)[O-] 245344093 XKBMCULFPFPLRP-NWANDNLSSA-N 318.373 2.789 5 40 DFBB O=C(Nc1c(Cl)ncnc1Cl)c1cccc([N+](=O)[O-])c1 3194760 RESJKNXXHHWVCG-UHFFFAOYSA-N 313.100 2.944 5 40 DFBB CN(Cc1ccsc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N 48315086 CTOKBNBVUITRAC-UHFFFAOYSA-N 309.322 2.650 5 40 DFBB CS(=O)(=O)c1ccc(Nc2ccc(F)cc2)c([N+](=O)[O-])c1 5702566 HDWDWWHAVFVLGE-UHFFFAOYSA-N 310.306 2.881 5 40 DFBB O=[N+]([O-])c1ccc(C2=CSC3=NNC4(CCCC4)NN23)cc1 39307419 HGPWGAMSUCRLCL-UHFFFAOYSA-N 317.374 2.591 5 40 DFBB COC(=O)c1ccccc1N(C)c1nc(Cl)ncc1[N+](=O)[O-] 95080530 QEVYSBDKFUBZPU-UHFFFAOYSA-N 322.708 2.593 5 40 DFBB Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1ccccc1[N+](=O)[O-] 31662141 CUQWFTGYUUQEED-NSHDSACASA-N 315.333 2.527 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)cc1 3382246 NEXNXCIXTFONEC-UHFFFAOYSA-N 320.732 2.943 5 40 DFBB O=C(NCc1ccc(-c2ccc(Cl)cc2)o1)[C@@H]1C[C@H]1[N+](=O)[O-] 32932525 XKRKXCPGEHMFKC-CHWSQXEVSA-N 320.732 2.881 5 40 DFBB Cc1ccc(-c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-] 21275216 AGQHYUCCYUMEFP-UHFFFAOYSA-N 305.359 2.863 5 40 DFBB O=C(Nc1ccccc1O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 33226532 LEJDGBYMELTTFL-UHFFFAOYSA-N 324.296 2.738 5 40 DFBB O=[N+]([O-])c1cnc(N[C@@H]2C[C@H]2c2ccccc2)nc1NC1CC1 71827978 GFUQSWSZTCCBOZ-QWHCGFSZSA-N 311.345 2.927 5 40 DFBB CCOc1cccc(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)c1 95468991 YNBJLGJXXJYBRV-UHFFFAOYSA-N 316.313 2.629 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1 3093876 AJHRKNXUMHRVRE-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB O=S(=O)(O)CCC[n+]1c2ccccc2cc2ccccc21 4521844 SMKBSSHVLHIPLU-UHFFFAOYSA-O 302.375 2.558 5 40 DFBB CC(C)=CC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 7651234 GXNPCHCRBVSWCF-UHFFFAOYSA-N 312.709 2.696 5 40 DFBB CSc1ncccc1C(=O)N(C)Cc1cccc([N+](=O)[O-])c1 24946669 OZHKEHKZLCNEFP-UHFFFAOYSA-N 317.370 2.984 5 40 DFBB O=C(CCn1cnc([N+](=O)[O-])c1)Nc1cccc2c1CCCC2 24431667 ULEIHVXMOXTBEW-UHFFFAOYSA-N 314.345 2.699 5 40 DFBB C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 36093458 AVLGWDQMJOYJQR-SJCJKPOMSA-N 314.341 2.913 5 40 DFBB Cc1c(C(=O)N(C)c2cccnc2N(C)C)cccc1[N+](=O)[O-] 79725732 CVVSHDDRNAGNOV-UHFFFAOYSA-N 314.345 2.641 5 40 DFBB CC(C)CCC(=O)N1CCN(c2sccc2[N+](=O)[O-])CC1 96492798 YLCJHWRNXUWIQL-UHFFFAOYSA-N 311.407 2.741 5 40 DFBB CC(=O)Nc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 5631925 CUTAWTIFSFEAFX-UHFFFAOYSA-N 313.313 2.734 5 40 DFBB O=[N+]([O-])c1ccc([S@](=O)Cc2ccccc2)c([N+](=O)[O-])c1 16923741 LKWVQGBAQZESOK-NRFANRHFSA-N 306.299 2.811 5 40 DFBB Cc1c(F)cccc1NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 1426270 HCXFYHUNLJVIGH-UHFFFAOYSA-N 324.333 2.984 5 40 DFBB O=[N+]([O-])c1cc2c(c(CSc3nncs3)c1)OCOC2 3389515 WBGMOUYNWQBECO-UHFFFAOYSA-N 311.344 2.605 5 40 DFBB O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 12998828 HGADRHXPHVBDFY-CQSZACIVSA-N 320.732 2.712 5 40 DFBB O=[N+]([O-])c1cc(-c2nc(-c3ccncc3)no2)cc([N+](=O)[O-])c1 4694806 GJORNZAMFLOHMQ-UHFFFAOYSA-N 313.229 2.615 5 40 DFBB CCN(CC)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C1 78934550 PGKPVTLGBAHABR-AWEZNQCLSA-N 319.405 2.707 5 40 DFBB CC(C)CSc1nnc2nc3c(nn12)c1ccccc1n3C 35655418 KIFMQHRHAZRPCB-UHFFFAOYSA-N 312.402 2.912 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cccc([N+](=O)[O-])c1 5006802 PRCPMGLVRJHXMT-GQCTYLIASA-N 303.230 2.748 5 40 DFBB Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(C(F)(F)F)c1 33416 ALBUEUZJBISFEL-UHFFFAOYSA-N 314.223 2.599 5 40 DFBB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 4156096 GLNDITBXXHRKJS-XXHBBNRNSA-N 318.716 2.560 5 40 DFBB CCOc1cccc(NCc2nnc3ccccn23)c1[N+](=O)[O-] 96502648 ZBMSNLXDTNTBLV-UHFFFAOYSA-N 313.317 2.648 5 40 DFBB C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1cccs1 10671466 XZPWNDDDFWXLPI-JTQLQIEISA-N 306.343 2.913 5 40 DFBB Cc1nn(Cc2cc(Cl)c3c(c2)OCCO3)c(C)c1[N+](=O)[O-] 8314563 RXQULBIAEOPVON-UHFFFAOYSA-N 323.736 2.881 5 40 DFBB CC(C)Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2O)s1 96012344 PNMGFIPYZQGSCS-UHFFFAOYSA-N 322.346 2.603 5 40 DFBB CCOC(=O)c1cnc(Oc2cccc([N+](=O)[O-])c2)nc1C 95460581 BIHQEUSPXDQLAR-UHFFFAOYSA-N 303.274 2.662 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(NCCn2cnnc2C(C)C)c1 96483048 JYUZJJJFOFXBEU-UHFFFAOYSA-N 323.328 2.570 5 40 DFBB CC[C@@H]1C[N@@+]2(C)CCc3cc(OC)c(OC)cc3[C@@H]2CC1=O 247694116 YQACESCIPWFYQC-XFHNUULXSA-N 304.410 2.747 5 40 DFBB Cc1nn(C)c(NCC2(N(C)C)CCCCCC2)c1[N+](=O)[O-] 47331097 DPAIRJTVDCFGKJ-UHFFFAOYSA-N 309.414 2.703 5 40 DFBB CC[C@@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])N1CCCC1 24796358 RZEMPCYMDGZLFQ-ZDUSSCGKSA-N 305.378 2.507 5 40 DFBB O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1ccc([N+](=O)[O-])cc1 252550154 SBNNMMXSGSEUOV-CFVMTHIKSA-N 304.346 2.813 5 40 DFBB O=C(O)c1cn(-c2ccc([N+](=O)[O-])cc2F)nc1C(F)(F)F 575441581 DXQNCAWAVYNREB-UHFFFAOYSA-N 319.170 2.637 5 40 DFBB Cc1ccc(NC(=O)CSc2[nH]nc(C)c2[N+](=O)[O-])cc1 6382566 ZGZGSBFWLBVYFJ-UHFFFAOYSA-N 306.347 2.666 5 40 DFBB Cc1cccc(C(=O)NCCOc2ccccc2F)c1[N+](=O)[O-] 12759699 AXOKMUKABKEMRR-UHFFFAOYSA-N 318.304 2.851 5 40 DFBB COc1ccc(C)cc1Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 12817671 FVYXAZGIBKOKEL-UHFFFAOYSA-N 314.297 2.868 5 40 DFBB O=c1c2cc(Cl)ccc2nc(-c2ccc([N+](=O)[O-])cc2)n1O 6883679 NXWSVJJVNIFUPP-UHFFFAOYSA-N 317.688 2.862 5 40 DFBB Cc1[nH]nc(C(=O)N(Cc2ccccc2)CC(F)F)c1[N+](=O)[O-] 76068119 BAKXPRHTHGWCKA-UHFFFAOYSA-N 324.287 2.534 5 40 DFBB CCOc1cccc(N2CCC(NC(C)C)CC2)c1[N+](=O)[O-] 96503059 HGRFYPRUOLTFPJ-UHFFFAOYSA-N 307.394 2.960 5 40 DFBB Cc1ccc(C)c(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 1728602 ZHGPEJSJVGXUJI-UHFFFAOYSA-N 307.327 2.979 5 40 DFBB Cc1ccc([C@H](N)c2n[nH]c(-c3ccc([N+](=O)[O-])cc3)n2)cc1 95534094 KPBQEOHRVCJOKY-AWEZNQCLSA-N 309.329 2.736 5 40 DFBB Cc1c(C(=O)Nc2ccc(CC(=O)O)cc2)cccc1[N+](=O)[O-] 13439876 AXDNWNJNDQVUOL-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C)n(C)c1C 8051857 GMLUPIZIEFAROM-UHFFFAOYSA-N 303.318 2.811 5 40 DFBB CC(=O)c1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 3128521 PMTUROBMHBTNSO-UHFFFAOYSA-N 320.326 2.598 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1ccccc1 4017518 SACNOGLALHVOHR-UHFFFAOYSA-N 317.257 2.521 5 40 DFBB Cc1nnc(SCC(=O)c2cc([N+](=O)[O-])ccc2Cl)o1 7342105 XUIYRGPYYYTKAX-UHFFFAOYSA-N 313.722 2.915 5 40 DFBB CCCCNC(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408527824 CRGQQFICWNDGPY-UHFFFAOYSA-N 300.318 2.582 5 40 DFBB Cc1cc(C(=O)n2cc(C(N)=O)c3ccccc32)ccc1[N+](=O)[O-] 216960768 NFVWZIAQRHOXPP-UHFFFAOYSA-N 323.308 2.645 5 40 DFBB N=C1NC(=O)/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1 975886 ZTDVAFBPHUYMFS-KPKJPENVSA-N 315.310 2.993 5 40 DFBB Nc1ncc([N+](=O)[O-])c(Sc2nc3ccccc3s2)n1 5446387 DPEVHWGSEVAVEL-UHFFFAOYSA-N 305.344 2.728 5 40 DFBB O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CC1 7848800 YQBXWHJUCBIAIF-UHFFFAOYSA-N 317.267 2.694 5 40 DFBB Cc1cc(NC[C@@H]2CCOC2)nc(-c2cccc([N+](=O)[O-])c2)n1 58208891 VDMAJCVKKIGMRM-LBPRGKRZSA-N 314.345 2.809 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1[N+](=O)[O-] 4544112 JCHMZDDAJRZHNK-UHFFFAOYSA-N 317.257 2.521 5 40 DFBB COc1cc(O)c2c(=O)oc3c(O)c(OC)cc(C)c3c2c1 14761028 SMKUDZVEVLDBSV-UHFFFAOYSA-N 302.282 2.683 5 40 DFBB biogenic CCn1cc(CN(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cn1 83173210 YTPFYENKILUQCY-UHFFFAOYSA-N 315.333 2.584 5 40 DFBB COc1ncccc1N(C)C(=O)CCc1cccc([N+](=O)[O-])c1 87317913 IATWYXRJJBQQNJ-UHFFFAOYSA-N 315.329 2.594 5 40 DFBB Cc1ccc(C(N)=O)cc1Oc1nc2sccn2c1[N+](=O)[O-] 69533449 YTMQWAOPLGRWEE-UHFFFAOYSA-N 318.314 2.504 5 40 DFBB CS(=O)(=O)c1ccc(OCc2cccc([N+](=O)[O-])c2)cc1 57652111 SBUGWQWMNCFPBJ-UHFFFAOYSA-N 307.327 2.577 5 40 DFBB Cc1nnc(SCC(=O)c2cc([N+](=O)[O-])ccc2Cl)[nH]1 7342106 UMBAUYWIGULVQD-UHFFFAOYSA-N 312.738 2.650 5 40 DFBB COCc1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 25334990 RSFYJUGWAICPNM-UHFFFAOYSA-N 300.314 2.922 5 40 DFBB CSc1ccc(C(=O)O[C@@H]2CCCCC2=O)cc1[N+](=O)[O-] 5425710 HJZBZUPHLFOYNG-GFCCVEGCSA-N 309.343 2.985 5 40 DFBB C[C@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)Nc1nccs1 4999355 YOOJVNQYTXCBDT-ZETCQYMHSA-N 310.360 2.566 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[C@H](O)c2ccco2)c1 95445498 QQGDAVZVTHROEF-FZMZJTMJSA-N 318.329 2.738 5 40 DFBB C[C@H]1C[C@@H](C)CN(c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 227156622 KBRICLGMIFKYHM-DTORHVGOSA-N 324.293 2.894 5 40 DFBB COC(=O)c1ccc([N+](=O)[O-])c(N(C)Cc2c(C)noc2C)c1 96501022 CBQSQHFWPRKGJA-UHFFFAOYSA-N 319.317 2.623 5 40 DFBB O=c1c2ccccc2ncn1-c1ccc([N+](=O)[O-])cc1Cl 341540 MRSRSAHZGHNFEM-UHFFFAOYSA-N 301.689 2.947 5 40 DFBB O=C(COC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(F)c1 3505270 WPTJHWUTZKFJBB-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cc1ccc([N+](=O)[O-])c(OCc2cc(=O)n3ccsc3n2)c1 21615027 ZROSJHNASQNGSE-UHFFFAOYSA-N 317.326 2.552 5 40 DFBB O=C(NCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 177051990 SJXCTWRPHJDBEV-UHFFFAOYSA-N 300.314 2.541 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCCCNC(=O)c1ccccc1 70040648 ZUTBBLPMHBBEKK-UHFFFAOYSA-N 314.345 2.530 5 40 DFBB Cc1ccc(CNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 7378190 ZXSYGBGZVGEWHC-UHFFFAOYSA-N 320.370 2.690 5 40 DFBB CC(=O)NC(=O)c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 85346807 XWTBJGIOYBSROK-UHFFFAOYSA-N 308.677 2.785 5 40 DFBB CCCC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 6592621 UYHNUIVBEBMVIP-UHFFFAOYSA-N 311.769 2.697 5 40 DFBB Cc1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1 2328076 ZEIFRZVPSYBDGV-UHFFFAOYSA-N 318.332 2.860 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC(OC3CCOCC3)CC2)cc1 77227073 CDAYNSUHADOPNK-UHFFFAOYSA-N 306.362 2.759 5 40 DFBB Cc1cc(C(=O)NCCOc2ccccc2)ccc1[N+](=O)[O-] 16009535 UFNFCILFOVWZMH-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB CC(=O)N1N=C(c2ccc(C)c([N+](=O)[O-])c2)OC12CCCC2 209024 PYPIERDNOBOELS-UHFFFAOYSA-N 303.318 2.714 5 40 DFBB CS(=O)(=O)c1ccc(N(CC2CC2)CC2CC2)c([N+](=O)[O-])c1 69977448 PGJUUPWOMAKQCC-UHFFFAOYSA-N 324.402 2.625 5 40 DFBB O=c1c([N+](=O)[O-])cc(Cl)cn1CCc1ccc2c(c1)CCO2 95981536 ZRHSANJRULQFPJ-UHFFFAOYSA-N 320.732 2.588 5 40 DFBB Cn1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(=O)c2ccccc21 41056955 JYRKDKPJUOLTKA-UHFFFAOYSA-N 323.308 2.699 5 40 DFBB N[C@H](Cc1ccccc1)c1n[nH]c(-c2ccc([N+](=O)[O-])cc2)n1 95534843 NOLNVMURYDUXPU-CQSZACIVSA-N 309.329 2.622 5 40 DFBB C[C@H]1C[C@@H](C)CN(CCCNC(=O)c2cccc([N+](=O)[O-])c2)C1 13673835 FUGLVOLTNUAYMU-OKILXGFUSA-N 319.405 2.693 5 40 DFBB Cc1csc(N(C(=O)c2cccc([N+](=O)[O-])c2N)C2CC2)n1 89705713 YXXVHXZUPXCJIS-UHFFFAOYSA-N 318.358 2.751 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cnn2cccnc12 12844905 IRWVQOVWKOIYPE-UHFFFAOYSA-N 317.692 2.543 5 40 DFBB C[C@@H](Oc1ccccc1[N+](=O)[O-])C(=O)NCc1cccs1 8072875 FHDGZAZMQQTRPD-SNVBAGLBSA-N 306.343 2.740 5 40 DFBB COc1cc(Nc2ncccc2[N+](=O)[O-])cc(OC)c1OC 7185696 CZHMLUCJGLFRTI-UHFFFAOYSA-N 305.290 2.759 5 40 DFBB CC(C)(CCO)CNc1ncc(Br)cc1[N+](=O)[O-] 96474589 NTOXNUIUEWLJQT-UHFFFAOYSA-N 318.171 2.573 5 40 DFBB O=C(O)CCCCCNc1ccc2nsnc2c1[N+](=O)[O-] 4110504 OGKMCGKXYXLFMO-UHFFFAOYSA-N 310.335 2.656 5 40 DFBB Cc1cccc(C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1[N+](=O)[O-] 95427625 URRYDCFIYMWOKF-LBPRGKRZSA-N 314.341 2.970 5 40 DFBB Cc1ccc([C@H](C)OC(=O)c2ccc(=O)n(C)c2)cc1[N+](=O)[O-] 84808260 GSSYROPWCZBMRG-NSHDSACASA-N 316.313 2.520 5 40 DFBB CC(C)(CCO)CNc1ncc([N+](=O)[O-])cc1Br 96452891 XCPWEENXQKJHBV-UHFFFAOYSA-N 318.171 2.573 5 40 DFBB O=C(Nc1ccccc1F)c1cccc([N+](=O)[O-])c1C(=O)O 33262 KSNCLEDXWGDCGX-UHFFFAOYSA-N 304.233 2.684 5 40 DFBB CC(C)c1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)n1 97162489 LONFPARWRRBSHC-UHFFFAOYSA-N 309.713 2.742 5 40 DFBB Cn1c(Sc2ccc([N+](=O)[O-])cn2)nnc1-c1ccccc1 22474504 ZAWFTDMOVPBXLA-UHFFFAOYSA-N 313.342 2.937 5 40 DFBB C[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 18207490 VRXOXICTLIABFM-LBPRGKRZSA-N 317.389 2.726 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H](CO)C1 8177857 WLCRIHGFLMUGQV-SECBINFHSA-N 304.268 2.822 5 40 DFBB O=[N+]([O-])c1ccccc1CN1CCC(OC2CCOCC2)CC1 72292470 GQSNNIZNZLIXID-UHFFFAOYSA-N 320.389 2.755 5 40 DFBB Cc1cccc(N2CCOC3(CCOCC3)CC2)c1[N+](=O)[O-] 225460202 NJIBPVVXWREARE-UHFFFAOYSA-N 306.362 2.679 5 40 DFBB Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] 96455223 WQTTWOBBWMPPHC-LNSITVRQSA-N 321.377 2.567 5 40 DFBB O=[N+]([O-])c1cc2c(cc1/C=C1/SC(=S)N=C1O)OCO2 2536909 UEWFSZGHGXQRQB-XNWCZRBMSA-N 310.312 2.653 5 40 DFBB O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCSC1=S 4743735 OMAQCCSUVURYEI-UHFFFAOYSA-N 302.764 2.722 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc([N+](=O)[O-])cc1 1722437 QXCIQSNKZUAHQI-UHFFFAOYSA-N 300.270 2.857 5 40 DFBB Cc1cc(=O)oc(C)c1C(=O)OCc1ccc([N+](=O)[O-])cc1 555860 RMHVSKYPORZDDO-UHFFFAOYSA-N 303.270 2.522 5 40 DFBB Cc1ccc(C)c(N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c1 20405595 SISRCJJMJBGMIL-UHFFFAOYSA-N 312.373 2.933 5 40 DFBB O=C1Nc2ccccc2/C1=C/c1cc2c(cc1[N+](=O)[O-])OCO2 3239448 NHKKXDBIHWFZCK-WZUFQYTHSA-N 310.265 2.816 5 40 DFBB COc1ccc(Sc2nnc(C(F)F)[nH]2)c([N+](=O)[O-])c1 216904026 WQXUVMSKUYLNKR-UHFFFAOYSA-N 302.262 2.810 5 40 DFBB Cc1ccc(C(=O)Nc2ccc(CC(=O)O)cc2)cc1[N+](=O)[O-] 13438860 OHAOBLUFBAPZTF-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB COc1ccc([C@@H]2CCCN2c2c([N+](=O)[O-])ncn2C)cc1 58304063 TZGXYVRKHHRRIQ-ZDUSSCGKSA-N 302.334 2.678 5 40 DFBB O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2ccccc2)CC1 3361842 IAVXMQOSVVIPEA-UHFFFAOYSA-N 317.370 2.619 5 40 DFBB O=[N+]([O-])c1ccc(CNC[C@@H]2COc3ccccc3O2)cc1 36062138 ZVFMCHZKQINZFX-CQSZACIVSA-N 300.314 2.524 5 40 DFBB CC(C)(C)c1n[nH]cc1CNCCc1ccc([N+](=O)[O-])cc1 78552897 FZQKJMBZMYCHKG-UHFFFAOYSA-N 302.378 2.948 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](CCC(N)=O)C1 97233696 QSEVNJDWCBMFIJ-ZIAGYGMSSA-N 319.405 2.942 5 40 DFBB CC(=O)NC(=S)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 14257684 KAULNZHLPMIJQM-UHFFFAOYSA-N 322.371 2.551 5 40 DFBB CC(C)(C)C(=O)N1CCC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 32816253 TWEKDWIHJPZCJU-ZDUSSCGKSA-N 319.361 2.570 5 40 DFBB Cc1cncc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)c1 97096008 NFTRFTXUEDERCX-UHFFFAOYSA-N 300.318 2.928 5 40 DFBB CCc1cc(NC(=O)c2cocn2)c2cc([N+](=O)[O-])ccc2n1 97142380 MWMBUYKXYLVFRC-UHFFFAOYSA-N 312.285 2.946 5 40 DFBB COc1cc(C(=O)NCc2cccc(C)n2)cc([N+](=O)[O-])c1C 189050823 WYDCVARGKCLRSR-UHFFFAOYSA-N 315.329 2.545 5 40 DFBB Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CC(=O)N(C2CC2)C1 225545261 FRWKLUWCIWBZPR-JTQLQIEISA-N 323.780 2.979 5 40 DFBB O=C(c1ncccc1O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 133775345 XUNIPEUIVUDBFP-UHFFFAOYSA-N 313.313 2.500 5 40 DFBB O=C1Oc2ccccc2/C1=C/c1cc2c(cc1[N+](=O)[O-])OCO2 1653846 HTDKGRAYYHTUGI-WZUFQYTHSA-N 311.249 2.783 5 40 DFBB COC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 3137667 KZOVYEJYLVWSFQ-UHFFFAOYSA-N 300.270 2.634 5 40 DFBB Cc1ccc(NC(=O)NC[C@H](O)c2ccccc2)cc1[N+](=O)[O-] 69369225 YXQQSMMFUDMKKK-HNNXBMFYSA-N 315.329 2.758 5 40 DFBB O=[N+]([O-])c1c(F)cccc1N1CCCN(CC(F)(F)F)CC1 69414072 QXCFIXWMKALOLE-UHFFFAOYSA-N 321.274 2.808 5 40 DFBB Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2c(F)cccc2C1 97050724 RMPPNDVVTRGFHJ-UHFFFAOYSA-N 315.304 2.515 5 40 DFBB Cc1cc(N[C@H](Cn2cncn2)c2ccccc2)ncc1[N+](=O)[O-] 74765902 FWJXOEDJXAACJG-CQSZACIVSA-N 324.344 2.743 5 40 DFBB CN(C)c1ccccc1N(C)C(=O)c1cc([N+](=O)[O-])ccc1O 195555963 ASFDRBAXULNVBG-UHFFFAOYSA-N 315.329 2.643 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCO2 59011810 PMAIBJZZRDGHQB-UHFFFAOYSA-N 317.272 2.931 5 40 DFBB CC1(C)[C@]2(C(=O)Nc3cccc([N+](=O)[O-])c3)CC[C@@]1(C)C(=O)O2 2881870 HFAXFXXFEHQVNB-JKSUJKDBSA-N 318.329 2.655 5 40 DFBB Cc1ccc(CNCc2nnc3n2CCCCC3)cc1[N+](=O)[O-] 61015503 FTZGDMSKFLLPES-UHFFFAOYSA-N 315.377 2.511 5 40 DFBB CS(=O)(=O)c1ccc(N(CC2CC2)CC2CC2)cc1[N+](=O)[O-] 69929360 OILCWTLBEDKVMI-UHFFFAOYSA-N 324.402 2.625 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCCSC1CCCC1 46450331 RAMABUFZMFCTFF-UHFFFAOYSA-N 308.403 2.929 5 40 DFBB COc1ccc2ccccc2c1[C@H]1NC(=O)NC(C)=C1[N+](=O)[O-] 358536 QEGNZDLOMNXGNP-CQSZACIVSA-N 313.313 2.711 5 40 DFBB O=C(COC(=O)c1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1 1918922 ZHQXVIWIEJPYQQ-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB CCOC(=O)c1ccccc1C(=O)c1ccc([N+](=O)[O-])c(N)c1 4550740 OOIJITYBWVFMQK-UHFFFAOYSA-N 314.297 2.585 5 40 DFBB O=C(O)c1ccc(C[S@@](=O)c2ccccc2)c([N+](=O)[O-])c1 4641481 OLUMHCPDVGQCAR-NRFANRHFSA-N 305.311 2.601 5 40 DFBB Cc1ccc(C(=O)O)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] 8051559 DTSOQWONMZBWGJ-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB O=c1nc2n(-c3ccccc3)c3cc(Cl)ccc3cc-2c(=O)[nH]1 554418 KUZXWHQMNCGRQX-UHFFFAOYSA-N 323.739 2.832 5 40 DFBB C[C@H]1CCC[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3195322 JUCIBDRBUQHWIF-UWVGGRQHSA-N 307.306 2.906 5 40 DFBB CCOc1ccc(C(=O)O[C@H]2CCCCC2=O)cc1[N+](=O)[O-] 8262429 XRFPFILGJBMJDS-AWEZNQCLSA-N 307.302 2.662 5 40 DFBB COc1ncccc1N(C)C(=O)c1cc(F)c([N+](=O)[O-])cc1F 97141657 WPUQPJAHQYBVAK-UHFFFAOYSA-N 323.255 2.553 5 40 DFBB CCN1C(=O)S/C(=C/c2ccc(OC)c([N+](=O)[O-])c2)C1=O 409108802 WCKZRTBKKQYDMR-YRNVUSSQSA-N 308.315 2.660 5 40 DFBB O=C1c2ccc([N+](=O)[O-])cc2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-] 102129918 JMJOTFMLQNWDEW-UHFFFAOYSA-N 315.197 2.623 5 40 DFBB COc1ccc([C@H](O)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 226292279 YRNNNJUXFSXYTE-MRXNPFEDSA-N 319.313 2.702 5 40 DFBB COc1cc(N[C@@H]2c3ccccc3C[C@@H]2O)ccc1[N+](=O)[O-] 91431130 FHLWTFBHXFKVKT-GOEBONIOSA-N 300.314 2.674 5 40 DFBB CCc1ccc(C(=O)O[C@H](C)c2nnc(C)o2)cc1[N+](=O)[O-] 96446381 BZYHEJLQIUMCDG-MRVPVSSYSA-N 305.290 2.767 5 40 DFBB COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cccc(C)c1 48367304 PEFOVGUQFXJGGA-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB CCN(CC)c1nc(N)c([N+](=O)[O-])c(Nc2ccccc2)n1 6392179 MXKWQXVZESRZQP-UHFFFAOYSA-N 302.338 2.557 5 40 DFBB Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])cc(C(=O)O)c1O 20140796 HIDFFTYWTOGOMO-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB Cc1cc(NC(=O)NC[C@H]2CCC[C@H](O)C2)ccc1[N+](=O)[O-] 97163048 GPYIVWYKEJSLCJ-AAEUAGOBSA-N 307.350 2.576 5 40 DFBB CN(Cc1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 38754256 FFVJURKHGXUKGL-UHFFFAOYSA-N 320.370 2.557 5 40 DFBB CC[C@]1(C)COCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 390833639 KRTIBDKVMGOFGI-CQSZACIVSA-N 312.753 2.889 5 40 DFBB O=c1c(Br)cccn1Cc1ccc([N+](=O)[O-])cc1 97910642 XRMLIOXVQLPOLO-UHFFFAOYSA-N 309.119 2.567 5 40 DFBB Cc1c(C(=O)NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-] 13166251 DCEXMPVTHHNHCX-UHFFFAOYSA-N 314.297 2.531 5 40 DFBB O=[N+]([O-])c1cc(Oc2ccc(F)cc2)cc(-n2cnnn2)c1 12374640 AASJQEPHBXJBIU-UHFFFAOYSA-N 301.237 2.502 5 40 DFBB CC(C)CCNc1nc(N)c([N+](=O)[O-])c(N2CCCCCC2)n1 5219678 XACMCRDOIWGKAT-UHFFFAOYSA-N 322.413 2.805 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)C[C@@H](C)C1 6409732 IDHCWKFTMSJFPY-TXEJJXNPSA-N 321.377 2.520 5 40 DFBB O=c1cc(C2CCC2)ncn1Cc1ccc([N+](=O)[O-])c(F)c1 188328338 WGIQCOYKMHMPHE-UHFFFAOYSA-N 303.293 2.606 5 40 DFBB Cc1cc(C(=O)N2CCC[C@H](N3CCCC3)C2)ccc1[N+](=O)[O-] 69872421 UNZSEMKCZXDZKH-HNNXBMFYSA-N 317.389 2.604 5 40 DFBB CNc1ccc([N+](=O)[O-])cc1-c1nc2ccccc2n(C)c1=O 3897865 PYOIQVYZIJPFFN-UHFFFAOYSA-N 310.313 2.550 5 40 DFBB Cc1ccccc1O[C@H](Cc1cccc([N+](=O)[O-])c1)C(=O)O 225125010 NOUCTKXNAJCALZ-OAHLLOKOSA-N 301.298 2.978 5 40 DFBB CCN(CC(=O)NCCC(C)C)Cc1ccccc1[N+](=O)[O-] 40087772 NRWNLLXJAOPUSI-UHFFFAOYSA-N 307.394 2.579 5 40 DFBB O=C(OCC(=O)c1ccc[nH]1)c1ccc(Cl)c([N+](=O)[O-])c1 13987241 GUGFPOLXHOYSTL-UHFFFAOYSA-N 308.677 2.616 5 40 DFBB Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)cc1Cl 193321 UNJGUDQGJDRNOO-UHFFFAOYSA-N 315.116 2.887 5 40 DFBB O=C(NCCc1ccc(O)cc1)Nc1ccc([N+](=O)[O-])cc1 54040830 KCGYCDCFDJIFMX-UHFFFAOYSA-N 301.302 2.665 5 40 DFBB O=C(Nc1nonc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 8869479 QRDXACKSZMYOAM-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB Nc1ccc(C(=O)NCC2(c3ccccc3)CC2)cc1[N+](=O)[O-] 11749933 FUWUUIQRIBAYRD-UHFFFAOYSA-N 311.341 2.639 5 40 DFBB CC(=O)c1ccc(Sc2ncnc3nc[nH]c23)c([N+](=O)[O-])c1 12249786 BRICJJRUWHOVBA-UHFFFAOYSA-N 315.314 2.615 5 40 DFBB O=[N+]([O-])c1cn(Cc2nc(-c3cccc(Cl)c3)no2)cn1 25451725 UZVNGEHKISBEMI-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB Cc1cc(C(=O)N(C[C@@H]2CCOC2)C2CC2)ccc1[N+](=O)[O-] 58393232 RMDDQUKAGDNTNR-LBPRGKRZSA-N 304.346 2.544 5 40 DFBB Cc1[nH]nc(C(=O)NC2(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] 77164334 ZXXXNVRRWCNQCJ-UHFFFAOYSA-N 320.736 2.699 5 40 DFBB Cc1cc(C(=O)O)ccc1NC(=O)Cc1ccccc1[N+](=O)[O-] 319928570 AUYXZSXEZQFBRN-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB C[C@H](OC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 5721772 PPTUBSSINJWZBK-LEWSCRJBSA-N 319.313 2.866 5 40 DFBB CN(C)C(=O)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 5811611 AAJKEAZZFRWDRU-UHFFFAOYSA-N 322.199 2.615 5 40 DFBB Cc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2C=O)cc1 4244710 PFNLZGOMWJVBHN-UHFFFAOYSA-N 320.326 2.517 5 40 DFBB C[C@@H]1CCCC[C@@H]1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 12739509 VOBDOXZUMVOMEG-DOMZBBRYSA-N 320.393 2.885 5 40 DFBB CSc1ccc(C(=O)OCC(=O)c2ccc[nH]2)cc1[N+](=O)[O-] 6848886 GVACFZKITGPDAW-UHFFFAOYSA-N 320.326 2.685 5 40 DFBB O=C(Cc1ccccc1F)N1CCc2ccc([N+](=O)[O-])cc21 8762414 QPTHFRIQLBSTST-UHFFFAOYSA-N 300.289 2.866 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@H](C(=O)NC(C)C)C1 75140095 VOKBGCSVUFIDLX-QWHCGFSZSA-N 320.393 2.794 5 40 DFBB Cc1ccc(NCCN)c2c(=O)c3cc(O)ccc3sc12 5392816 ZJKOCQVEIATSEP-UHFFFAOYSA-N 300.383 2.799 5 40 DFBB CC[C@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])N1CCCC1 24796366 RZEMPCYMDGZLFQ-CYBMUJFWSA-N 305.378 2.507 5 40 DFBB CN(C)C1(CNC(=O)c2cccc([N+](=O)[O-])c2)CCCCC1 10446655 VPFORBXFKGRFJU-UHFFFAOYSA-N 305.378 2.589 5 40 DFBB C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1F 18014935 JDVZWLNVPMJGBV-QMMMGPOBSA-N 321.283 2.946 5 40 DFBB O=C1NC(S)=N/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 71237 FRHFXSMLBDTBLY-YRNVUSSQSA-N 315.310 2.611 5 40 DFBB O=C(C[C@@H](C(=O)O)[C@@H](c1ccccc1)[N+](=O)[O-])c1ccccc1 1687173 OXISQRBRNJKOGQ-GDBMZVCRSA-N 313.309 2.978 5 40 DFBB Cc1cccc(C(=O)NCc2ccc3c(c2)OCO3)c1[N+](=O)[O-] 2729816 AQOUCFZLZBDRFU-UHFFFAOYSA-N 314.297 2.562 5 40 DFBB C[C@@H]1Cc2ccccc2N1C(=O)COc1ccccc1[N+](=O)[O-] 5109408 FVUXZLFEACEBHL-GFCCVEGCSA-N 312.325 2.951 5 40 DFBB O=C(Nc1ccc(F)cc1[N+](=O)[O-])c1cccc2c1OCO2 72274403 FUFVOHIOUFTLAO-UHFFFAOYSA-N 304.233 2.715 5 40 DFBB Cc1cc([C@@](C)(O)CNc2ncc([N+](=O)[O-])cc2C)c(C)o1 76063273 FJUCQIZJPHYNQE-HNNXBMFYSA-N 305.334 2.828 5 40 DFBB CS[C@H](CO)[C@H](C)Nc1ccc2ncccc2c1[N+](=O)[O-] 96417308 HTRRIWDAJOAPLP-TVQRCGJNSA-N 307.375 2.667 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCn1ccnc1 97380035 JBFMFCGLDCCBQK-UHFFFAOYSA-N 317.349 2.620 5 40 DFBB C[C@@H]1CCN(C(=O)CCn2cnc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]21 32561675 HQSAKDAJSYPHDI-RDBSUJKOSA-N 320.393 2.609 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)OCc1ccccc1[N+](=O)[O-] 6591907 OSKHKKPPBIBSAC-UHFFFAOYSA-N 316.269 2.789 5 40 DFBB Cc1nnc(Sc2ccc([N+](=O)[O-])c3cccnc23)n1C 59402666 RSICDKWAJFJAQC-UHFFFAOYSA-N 301.331 2.731 5 40 DFBB O=C1c2ccc(F)cc2C(=O)N1Cc1csc([N+](=O)[O-])c1 96452645 SERDQJDNFSSBFC-UHFFFAOYSA-N 306.274 2.592 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@H]2OCCC[C@@H]2C1 97095521 PUOZPFAOJNSRAO-BXUZGUMPSA-N 324.764 2.889 5 40 DFBB O=C(CCc1ccc2c(c1)OCO2)Nc1cccc([N+](=O)[O-])c1 12459898 MMDQVMQDOWGPDH-UHFFFAOYSA-N 314.297 2.895 5 40 DFBB Cc1nn(Cc2nc(-c3ccc(F)cc3)no2)c(C)c1[N+](=O)[O-] 6560044 DXVKPKAEFFUZAI-UHFFFAOYSA-N 317.280 2.646 5 40 DFBB O=c1ccn(Cc2ccc(Br)s2)cc1[N+](=O)[O-] 96468026 YSIHCNXJKUKGLI-UHFFFAOYSA-N 315.148 2.629 5 40 DFBB COc1cc(/C=C2\C(=O)Nc3ccccc32)cc([N+](=O)[O-])c1O 36624101 WPHSCZAUPDUDQR-WDZFZDKYSA-N 312.281 2.802 5 40 DFBB COc1cccc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 8050309 GOIMFKXWRWGUNB-UHFFFAOYSA-N 313.357 2.930 5 40 DFBB COc1cc(C(=O)Nc2ccccc2OC)cc([N+](=O)[O-])c1 8751877 IHVFSIKOHHANMS-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB COc1c2c(cc3c1[C@H](C[C@H](O)C(C)C)[N+](C)(C)CC3)OCO2 486950 YEKBHHKHHZVRNL-KBPBESRZSA-N 322.425 2.505 5 40 DFBB biogenic COc1ccc([C@H]2CCCN2c2c([N+](=O)[O-])ncn2C)cc1 58304062 TZGXYVRKHHRRIQ-CYBMUJFWSA-N 302.334 2.678 5 40 DFBB Cc1ccc2nc(CNc3cc([N+](=O)[O-])ccc3C)cc(=O)n2c1 15288995 TTZVKCYSIKHNFY-UHFFFAOYSA-N 324.340 2.832 5 40 DFBB CC(=O)c1ccc(Nc2cnn(-c3ncccn3)c2)c([N+](=O)[O-])c1 72291274 GOLKKYJSYWNNBM-UHFFFAOYSA-N 324.300 2.517 5 40 DFBB COCc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1O 89541085 BNKPRHPDLDUUGK-UHFFFAOYSA-N 302.286 2.699 5 40 DFBB O=C(NCc1nc(-c2ccccc2)no1)c1cccc([N+](=O)[O-])c1 33539934 FAYPYZRFKMZVMY-UHFFFAOYSA-N 324.296 2.575 5 40 DFBB Cc1nnc(SCC(=O)c2cc([N+](=O)[O-])cs2)s1 12139004 ADQCNIHJYQJCJL-UHFFFAOYSA-N 301.374 2.791 5 40 DFBB O=C(O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 15443076 LUJIWJDGWCJVKC-MRVPVSSYSA-N 318.251 2.915 5 40 DFBB Cc1cccc([N+](=O)[O-])c1N1CCC(C2(C)OCCO2)CC1 95970992 TWPRKGNIVXVZPL-UHFFFAOYSA-N 306.362 2.883 5 40 DFBB CCC[C@H](C)NC(=O)CN(CC)Cc1ccccc1[N+](=O)[O-] 40087769 LFIPUFPNJHSIBQ-ZDUSSCGKSA-N 307.394 2.722 5 40 DFBB Cc1ccc(C2=NN[C@@H]3CC(C)(C)CC(=O)[C@H]23)cc1[N+](=O)[O-] 228922857 ZEORXFZIUKHHGJ-BXUZGUMPSA-N 301.346 2.584 5 40 DFBB CC[N+](C)(C)C[C@@H]1C(=O)O[C@@]23[C@H](CC[C@@]4(C)O[C@H]42)[C@H](C)CC[C@H]13 9329325 BGJJAOTZPPPJJJ-IADIPTBJSA-N 322.469 2.608 5 40 DFBB Cc1ccc(C(=O)NCCOc2ccc(F)cc2)cc1[N+](=O)[O-] 22479881 OVNWVKDETUTDBT-UHFFFAOYSA-N 318.304 2.851 5 40 DFBB CCOc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 13669748 GNIYNRVVQLQVPP-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB NC(=O)c1ccccc1OCc1ccc([N+](=O)[O-])cc1Cl 97082306 RZNGLCHLWOIEHC-UHFFFAOYSA-N 306.705 2.926 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)Cc1ccccc1F 40511081 JYBIGJNHSQWINP-UHFFFAOYSA-N 302.305 2.935 5 40 DFBB CCn1ncc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1C 372999 JPVOGKMIILNERV-UHFFFAOYSA-N 322.752 2.703 5 40 DFBB O=[N+]([O-])c1cccnc1NCC1(N2CCSCC2)CCCC1 29622793 YYIACIPJLXKJFN-UHFFFAOYSA-N 322.434 2.763 5 40 DFBB CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C1CCOCC1 72307197 VEMRMXKBDUPANS-CQSZACIVSA-N 310.325 2.669 5 40 DFBB CNc1nc(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])cs1 72301717 ISLWZCUDRZYSEY-UHFFFAOYSA-N 306.347 2.908 5 40 DFBB CC[C@@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 521396432 XAPUTBGLUFIEMU-MRVPVSSYSA-N 315.167 2.815 5 40 DFBB O=C(Cn1ccc(=O)c2ccccc21)Nc1cccc([N+](=O)[O-])c1 225719874 LXFIXQHKUDFXLY-UHFFFAOYSA-N 323.308 2.548 5 40 DFBB O=[N+]([O-])c1ccc(OC[C@@H](O)COc2ccccc2)c(F)c1 95439058 QJQNAIAKGBKXJD-LBPRGKRZSA-N 307.277 2.553 5 40 DFBB COc1ccc2oc(=O)c3ccc(OC)c(OC(C)=O)c3c2c1 1721294 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2.532 5 40 DFBB CN[C@@H](C(=O)c1ccccc1)[C@H](OC)c1cccc([N+](=O)[O-])c1 57256230 XRTRVAKJWCIIMD-DOTOQJQBSA-N 314.341 2.753 5 40 DFBB Cc1cc(C(=O)OCC(=O)Nc2ccccc2)ccc1[N+](=O)[O-] 1934338 KBSVNTNSACZBID-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB C[C@H](COc1cccc(F)c1)NC(=O)c1ccccc1[N+](=O)[O-] 58179528 CPHHCINZNCHYAV-LLVKDONJSA-N 318.304 2.931 5 40 DFBB C[C@@H](Sc1ccc([N+](=O)[O-])cn1)C(=O)Nc1nccs1 4999356 YOOJVNQYTXCBDT-SSDOTTSWSA-N 310.360 2.566 5 40 DFBB CCc1cc(CNc2cc(C)c([N+](=O)[O-])c(C(=O)OC)c2)on1 95416544 HTYFFYBNHJYOFF-UHFFFAOYSA-N 319.317 2.852 5 40 DFBB C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccc([N+](=O)[O-])o1 95979587 ADQSGHLTEKUJQJ-QMMMGPOBSA-N 308.315 2.641 5 40 DFBB CC(=O)Oc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 4014150 SRSZKFRERMDYIL-UHFFFAOYSA-N 300.270 2.772 5 40 DFBB CC(=O)c1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 6061670 XPMFNXHIYYCLDK-UHFFFAOYSA-N 314.297 2.815 5 40 DFBB COc1ccc(NC(=O)CC(=O)c2ccc([N+](=O)[O-])cc2)cc1 3147800 BISJVMLUVPLYLN-UHFFFAOYSA-N 314.297 2.815 5 40 DFBB 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CN(C)c1ncnc2c1N=Cc1cc([N+](=O)[O-])ccc1S2 12388832 CKVQLJNMNIPAHP-UHFFFAOYSA-N 301.331 2.666 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCC(=O)NC1CCCCCC1 25906737 MBRVGGXNNUWUNY-UHFFFAOYSA-N 321.377 2.854 5 40 DFBB C[C@H]1CCCC[C@H]1NC(=O)NCCNc1ccccc1[N+](=O)[O-] 12642051 SSXCYYNRGIPZMF-QWHCGFSZSA-N 320.393 2.885 5 40 DFBB CC[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc([N+](=O)[O-])c1 110665622 WJLBFADXPRTZLG-KBUPBQIOSA-N 304.346 2.730 5 40 DFBB Cc1nnc(Sc2c(Cl)cc(C(=O)O)cc2[N+](=O)[O-])[nH]1 70462482 KOIDOVUWHNPTNK-UHFFFAOYSA-N 314.710 2.524 5 40 DFBB O=C(c1cccc(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 9028631 JGGOWUULONNLLW-UHFFFAOYSA-N 303.245 2.736 5 40 DFBB CN1C(=O)[C@@]2(CCN[C@@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc21 27046929 HXHRRCNUZRAENO-AEFFLSMTSA-N 323.352 2.544 5 40 DFBB Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2)cccc1C(=O)O 20140838 AITUNZSUASLPGR-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB CCn1nc(C)c(CN2CCc3ccc([N+](=O)[O-])cc3C2)c1C 93338289 LISVZYVMUDCPDZ-UHFFFAOYSA-N 314.389 2.986 5 40 DFBB C[C@@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 16091283 GZVCVJIIHYNKNV-LBPRGKRZSA-N 320.370 2.677 5 40 DFBB CC(=O)Oc1cc(OC(C)=O)c2c(c1)oc(=O)c1ccccc12 278298 HYWLETNAKIDVTM-UHFFFAOYSA-N 312.277 2.797 5 40 DFBB biogenic Cc1noc([C@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1 42650928 XAKYKSZPTLSQAR-LURJTMIESA-N 311.681 2.858 5 40 DFBB CS(=O)(=O)c1cc([N+](=O)[O-])c(Oc2ccc(F)cc2)s1 96008382 LUXBCPYWMATSGA-UHFFFAOYSA-N 317.319 2.991 5 40 DFBB Cc1ccn(Cc2csc(-c3ccoc3)n2)c(=O)c1[N+](=O)[O-] 89700627 HDVDTXMQQLZITN-UHFFFAOYSA-N 317.326 2.830 5 40 DFBB CC(C)(C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4090353 WLQZFWXWPSMXII-UHFFFAOYSA-N 305.378 2.680 5 40 DFBB COc1cc(CNc2ccc3[nH]ncc3c2)c([N+](=O)[O-])cc1O 95440150 JUGZXINKHYDJJM-UHFFFAOYSA-N 314.301 2.797 5 40 DFBB C[C@@H]1CCc2ccccc2N1C(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1 180504238 HHZOWXONHLHTEY-VXGBXAGGSA-N 314.345 2.720 5 40 DFBB Cc1ccc(NC(=O)c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 5750611 XDJCHJGXKSIIQS-UHFFFAOYSA-N 300.270 2.884 5 40 DFBB O=C(OCn1cnc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 2577527 RXUILJMHYPJIQG-UHFFFAOYSA-N 316.100 2.913 5 40 DFBB Cc1cccc(NCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 49980 GOLDABSTQQFZCM-UHFFFAOYSA-N 311.297 2.569 5 40 DFBB O=[N+]([O-])c1ccc(SCC[S@@](=O)c2ccccc2)nc1 89847812 KXVOHIXWNVTKIW-FQEVSTJZSA-N 308.384 2.890 5 40 DFBB CC[C@H]1CCCCN1C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3263624 COOUYIHXNRCIMG-ZDUSSCGKSA-N 320.345 2.543 5 40 DFBB CCc1ccccc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225018910 JFMDVQDHIGGWFJ-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1Nc1cnn(C[C@H]2CCCO2)c1 43272482 IGNKPWCVYVWBNW-GFCCVEGCSA-N 306.297 2.853 5 40 DFBB O=C1OC(c2ccc([N+](=O)[O-])cc2)=N/C1=C/c1ccccc1O 1735804 ASXFFUYKEYLKAK-UKTHLTGXSA-N 310.265 2.645 5 40 DFBB C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)O1 226300745 UIDXZCSPVXPLDP-DTORHVGOSA-N 315.167 2.971 5 40 DFBB Cc1ccc(NC(=O)COC(=O)c2cccs2)cc1[N+](=O)[O-] 3379433 GZOYAXHJWQMKBH-UHFFFAOYSA-N 320.326 2.760 5 40 DFBB Cc1ccccc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 3488051 ZHYXTEFTABGFRU-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB Cc1cc(C)c(NC(=O)CNc2ccc([N+](=O)[O-])cn2)c(C)c1 12999803 FKZGKQMSZVWFTA-UHFFFAOYSA-N 314.345 2.966 5 40 DFBB CCN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc([N+](=O)[O-])o1 65576208 QUUYHEYWCQUFNO-UHFFFAOYSA-N 318.285 2.579 5 40 DFBB Cc1ccc(C(=O)Nc2cc(C(=O)O)ccc2F)cc1[N+](=O)[O-] 95349593 GRRGBDXWMQMXLD-UHFFFAOYSA-N 318.260 2.993 5 40 DFBB Cc1cc2nc(Sc3c([N+](=O)[O-])ncn3C)[nH]c2cc1C 33273 FBHRRBWRNYIHLX-UHFFFAOYSA-N 303.347 2.973 5 40 DFBB Nc1nn(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)c2ccccc12 40152097 VKVRCJIGSSGRLF-CMDGGOBGSA-N 308.297 2.880 5 40 DFBB Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 3149531 FPVJHMFRCRSZCI-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB O=C(OC[C@H]1CCCO1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 25396888 KPEOXJUISDFEAL-CYBMUJFWSA-N 320.345 2.531 5 40 DFBB Cc1cc(C(=O)Nc2nncn2-c2ccccc2)cc([N+](=O)[O-])c1 95988461 CKHJQOBSPQGJFN-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB C[C@@H](Oc1cccnc1[N+](=O)[O-])c1nnnn1C1CCCCC1 188787068 ZFDIWVDNNLTODR-SNVBAGLBSA-N 318.337 2.622 5 40 DFBB Cc1cnc(OCc2csc(N(C)C3CC3)n2)c([N+](=O)[O-])c1 96475502 GIJMMXNSFZMADZ-UHFFFAOYSA-N 320.374 2.932 5 40 DFBB C[C@@H](OC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 5723131 PPTUBSSINJWZBK-SWHYSGLUSA-N 319.313 2.866 5 40 DFBB CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 3103929 SCIQYIYYMAPENJ-UHFFFAOYSA-N 301.258 2.780 5 40 DFBB Cc1ccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)c(C)c1 12521297 BRENAWONGMXUPE-UHFFFAOYSA-N 322.342 2.718 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1cnc2ccccc2n1 24851760 ICNCIRMNLNVNES-UHFFFAOYSA-N 309.281 2.895 5 40 DFBB CN(C)c1ccc(C(=O)c2ccccc2C(=O)O)cc1[N+](=O)[O-] 3887868 SXDFWKNQEKZQCQ-UHFFFAOYSA-N 314.297 2.590 5 40 DFBB C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)NC1CCCCCC1 7202815 DOPKOHJSIQPYOX-LLVKDONJSA-N 307.350 2.596 5 40 DFBB CC(C)(C)c1cnc(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)o1 97112848 NBJWEMJTYLSIHH-UHFFFAOYSA-N 319.317 2.516 5 40 DFBB Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CC(C)C)C1CC1 46034297 ZGQGCXUGEMFVQG-UHFFFAOYSA-N 312.391 2.712 5 40 DFBB Cc1n[nH]c2cc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)ccc12 97374770 MHXOKZXDAQRAKO-UHFFFAOYSA-N 312.285 2.737 5 40 DFBB COc1ccccc1-n1cc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2n1 3672409 YWJBYKRZDHOFLF-UHFFFAOYSA-N 314.257 2.851 5 40 DFBB Cc1ccc2nc(COC(=O)c3cccc([N+](=O)[O-])c3)cn2c1 8425178 MMSGBDHQMWUQKF-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCc2ccccc21 6314848 LUDVDKMHYIYPDW-UHFFFAOYSA-N 318.354 2.655 5 40 DFBB CCn1cc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 372991 HZGRJFPSBMJYQX-UHFFFAOYSA-N 322.752 2.703 5 40 DFBB CN(C[C@H](O)COc1ccc([N+](=O)[O-])cc1)C1CCCCC1 6001482 AHIOSJCLDVYQCM-HNNXBMFYSA-N 308.378 2.599 5 40 DFBB O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 100556084 LLGYMIYRWVKWTJ-AOOOYVTPSA-N 308.721 2.928 5 40 DFBB CCOC(=O)N1CCC(Nc2ccc(OC)cc2[N+](=O)[O-])CC1 196644922 KLSJJWMNVALJLD-UHFFFAOYSA-N 323.349 2.636 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C(C)C)C(C)C 14401364 PVFKYAIECATEBY-UHFFFAOYSA-N 314.407 2.862 5 40 DFBB O=[N+]([O-])c1ccc(-c2nc(CN3CCOCC3)cs2)cc1 20436629 DYQBVLTUXJEIJT-UHFFFAOYSA-N 305.359 2.551 5 40 DFBB CC[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 9499497 JODGQLKIKDLCQN-NSHDSACASA-N 305.290 2.687 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[C@H](O)c2ccco2)c1 95445499 QQGDAVZVTHROEF-RISCZKNCSA-N 318.329 2.738 5 40 DFBB C[C@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])cc1 248287910 HANZSBWKEKJQSI-NZVBXONLSA-N 315.329 2.736 5 40 DFBB O=[N+]([O-])c1ccc(NCCCN2CCc3ccccc3C2)nc1 40083101 BKTCMLIVQAWNBQ-UHFFFAOYSA-N 312.373 2.850 5 40 DFBB CCN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H](C)c1cccnc1 97052596 FGFJDMWUMWODLH-NSHDSACASA-N 315.329 2.919 5 40 DFBB O=[N+]([O-])c1cnn(CN2CCC(Cc3ccccc3)CC2)c1 14194766 VFDRXVRTZWOEDD-UHFFFAOYSA-N 300.362 2.704 5 40 DFBB CCOc1cccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 356199 OZAIMSDVBCWXEN-UHFFFAOYSA-N 312.281 2.794 5 40 DFBB CS(=O)(=O)c1ccc(NCc2cccc(F)c2)c([N+](=O)[O-])c1 46485040 CBIOZBDYKKGEDG-UHFFFAOYSA-N 324.333 2.750 5 40 DFBB COc1ccc2c(c1)c1nc3ccccc3nc1n2CC(=O)O 537394 MIPIKQPSSUPSSR-UHFFFAOYSA-N 307.309 2.831 5 40 DFBB CN(C)[C@@H](CNc1ccc([N+](=O)[O-])cn1)c1cccc(F)c1 25371205 NSEJIQXXVPEWBY-AWEZNQCLSA-N 304.325 2.844 5 40 DFBB CS[C@H](CO)[C@@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 76018802 AWYARWFRDJVTSH-YMTOWFKASA-N 307.375 2.667 5 40 DFBB O=[N+]([O-])c1ccc(NC[C@@H](O)c2ccco2)cc1OC(F)F 84429574 DAVLMBSKEYPWTR-SNVBAGLBSA-N 314.244 2.935 5 40 DFBB COc1ccccc1[C@H](CNc1ncccc1[N+](=O)[O-])N(C)C 22500674 BFJYGXMSARAKIB-AWEZNQCLSA-N 316.361 2.713 5 40 DFBB C[C@H](NCc1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 3281918 IKSBHGPJWMTZFP-JTQLQIEISA-N 305.359 2.773 5 40 DFBB CS[C@H](CO)[C@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 76018801 AWYARWFRDJVTSH-LKFCYVNXSA-N 307.375 2.667 5 40 DFBB O=[N+]([O-])c1ccc([C@@H]2ON=C(c3ccccc3)[C@@H]2[N+](=O)[O-])cc1 4016990 HLCKDFGBHDBICY-GJZGRUSLSA-N 313.269 2.716 5 40 DFBB Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc2ccccc2o1 8191423 FEQGLEKPMPYBQN-UHFFFAOYSA-N 313.269 2.675 5 40 DFBB CS[C@@H]1CC[C@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 95990194 HIYQQSZQPANSQN-JGVFFNPUSA-N 316.329 2.887 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)c(OC)c1 35307616 ZQDHOGAWNWMEAL-UHFFFAOYSA-N 318.285 2.570 5 40 DFBB Cc1ccc([C@@H](N)c2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cc1 95534085 FLDLDVPNTHWVSA-CQSZACIVSA-N 309.329 2.736 5 40 DFBB O=[N+]([O-])c1cc([N+](=O)[O-])c2[nH]c(-c3ccc([N+](=O)[O-])o3)nc2c1 100527351 VDRKJNXOAFKOLK-UHFFFAOYSA-N 319.189 2.548 5 40 DFBB Cc1cccc(-n2c3nc(=O)[nH]c(=O)c-3cc3ccccc32)c1C 8856385 YNCLZVOSYFEFHJ-UHFFFAOYSA-N 317.348 2.796 5 40 DFBB Cc1nccc(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 71185150 WNBRSBLIVPZSGH-JTQLQIEISA-N 300.318 2.526 5 40 DFBB O=C(O)c1ccc(Nc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 38857794 RIZFITNYEJRQQU-UHFFFAOYSA-N 302.242 2.735 5 40 DFBB CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96450517 QJRKUDCDUGJPTC-WCQYABFASA-N 309.391 2.581 5 40 DFBB C[N+]1(C)CCN(C[C@@](O)(c2ccccc2)C2CCCCC2)CC1 363 ZRYHPQCHHOKSMD-HXUWFJFHSA-N 317.497 2.847 5 40 DFBB world Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)c([N+](=O)[O-])cc1C 9434778 TUQAATQHHZTGNV-HGSJOUDDSA-N 312.325 2.523 5 40 DFBB COc1ccccc1O[C@@H](Cc1cccc([N+](=O)[O-])c1)C(=O)O 225126094 COGVUJDYFLWJHO-HNNXBMFYSA-N 317.297 2.678 5 40 DFBB Cc1nn(CN2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c(=S)n1C 36394586 SOZXTFCTMVWCGS-SECBINFHSA-N 319.390 2.576 5 40 DFBB O=C1C[C@H](Cc2ccccc2)C(=O)N1c1ccc([N+](=O)[O-])cc1 4661923 BVYKHIMTIVAVPN-ZDUSSCGKSA-N 310.309 2.717 5 40 DFBB Cc1nc(CSCc2ccc(C(N)=O)cc2[N+](=O)[O-])cs1 75584423 BFZFPOXJOKROLD-UHFFFAOYSA-N 323.399 2.892 5 40 DFBB CCCN(C[C@@H]1CCCCO1)Cn1nc(C)c([N+](=O)[O-])c1C 71883585 NHYCZVDISHUBHN-AWEZNQCLSA-N 310.398 2.647 5 40 DFBB CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 153064369 KNLCVEWORUTSEM-UHFFFAOYSA-N 321.358 2.792 5 40 DFBB C[C@@H](O)c1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cc1 53601804 ACWCFZJNBIPCQY-SECBINFHSA-N 318.358 2.969 5 40 DFBB CC(C)N1CCC[C@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 58196329 MJIMMTAVVWYQBC-CYBMUJFWSA-N 320.393 2.837 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)[C@@H](C)C1CC1 58163221 QVCZTOQBTYWAGU-LBPRGKRZSA-N 305.378 2.962 5 40 DFBB CC(=O)Oc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 13955095 GLEBXYUNGOJAQZ-UHFFFAOYSA-N 300.270 2.772 5 40 DFBB Cc1ccccc1-c1nc(CNc2ncccc2[N+](=O)[O-])no1 97163729 BMYJFKXCMZQKHK-UHFFFAOYSA-N 311.301 2.960 5 40 DFBB NC(=O)c1cc([N+](=O)[O-])cc2nc(-c3cccc(F)c3)oc12 73641863 PSKZWUSPQHQCOP-UHFFFAOYSA-N 301.233 2.641 5 40 DFBB CCOc1ccc([N+](=O)[O-])cc1CNC1CCN(CC)CC1 69514787 WYQLOPJQAHVUFE-UHFFFAOYSA-N 307.394 2.567 5 40 DFBB Cc1nc(C)c(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)s1 33180218 QWVBNLIQUPAHAL-UHFFFAOYSA-N 320.374 2.510 5 40 DFBB COc1ccc(OCCN(C)c2ncccc2[N+](=O)[O-])cc1 20668670 GTDZWTBNHHDQHB-UHFFFAOYSA-N 303.318 2.514 5 40 DFBB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] 47264316 PCFVLLHMHNKALH-CHWSQXEVSA-N 323.780 2.605 5 40 DFBB COc1ccc(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 9721286 HBAGHZXPMKFBBF-UHFFFAOYSA-N 312.325 2.735 5 40 DFBB CCc1ccc(NC(=O)N[C@H](C)c2cnn(C)c2)cc1[N+](=O)[O-] 95403805 NZWZZLVPQRYPLU-SNVBAGLBSA-N 317.349 2.773 5 40 DFBB O=C1N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)N1C1CCCCC1 409089293 ZXMNBAHJYPLFCJ-UVTDQMKNSA-N 315.329 2.820 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC(n3cncn3)CC2)c2ncccc12 71899515 RVELXFSSWOYHTR-UHFFFAOYSA-N 324.344 2.576 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)NCC2(SC)CCC2)c1 194467448 WZGPKABMMBPOMR-UHFFFAOYSA-N 310.375 2.619 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@]2(c3ccc([N+](=O)[O-])cc3)O[C@@H]2C1 242522251 INXVAUGPWTYTKB-CZUORRHYSA-N 320.345 2.830 5 40 DFBB CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccncc2)c1 17168570 LQRLKCBERFYURM-UHFFFAOYSA-N 303.343 2.642 5 40 DFBB CN(c1cccc(F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 150748791 KJXWMCXPPXIOMQ-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB NC(=O)c1ccc(-c2ncc3c(=O)oc4ccccc4c3n2)cc1 4784957 QGEPTVWUVLCZHM-UHFFFAOYSA-N 317.304 2.502 5 40 DFBB C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1nc2ccccc2[nH]1 6664329 DUBGVQBIJDCBHS-QMMMGPOBSA-N 300.274 2.555 5 40 DFBB COc1ccc([N+](=O)[O-])cc1O[C@@H](C)C(=O)N1CCCCCC1 15395041 NQNHVFDPBYVNHW-LBPRGKRZSA-N 322.361 2.773 5 40 DFBB CCOc1ccc(NCc2cccc([N+](=O)[O-])c2)c(C(N)=O)c1 72301942 WVGIPJZIAMDZFR-UHFFFAOYSA-N 315.329 2.705 5 40 DFBB C[C@]1(c2ccccc2)NC(=S)N(c2ccc([N+](=O)[O-])cc2)N1 225345892 BBUFNNIOOPHHRD-HNNXBMFYSA-N 314.370 2.667 5 40 DFBB CCc1ccc(-n2c3nc(=O)[nH]c(=O)c-3cc3ccccc32)cc1 521072 BRGSICLIJGCUFP-UHFFFAOYSA-N 317.348 2.741 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccccc1F 12585478 ACJFUFCJGBKECW-UHFFFAOYSA-N 324.333 2.521 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CCCN1c1nccs1 95948744 BZBAZAQUHDHIBB-GFCCVEGCSA-N 318.358 2.659 5 40 DFBB O=[N+]([O-])c1ccc(/N=c2/ssnc2Cl)c([N+](=O)[O-])c1 4190315 GZOWEEMEPIMVHO-CSKARUKUSA-N 318.723 2.907 5 40 DFBB O=[N+]([O-])c1ccc(C(=S)NCc2ccc3c(c2)OCO3)cc1 9188139 ARNJZZTXCNVUJJ-UHFFFAOYSA-N 316.338 2.789 5 40 DFBB C[C@@H](NCc1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 3281919 IKSBHGPJWMTZFP-SNVBAGLBSA-N 305.359 2.773 5 40 DFBB NC(=O)c1cc(Cl)ccc1NCc1ccc([N+](=O)[O-])cc1 58267889 MYRICESXQSMUOM-UHFFFAOYSA-N 305.721 2.959 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nnc(N2CCCC2)s1 48894041 OTTUFFDRQGVXHQ-UHFFFAOYSA-N 309.376 2.593 5 40 DFBB O=C(CN1CCc2cc([N+](=O)[O-])ccc21)Nc1ccccc1F 8779945 JWECHDGJQUKVHI-UHFFFAOYSA-N 315.304 2.735 5 40 DFBB Cc1ccn(Cc2ccc([N+](=O)[O-])cc2Br)c(=O)c1 97096253 ZEYNABHLGRMHIO-UHFFFAOYSA-N 323.146 2.876 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1C[C@H](C)O 97145755 PMDYVEDFVNLATR-QWHCGFSZSA-N 321.377 2.979 5 40 DFBB O=C(c1ccc2nc3ccccc3nc2c1)N1CCSCC1 33768072 XGNRYDMTSWYAAB-UHFFFAOYSA-N 309.394 2.972 5 40 DFBB CC(=O)Nc1cc([N+](=O)[O-])ccc1C[C@H](O)c1ccccc1 5431561 RCLULDDTHVAVPE-INIZCTEOSA-N 300.314 2.829 5 40 DFBB O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C\c1ccc(O)cc1 8642177 BNBFTLPBXWVSKJ-ZSOIEALJSA-N 310.265 2.645 5 40 DFBB O=c1[nH]c(SCc2ccc([N+](=O)[O-])cc2)nc2c1CCCC2 8017038 PZWPVSHDZJVISY-UHFFFAOYSA-N 317.370 2.849 5 40 DFBB COc1ccc(OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 5360357 WAXSFNFMEFGJJS-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB O=C(COC(=O)C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 5505411 QBCHBRAPFGVYCU-UHFFFAOYSA-N 306.318 2.657 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1O)N(Cc1cccnc1)C1CC1 122907359 HTDAEYFBXFZMPJ-UHFFFAOYSA-N 313.313 2.500 5 40 DFBB CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@H](C)C2)n1 5163890 JFXKQUVPZMIDHL-GARJFASQSA-N 322.413 2.660 5 40 DFBB COc1cc(NC(=O)CN2CCCC[C@H]2C)c(C)cc1[N+](=O)[O-] 7486593 GSAWCAVIHFXXOC-GFCCVEGCSA-N 321.377 2.725 5 40 DFBB COc1ccccc1[C@H]1NC[C@@H](c2ccc([N+](=O)[O-])cc2)O1 19805528 RUPFSSOHHXJTKI-HOTGVXAUSA-N 300.314 2.963 5 40 DFBB Cc1ccc(S(=O)(=O)NCc2cccc(F)c2)cc1[N+](=O)[O-] 43785688 CVEMZWYMIWPJJD-UHFFFAOYSA-N 324.333 2.521 5 40 DFBB CCOC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 97095514 CGFWQYZZLXOARB-SNVBAGLBSA-N 312.753 2.747 5 40 DFBB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 6315601 JNNHYXIFAVSLFA-NSHDSACASA-N 318.354 2.735 5 40 DFBB Cc1nc(COC(=O)c2ccc([N+](=O)[O-])o2)nc2ccccc12 25265501 NVWCJCMLCCTNJE-UHFFFAOYSA-N 313.269 2.796 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc(-c3ccccn3)o2)nc1 408582474 OHQXWHJSGBZARR-UHFFFAOYSA-N 301.287 2.586 5 40 DFBB O=C(OCc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])o1 3513106 NENLILZNTFFZKS-UHFFFAOYSA-N 315.241 2.595 5 40 DFBB CC1CCC(N(C)c2nc3ccccn3c(=O)c2[N+](=O)[O-])CC1 12909685 MOERREPRSRLHRY-UHFFFAOYSA-N 316.361 2.618 5 40 DFBB COc1ccc([C@@H](C[N+](=O)[O-])C2C(=O)CC(C)(C)CC2=O)cc1 100835214 CBWQGVITGZFHSI-CYBMUJFWSA-N 319.357 2.630 5 40 DFBB COC(=O)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 14351148 SKWKIFXSAOAKJN-UHFFFAOYSA-N 301.298 2.889 5 40 DFBB O=C(c1ccc(F)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 9028716 QDSKKYXGBCAYQX-UHFFFAOYSA-N 303.245 2.736 5 40 DFBB O=C(Nc1nc(-c2cccnc2)cs1)c1ccc([N+](=O)[O-])o1 4138506 RKVUXHCJXUCTCZ-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB Cc1nn(CCC(=O)N2[C@H](C)CCC[C@H]2C)c(C)c1[N+](=O)[O-] 2779223 XWZGHWMGJXTJPR-GHMZBOCLSA-N 308.382 2.588 5 40 DFBB O=[N+]([O-])c1cnn(Cc2ccc(Br)cc2F)c1 67799567 OUVDSGRPWJUTLR-UHFFFAOYSA-N 300.087 2.741 5 40 DFBB O=C1N/C(=C/c2ccccc2[N+](=O)[O-])C(=O)N1Cc1ccccc1 221925352 QRCZRDSKGFJOPJ-GXDHUFHOSA-N 323.308 2.688 5 40 DFBB O=C(Nc1nc(-c2ccccn2)cs1)c1ccc([N+](=O)[O-])o1 239524 GMFTUXQMPOLTIV-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)NCCc1ccc(F)cc1 8156267 HBNBJTPHPXYZKB-UHFFFAOYSA-N 317.320 2.505 5 40 DFBB CCC(=O)Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 884867 ZNKFJWWHNIILDO-UHFFFAOYSA-N 303.274 2.789 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCCC[C@@H]2C)c([N+](=O)[O-])c1 26508764 PFTQFKIEVODVEB-VIFPVBQESA-N 323.305 2.668 5 40 DFBB COc1cc([N+](=O)[O-])ccc1N[C@@H]1OC(=O)c2ccccc21 4140846 FPOCCEURNADLDU-CQSZACIVSA-N 300.270 2.885 5 40 DFBB C[C@H]1CCc2noc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 8612414 LTSFWTHSANWTTH-VIFPVBQESA-N 301.302 2.960 5 40 DFBB CCc1ccccc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 5260039 HCXZPXIHVJNCGZ-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3ccccc3Cl)CC2)cn1 5688303 DEYUEIBXAJXFEF-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB COc1ccccc1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 18234547 GWQGWSDHADAFDV-UHFFFAOYSA-N 312.325 2.735 5 40 DFBB COC(=O)c1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1 3181324 ZPLOBEXNKUWSLU-UHFFFAOYSA-N 301.254 2.601 5 40 DFBB biogenic CCOc1ccc(-c2ccc(/C=C/C(N)=O)o2)c([N+](=O)[O-])c1 70461199 ZVOPFWKZXTVRDB-VMPITWQZSA-N 302.286 2.752 5 40 DFBB COc1cc(CN(C)Cc2c(C)noc2C)c([N+](=O)[O-])cc1O 91814666 FPCMMEHHRNLOFA-UHFFFAOYSA-N 321.333 2.546 5 40 DFBB C[C@H]1[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]2C[C@H]1C2(C)C 102595704 NUHDHPGTPBVBFT-OXHZDVMGSA-N 321.377 2.795 5 40 DFBB Cc1nn(C(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C)c1[N+](=O)[O-] 2084750 DHXURVUYEKJCBK-UHFFFAOYSA-N 324.680 2.658 5 40 DFBB Cc1nn2c(nnc3c4ccnn4ccc32)c1-c1ccccc1 22606851 WYGCRFXXIHGNJJ-UHFFFAOYSA-N 300.325 2.901 5 40 DFBB CCOc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 14256001 SUTNYDIPGPFHSF-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB CCc1ccc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 10325483 ITIHJPDQWFYBNL-UHFFFAOYSA-N 313.313 2.734 5 40 DFBB CCOC(=O)c1cnc2c(C)c(F)c(F)c([N+](=O)[O-])c2c1O 96327317 KSZSXIMAODIQHC-UHFFFAOYSA-N 312.228 2.612 5 40 DFBB COc1cc(C(=O)N2CCSC(C)(C)CC2)ccc1[N+](=O)[O-] 279367126 SHAFRPOOTDAKFO-UHFFFAOYSA-N 324.402 2.961 5 40 DFBB O=c1[nH]cnc2cc(NCCc3cccs3)c([N+](=O)[O-])cc12 29187241 GDBWJAWMWJFLBQ-UHFFFAOYSA-N 316.342 2.547 5 40 DFBB O=C1OCCN1Cc1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1 52486979 TYRLWDVGVLZYCI-UHFFFAOYSA-N 314.301 2.686 5 40 DFBB Cc1ccc(C)c(-n2c3nc(=O)[nH]c(=O)c-3cc3ccccc32)c1 428959 BNHGZIKQZWRBAP-UHFFFAOYSA-N 317.348 2.796 5 40 DFBB CC(C)(C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1O 57294252 RJZJAFGECSUPLR-UHFFFAOYSA-N 317.139 2.591 5 40 DFBB O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccn(C2CCCC2)n1 92546542 IKEQRCXVKXNQHL-UHFFFAOYSA-N 316.317 2.864 5 40 DFBB O=[N+]([O-])c1ccc(N(C[C@H]2CCCO2)C[C@H]2CCCO2)c(F)c1 84351187 MBLDFBMYTQUXQP-ZIAGYGMSSA-N 324.352 2.898 5 40 DFBB Cc1cc(N[C@H](c2nnc3n2CCC3)C(C)C)ncc1[N+](=O)[O-] 95415005 SNOGGUMGMZDHGS-AWEZNQCLSA-N 316.365 2.645 5 40 DFBB O=[N+]([O-])c1cc(Cl)ccc1N1CCC(Cn2ccnn2)CC1 89768438 TWSILNOFDJBCOY-UHFFFAOYSA-N 321.768 2.756 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(OCc2ccc(F)cc2)cc1O 216933421 HXUUCNTZUVNZNY-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB CCCOc1ccc(CNc2c([N+](=O)[O-])ncn2C)cc1OC 32827761 WXBFMFMKDUZWGF-UHFFFAOYSA-N 320.349 2.738 5 40 DFBB COc1cc(NC(=O)CNC2CCCCC2)c(C)cc1[N+](=O)[O-] 8344430 IRIXVCMUOZKOHR-UHFFFAOYSA-N 321.377 2.773 5 40 DFBB O=[N+]([O-])c1c(NC[C@@H]2Cc3ccccc3O2)nc2ccccn12 25569893 DONJHMSCCMPVLD-LBPRGKRZSA-N 310.313 2.658 5 40 DFBB O=c1[nH]c2c(s1)[C@@H]1c3cc([N+](=O)[O-])ccc3OC[C@@H]1CS2 2487403 VDJBLTVFFSDNLR-LDWIPMOCSA-N 322.367 2.591 5 40 DFBB O=c1nc2c3ccc(F)cc3ncn2nc1-c1ccc(F)cc1 69982207 ILBMAKRCUPSENZ-UHFFFAOYSA-N 310.263 2.583 5 40 DFBB O=C(Nc1nnc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 4330259 HWFKGCJVIGPRRM-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB O=C(N[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 71882831 ZAADNNPQGHMGEB-AWEZNQCLSA-N 311.341 2.604 5 40 DFBB COc1ccc(Nc2ccc3nonc3c2[N+](=O)[O-])c(OC)c1 4537871 ITHMLCBLBNRDGY-UHFFFAOYSA-N 316.273 2.892 5 40 DFBB O=C(NCCCOCc1ccccc1)c1ccc([N+](=O)[O-])o1 25837340 YJLDYUOEHOGAAF-UHFFFAOYSA-N 304.302 2.525 5 40 DFBB CN(C)CCCNCc1cc(=O)oc2ccc3ccccc3c12 57406161 DDYKJXLIKRACSQ-UHFFFAOYSA-N 310.397 2.988 5 40 DFBB O=[N+]([O-])c1ccc2c(cnn2CN(CC(F)(F)F)C2CC2)c1 58392020 IORMDCKRNVKGOK-UHFFFAOYSA-N 314.267 2.929 5 40 DFBB Cc1cc(C(=O)N[C@H](C)CC[C@@H]2CCCO2)c(N)c([N+](=O)[O-])c1 69977510 RPHZNCUKJMNCPL-NEPJUHHUSA-N 321.377 2.563 5 40 DFBB Cc1ccc(NC(=O)CCNc2ccc([N+](=O)[O-])cc2)nc1 71899544 QDLMQHXAKOHYNC-UHFFFAOYSA-N 300.318 2.739 5 40 DFBB Cc1cncc(CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 97095566 ZXWPLYMKSJPWNY-UHFFFAOYSA-N 305.721 2.882 5 40 DFBB C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CN1C1CC1 97162526 GUOQVSMJYZRFNC-KOLCDFICSA-N 323.780 2.603 5 40 DFBB COc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1cccs1 32744536 YSCOOBRCJZSWGW-UHFFFAOYSA-N 306.343 2.937 5 40 DFBB Cn1cnc([N+](=O)[O-])c1C(=O)Nc1ccc(Cl)c(Cl)c1 4629778 AUDJAXQBVJCUNB-UHFFFAOYSA-N 315.116 2.887 5 40 DFBB O=C(O)c1ccc(Cl)c(NC(=O)c2ccc([N+](=O)[O-])o2)c1 20139719 GRULCZUVTGSMQI-UHFFFAOYSA-N 310.649 2.792 5 40 DFBB COCc1cccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 26547305 DPHDUNQQPPGDPE-UHFFFAOYSA-N 322.342 2.542 5 40 DFBB O=C(NCc1ccc(-n2ccnc2)cc1)c1ccc([N+](=O)[O-])cc1 20494624 DMCSUPBLRKTEMI-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB C[C@@H](OC[C@H]1CCCCO1)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 71795773 WKERCXADUMPRTR-IUODEOHRSA-N 322.361 2.532 5 40 DFBB CC(C)CSCCNc1cc([N+](=O)[O-])ccc1NCCO 95454330 ODINGZCAOMKSCV-UHFFFAOYSA-N 313.423 2.800 5 40 DFBB CCCCOC(=O)c1cc([N+](=O)[O-])ccc1Sc1ncn[nH]1 70462434 DQESEHXWRKSCNI-UHFFFAOYSA-N 322.346 2.821 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(NCc2ccnc(OC)c2)c1 96446497 BPDOZAUSJBIKKX-UHFFFAOYSA-N 307.281 2.758 5 40 DFBB C[C@H]1O[C@@](O)(c2ccc([N+](=O)[O-])cc2)CC[N+]12CCCCC2 162707 SODNBJROKAQGMX-CZUORRHYSA-N 307.370 2.507 5 40 DFBB Cc1ccc(CNC(=O)COc2cc(F)ccc2[N+](=O)[O-])cc1 3572642 AUDLHEXSGRXRAI-UHFFFAOYSA-N 318.304 2.738 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 12760127 WGGVEZYTZMGDIN-UHFFFAOYSA-N 318.354 2.620 5 40 DFBB Cc1ncc([N+](=O)[O-])n1Cc1ccc(OC[C@H]2CCCO2)cc1 96489847 FXBDPHOWFPJAIK-OAHLLOKOSA-N 317.345 2.706 5 40 DFBB CCCc1cc(=O)[nH]c(SCc2ccccc2[N+](=O)[O-])n1 11443246 RFGIRCZSUMURHN-UHFFFAOYSA-N 305.359 2.923 5 40 DFBB CC[C@@](CO)(NCc1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 83469436 ZCVNJBZXLDNCLQ-KRWDZBQOSA-N 316.357 2.688 5 40 DFBB C[C@@H](SC1=NCCS1)C(=O)Nc1ccc([N+](=O)[O-])cc1 9500059 RUIZQVHHOLCJRZ-MRVPVSSYSA-N 311.388 2.758 5 40 DFBB CCCCCC(=O)Nc1ccc([N+](=O)[O-])cc1N1CCOCC1 20611761 HCGSTYCMFOCHAY-UHFFFAOYSA-N 321.377 2.950 5 40 DFBB O=C(NCC1CC1)C1(NCc2csc([N+](=O)[O-])c2)CCCC1 85938252 WWPLEYJFIRARCV-UHFFFAOYSA-N 323.418 2.585 5 40 DFBB C[C@@H](c1ccco1)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 89910086 YYDXDINGXKUKTH-NSHDSACASA-N 324.358 2.711 5 40 DFBB Cc1ccc(NCCN(C)C)c2c(=O)c3cc(O)ccc3oc12 5460313 QBUATVGLDZNNBO-UHFFFAOYSA-N 312.369 2.934 5 40 DFBB Cc1cccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])o2)c1C 3235451 LEFHDBKFGZELQB-UHFFFAOYSA-N 318.285 2.600 5 40 DFBB Cc1ccc2nc(CNc3cccc([N+](=O)[O-])c3C)cc(=O)n2c1 15319822 PYWFYOOYVRPJEE-UHFFFAOYSA-N 324.340 2.832 5 40 DFBB CC(C)OCCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl 21779845 LMSYFBWRQCHBLI-UHFFFAOYSA-N 300.742 2.793 5 40 DFBB CNc1ccc(C)cc1S(=O)(=O)c1ccccc1[N+](=O)[O-] 1642741 MIOQKLFEBBWXNP-UHFFFAOYSA-N 306.343 2.778 5 40 DFBB CCn1c(=O)c([N+](=O)[O-])c(NC[C@@H]2CCCO2)c2ccccc21 5573281 HBBBFUILSMIJBM-NSHDSACASA-N 317.345 2.521 5 40 DFBB C[C@H](Cc1cccs1)NC(=O)Nc1ccncc1[N+](=O)[O-] 97080904 YGGRLUHPZSBAFM-SECBINFHSA-N 306.347 2.804 5 40 DFBB CC(C)CN(CC(C)C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 13946393 FSACVEJPRMIXQX-UHFFFAOYSA-N 314.407 2.898 5 40 DFBB Cc1cc(C(=O)Nc2ccc(O)c(C(=O)O)c2)ccc1[N+](=O)[O-] 9190513 VGSCEPVUEBGLIX-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB CC(=O)N[C@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 97048439 YIYHXOAYERGIJG-OCCSQVGLSA-N 305.378 2.565 5 40 DFBB CO[C@]1(C)C[C@H](N(C)c2nc3ccccn3c2[N+](=O)[O-])C1(C)C 76093041 XZTMPNXCENHCTB-MEDUHNTESA-N 318.377 2.882 5 40 DFBB Cc1cc(C(=O)N(C(C)C)C2CCOCC2)ccc1[N+](=O)[O-] 78182707 RQNOQDYZNDYHMK-UHFFFAOYSA-N 306.362 2.933 5 40 DFBB O=C(CC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(O)c1 127425 NTEKWBSTOGJVHX-UHFFFAOYSA-N 300.270 2.512 5 40 DFBB CON(C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 32902410 IONFHINEOJVAGV-UHFFFAOYSA-N 301.302 2.972 5 40 DFBB O=C(CCn1cnc([N+](=O)[O-])c1)Nc1cccc2ccccc12 12544607 JFFGRSKFSLEQRD-UHFFFAOYSA-N 310.313 2.973 5 40 DFBB O=C(COC(=O)c1ccccc1)Nc1ccc(F)cc1[N+](=O)[O-] 5128221 PMHJZNLILJUNHU-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cc1nc(C(C)(C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])no1 65513072 NOTPHVBRFOJEBC-UHFFFAOYSA-N 324.724 2.605 5 40 DFBB CC(C)CO[C@@H]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 95413110 UQFLDWIINWFMNE-OAHLLOKOSA-N 321.377 2.551 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc2c(c1)OCO2 31929712 BEVRKKBEXDCANQ-UHFFFAOYSA-N 314.297 2.596 5 40 DFBB Cc1nn(C)c(N[C@@H]2CCO[C@@H]2c2ccccc2)c1[N+](=O)[O-] 96447434 HNPISTYTXTYEAO-TZMCWYRMSA-N 302.334 2.579 5 40 DFBB Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] 245343966 WQTTWOBBWMPPHC-CORIIIEPSA-N 321.377 2.567 5 40 DFBB CCc1nn(C)c(CC)c1CNc1ncc([N+](=O)[O-])cc1C 270002816 YNEOEMXYEHDHOE-UHFFFAOYSA-N 303.366 2.769 5 40 DFBB CC[C@@H](C)NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2o1 32777301 SGKYUFAFOQOLEN-MRVPVSSYSA-N 309.347 2.743 5 40 DFBB O=[N+]([O-])c1cnc(NCc2ccccc2F)nc1NC1CC1 46584159 XVJPTJZRZNWFEI-UHFFFAOYSA-N 303.297 2.710 5 40 DFBB COc1cc(C=O)ccc1OCC(=O)c1ccc([N+](=O)[O-])cc1 3257593 VKGLJDAARKDLQM-UHFFFAOYSA-N 315.281 2.678 5 40 DFBB COc1ccc(NS(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 4148334 AIADJAOLOVAOAW-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB O=C(NCCSc1ccccc1)c1ccc([N+](=O)[O-])c(O)c1 14015443 AXSVQHIIEANGOT-UHFFFAOYSA-N 318.354 2.823 5 40 DFBB Cc1ccc(OC(=O)CCn2cc([N+](=O)[O-])cn2)c(Cl)c1 76019385 ZLPXYFUNXHPXML-UHFFFAOYSA-N 309.709 2.749 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1O)N1CCc2ccc(F)cc21 195567284 QDBUADAGSKAQEE-UHFFFAOYSA-N 302.261 2.642 5 40 DFBB CCCNc1nc(Cl)nc(Nc2cccc([N+](=O)[O-])c2)n1 199800727 ASCUSHKZSJQHFA-UHFFFAOYSA-N 308.729 2.999 5 40 DFBB CC(C)[C@@H]1OCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1F 96454450 DVPQQIRZGNWUBD-YGRLFVJLSA-N 310.325 2.525 5 40 DFBB O=C(O)c1ccccc1Nc1ccc([N+](=O)[O-])cc1C(=O)O 4361828 WWICBKVKLIBPOT-UHFFFAOYSA-N 302.242 2.735 5 40 DFBB NC(=O)c1ccc(COc2ccccc2Cl)c([N+](=O)[O-])c1 8718559 LVQOGCCAFWTKSX-UHFFFAOYSA-N 306.705 2.926 5 40 DFBB Cc1ccc(C(=O)N2CC(C)(C)OC(C)(C)C2)cc1[N+](=O)[O-] 97104702 JZEDDJWMFSQHKG-UHFFFAOYSA-N 306.362 2.933 5 40 DFBB CN(C)C(=O)Cc1ccccc1NCc1ccccc1[N+](=O)[O-] 83136503 KROPQNZQMKJHAF-UHFFFAOYSA-N 313.357 2.838 5 40 DFBB Cc1nc(Nc2ccccn2)c([N+](=O)[O-])c(Nc2ccccn2)n1 5390720 ODGJGVVEUCLBCM-UHFFFAOYSA-N 323.316 2.970 5 40 DFBB COc1cccc([C@H](CNc2ncccc2[N+](=O)[O-])N(C)C)c1 7979758 NCCZWWSQALYEPH-HNNXBMFYSA-N 316.361 2.713 5 40 DFBB Brc1ccc2c(ccc3c2nnc2ncnn23)c1 1588292 AGLHLBKQMJDZFP-UHFFFAOYSA-N 300.119 2.588 5 40 DFBB COc1ccccc1[C@@H]1CCCN1c1c([N+](=O)[O-])ncn1C 68916718 HXXFHVYHOJVZPX-LBPRGKRZSA-N 302.334 2.678 5 40 DFBB COc1ccc(NC(=O)CN(C)C2CCCCC2)c([N+](=O)[O-])c1 6637032 BTKOMUIOSUYDMM-UHFFFAOYSA-N 321.377 2.806 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1cccc(O)c1 97096149 HHZXAIDBTPPNGE-UHFFFAOYSA-N 301.302 2.931 5 40 DFBB Cc1nc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cs1 75127482 RIFGQCATWGSVBW-MRVPVSSYSA-N 303.343 2.951 5 40 DFBB Cc1ccc(S(=O)(=O)NCC2=CCCCC2)cc1[N+](=O)[O-] 223975750 MEXYNPLKURPFNB-UHFFFAOYSA-N 310.375 2.682 5 40 DFBB O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1ccc([N+](=O)[O-])cc1 252550155 SBNNMMXSGSEUOV-YUELXQCFSA-N 304.346 2.813 5 40 DFBB O=[N+]([O-])c1cnn(Cc2cc(Cl)c3c(c2)OCCCO3)c1 58391135 LKIYCUXHQHUZID-UHFFFAOYSA-N 309.709 2.654 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])c1 169302110 BVUUQMPZCQAOIE-FKGLVLAHSA-N 312.325 2.605 5 40 DFBB Cc1nn(CCC(=O)N2[C@@H](C)CCC[C@@H]2C)c(C)c1[N+](=O)[O-] 2779222 XWZGHWMGJXTJPR-QWRGUYRKSA-N 308.382 2.588 5 40 DFBB CCc1nc2ccccc2c2nc(=O)c(-c3cccs3)nn12 12878068 JPKAAVMFNMCCOB-UHFFFAOYSA-N 308.366 2.929 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(F)cc1 4594733 RESDUXJRTXMHFY-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB O=[N+]([O-])c1cccc([C@H](NCc2ccccc2)P(=O)(O)O)c1 65090419 OVSHTRIRRLHWHS-CQSZACIVSA-N 322.257 2.561 5 40 DFBB O=[N+]([O-])c1cc(NC(=S)NC[C@@H]2CCCO2)ccc1Cl 7521341 GVNZJHSRROSZIL-VIFPVBQESA-N 315.782 2.714 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@H]1CCc1ccccc1 52454283 GCJLUYKWZQPKIZ-AWEZNQCLSA-N 300.362 2.930 5 40 DFBB CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc([N+](=O)[O-])c(O)c1 71883702 ZWUOBYYVZVFZOF-ZDUSSCGKSA-N 322.361 2.722 5 40 DFBB C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 95438293 IDBKDWGBSDZNGY-RISCZKNCSA-N 312.325 2.889 5 40 DFBB COc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c(C)n1 89688883 OXHSHOOZVBQFJZ-UHFFFAOYSA-N 301.302 2.868 5 40 DFBB O=[N+]([O-])c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1F 128926717 FIEJGSWTTXCBKS-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB CO[C@@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 80827413 VIHPCZMSBHICRY-MRXNPFEDSA-N 312.325 2.825 5 40 DFBB CC[C@@H]1COCCN1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 96455212 HFQRNGPTQPNQRV-GXTWGEPZSA-N 321.377 2.785 5 40 DFBB NC(=O)c1cccc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 69559675 OQCKIRNUVTVWIO-UHFFFAOYSA-N 322.324 2.606 5 40 DFBB COc1ccc(Nc2ccc([N+](=O)[O-])c3nonc23)c(OC)c1 4537869 PFYUJAUPXOLLHR-UHFFFAOYSA-N 316.273 2.892 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@@H](C(C)C)CC1 71908065 KALZUZHDLIYRAO-CQSZACIVSA-N 322.409 2.775 5 40 DFBB Cc1cc(NC(=O)NC[C@@H]2CCC[C@H](O)C2)ccc1[N+](=O)[O-] 97163047 GPYIVWYKEJSLCJ-YPMHNXCESA-N 307.350 2.576 5 40 DFBB CC1(C)C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)O1 187029777 UWGWPILSHXXYRP-ZIAGYGMSSA-N 308.378 2.564 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCC[S@@](=O)c1ccccc1 96408675 SCYHTPISZPECHH-NRFANRHFSA-N 305.359 2.518 5 40 DFBB Cn1cccc1[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])o1 96445072 UFCYVYBPAMRECS-GFCCVEGCSA-N 303.318 2.894 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc(Cl)c1F 58016225 DIQHGIJTCXVDQJ-UHFFFAOYSA-N 312.688 2.531 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccc(F)cc1 55651232 BZDRPMYCKQKLFY-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB CCN(C)c1nc(Cl)nc(Nc2cccc([N+](=O)[O-])c2)n1 199801053 YWOWBHGYQUFLNP-UHFFFAOYSA-N 308.729 2.633 5 40 DFBB NCCc1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 255189037 NIDKDRIKNUWCGI-UHFFFAOYSA-N 302.290 2.748 5 40 DFBB CC[C@H]1C[N+]2(C)CCc3cc(OC)c(OC)cc3[C@@H]2CC1=O 5437478 YQACESCIPWFYQC-OKNGLOLHSA-N 304.410 2.747 5 40 DFBB Cc1c(C(=O)NC[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] 40074535 XGKCNBDIBBVJQQ-CYBMUJFWSA-N 312.325 2.637 5 40 DFBB Cc1nn(C)c(Nc2ccc(OCC(C)(C)O)cc2)c1[N+](=O)[O-] 72289235 OHXAZIHMCBRPFH-UHFFFAOYSA-N 320.349 2.530 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CSc1nnnn1CC(C)C 30396954 TWJOOHNNGKMHHI-UHFFFAOYSA-N 323.378 2.538 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCc2ccccc21 3079074 ZZGFBPXAPDNPRH-UHFFFAOYSA-N 312.325 2.953 5 40 DFBB COC(=O)c1ccc(N2CCc3ccccc3C2)c([N+](=O)[O-])c1 22795941 OXVJULLBSOMXEU-UHFFFAOYSA-N 312.325 2.944 5 40 DFBB C[C@@H](O)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 97232716 AHQMFJZVVKNFDX-NOZJJQNGSA-N 312.753 2.624 5 40 DFBB O=C(NCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 32925599 RTJJHXSOXKKAJZ-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB NC(=O)c1cc([N+](=O)[O-])cc2nc(-c3ccc(F)cc3)oc12 73641885 ATRVPIUJXFCHBJ-UHFFFAOYSA-N 301.233 2.641 5 40 DFBB CCc1ccccc1N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 224997785 XDUMGHOUFSENHY-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCCCCC1 58369977 VFGAIFWCRNPWIR-UHFFFAOYSA-N 323.305 2.670 5 40 DFBB Nc1ccccc1SCC(=O)Nc1ccccc1[N+](=O)[O-] 4708523 GPUICUBBQFHVKP-UHFFFAOYSA-N 303.343 2.908 5 40 DFBB Cc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)nc1 8746415 GPDVOZCBHDBNSO-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB COc1ccc(CC(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1F 89536978 CIIHSKFZQZEYPH-UHFFFAOYSA-N 319.292 2.627 5 40 DFBB Cc1ccc(C(=O)NCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 5618301 UCIBSDNXLSXILN-UHFFFAOYSA-N 314.297 2.562 5 40 DFBB COc1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3149741 TXPXWYPNZVZGSB-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=c1c2ccccc2nc2c3cnn(-c4ccccc4)c3ncn12 82075 IRDBIFWWHDKDBQ-UHFFFAOYSA-N 313.320 2.582 5 40 DFBB COc1ccccc1/C=C/c1ncc([N+](=O)[O-])cc1C(=O)O 39996370 MKKMWMGFLLXJRN-VOTSOKGWSA-N 300.270 2.867 5 40 DFBB O=C(NCc1ccccc1)c1cn[nH]c1-c1ccc([N+](=O)[O-])cc1 72329373 OGFJAYREVLGCDX-UHFFFAOYSA-N 322.324 2.915 5 40 DFBB NC(=O)c1cn(C(=O)Cc2ccc([N+](=O)[O-])cc2)c2ccccc12 216952048 MCOSKUWADHYWKN-UHFFFAOYSA-N 323.308 2.531 5 40 DFBB CC1=C[C@@H]2C[C@H]1[C@@H]1C(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C(=O)[C@H]21 5684548 VOARIUUNMNTZEJ-LTZCYQRMSA-N 312.325 2.605 5 40 DFBB Cc1c(-c2ccccc2)n(O)c(-c2ccc([N+](=O)[O-])cc2)[n+]1[O-] 1568647 XDJKLOIWMSEVQA-UHFFFAOYSA-N 311.297 2.909 5 40 DFBB Cn1cnnc1-c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 32912935 XBVLRNRSDVDXRP-UHFFFAOYSA-N 323.312 2.643 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N2CCOc3nc(C)ccc32)c1 97033591 LIJRVPSSPFNRDK-UHFFFAOYSA-N 313.313 2.646 5 40 DFBB CC[C@@H]1C[N+]2(C)CCc3cc(OC)c(OC)cc3[C@@H]2CC1=O 44568 YQACESCIPWFYQC-LKZXSFHQSA-N 304.410 2.747 5 40 DFBB O=C(O)CCCCCO[C@@H](C[N+](=O)[O-])C(Cl)(Cl)Cl 1557954 CKFBVZVFNWQUEM-ZETCQYMHSA-N 322.572 2.664 5 40 DFBB O=C(Cn1cnc([N+](=O)[O-])n1)c1ccc2c(c1)-c1ccccc1C2 53834862 XWECAZRTWVUGSX-UHFFFAOYSA-N 320.308 2.640 5 40 DFBB CC[C@@H](c1ccncc1)N(C)C(=O)c1cccc([N+](=O)[O-])c1O 89947962 MDFCHSGJJOPNRI-ZDUSSCGKSA-N 315.329 2.919 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CCCN(c2nccs2)CC1 58440964 ALZZEQKCSOELPG-UHFFFAOYSA-N 322.365 2.907 5 40 DFBB COc1ccccc1N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 6831933 QTXLAYLJHNOVMV-UHFFFAOYSA-N 313.357 2.930 5 40 DFBB C[C@H]1[C@H](C)CCN1C(=O)c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1 96011246 MHHOKEODINYRFM-MNOVXSKESA-N 314.345 2.855 5 40 DFBB CN(Cc1cnn(C)c1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 84318469 QPPLTCNQUISCOH-UHFFFAOYSA-N 312.276 2.566 5 40 DFBB O=C1CCCCN1c1ccc(N2CCCCC2=O)c([N+](=O)[O-])c1 31773291 BMJPWIKWYVHAIE-UHFFFAOYSA-N 317.345 2.629 5 40 DFBB CC(=O)Nc1cccc(OCOc2ccc([N+](=O)[O-])cc2)c1 1749053 AWMJERRMAZYAFB-UHFFFAOYSA-N 302.286 2.969 5 40 DFBB Cc1nn([C@@H](C)C(=O)N[C@H](C)[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1[N+](=O)[O-] 101617438 DQKCGZGIMIXYSB-WJUUCBRBSA-N 320.393 2.602 5 40 DFBB Cn1ccnc1C(=O)c1ccc(NC2CCCC2)c([N+](=O)[O-])c1 58415102 ISCMCXSZYNEBFX-UHFFFAOYSA-N 314.345 2.914 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@@H](C(F)(F)F)C1 36385437 APLQPWVHVHFXTQ-SECBINFHSA-N 318.251 2.715 5 40 DFBB O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)NC1CCCC1 69630753 BQKGSIJGHBBZHN-UHFFFAOYSA-N 314.345 2.517 5 40 DFBB CC(C)(C(=O)Nc1ccc(O)c(Cl)c1)n1cc([N+](=O)[O-])cn1 195556814 OVCHURFMHFKNSU-UHFFFAOYSA-N 324.724 2.524 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCCCCC1 5335141 MSGUQZMZKLOPMQ-UHFFFAOYSA-N 309.278 2.582 5 40 DFBB C[C@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C(C)(C)CO1 91216335 QSKRYHAAOAQUAX-VIFPVBQESA-N 312.753 2.888 5 40 DFBB C[C@@H]1CCC[C@@](O)(CNc2nc3sccn3c2[N+](=O)[O-])C1 65566746 BUXXNDOIEOBXDL-RNCFNFMXSA-N 310.379 2.657 5 40 DFBB CCc1ncc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(O)c2)s1 71890827 GJBLBCZLJWNCFV-UHFFFAOYSA-N 321.358 2.592 5 40 DFBB C[C@H](C[C@H](O)c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 95412740 BAVFUGIFHPWPSB-WBMJQRKESA-N 314.341 2.837 5 40 DFBB Cc1ccccc1[C@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C1CC1 79002065 NIVITJJEMBJYQG-CYBMUJFWSA-N 314.345 2.816 5 40 DFBB O=[N+]([O-])c1ccccc1CN1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 4725190 HUYZTWXQPXNEDQ-HDMKZQKVSA-N 315.417 2.901 5 40 DFBB CCCc1ccc(-c2cc(NC(=O)[C@H]3C[C@@H]3[N+](=O)[O-])[nH]n2)cc1 57205613 QSETWVXEHOCNHR-JSGCOSHPSA-N 314.345 2.633 5 40 DFBB CS[C@H]1CCC[C@H]1N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] 72896622 OWZLWCLNRNUOOF-KGLIPLIRSA-N 323.418 2.749 5 40 DFBB CC[C@@H](CCO)CNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 79075264 OEVMIKVKVZHZTM-PZBABLGHSA-N 322.361 2.602 5 40 DFBB COc1cc(N2CC[C@H]3OCCC[C@@H]3C2)c(F)cc1[N+](=O)[O-] 96489944 TVIYNPJJAWJLBG-QMTHXVAHSA-N 310.325 2.748 5 40 DFBB O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1 5883954 QQBMMPCMNXARBZ-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB O=C(Oc1cc(F)ccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 2564935 GANWZDYNQBLISZ-UHFFFAOYSA-N 306.205 2.861 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)Nc1cccnc1Cl 7358631 LHNDUUHBZBQUSW-UHFFFAOYSA-N 306.709 2.694 5 40 DFBB NC(=O)c1ccc(CSc2ccc(O)cc2)c([N+](=O)[O-])c1 37995810 QHZBDJIFMLQJPK-UHFFFAOYSA-N 304.327 2.692 5 40 DFBB COc1ccc(CCC(=O)Nc2ncc([N+](=O)[O-])s2)cc1 3819046 QOOKTOYWEDZCMO-UHFFFAOYSA-N 307.331 2.631 5 40 DFBB CNc1ccc(CN2CCO[C@@H](c3ccco3)C2)cc1[N+](=O)[O-] 93841462 DMLWIPQNOZRYDO-MRXNPFEDSA-N 317.345 2.803 5 40 DFBB O=[N+]([O-])c1cc(Br)c(O)c(OC(F)(F)F)c1 169800501 ZQHUMRDXFMJFTP-UHFFFAOYSA-N 302.002 2.962 5 40 DFBB O=C(Nc1nnc(-c2cccs2)o1)c1ccc([N+](=O)[O-])o1 2641516 JVSQWTAHRXUMGE-UHFFFAOYSA-N 306.259 2.552 5 40 DFBB CCOC(=O)c1cnc2ccc([N+](=O)[O-])cc2c1N1CCCC1 20405770 OQUSJSXDPCQJPA-UHFFFAOYSA-N 315.329 2.920 5 40 DFBB C[C@@H]1CC[C@@H](C)N1[C@@H]1CCCN(c2ncccc2[N+](=O)[O-])C1 40554228 UZHQMAOTUMUBRB-MGPQQGTHSA-N 304.394 2.831 5 40 DFBB CCN(C[C@@H](O)COc1ccc([N+](=O)[O-])cc1)C1CCCCC1 1473299 SPBKKPJOGBBWHL-MRXNPFEDSA-N 322.405 2.989 5 40 DFBB Nc1nnc(SCc2c(F)cccc2[N+](=O)[O-])n1C1CC1 69894083 IDMHOOVWQFADNF-UHFFFAOYSA-N 309.326 2.535 5 40 DFBB O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)NC2CCCCC2)c1 5506488 SNHOZQYKCQEKBG-UHFFFAOYSA-N 318.782 2.859 5 40 DFBB Cc1cc(OCC(=O)NCCc2cccs2)ccc1[N+](=O)[O-] 7846274 ALGCCBZBQDYHJC-UHFFFAOYSA-N 320.370 2.702 5 40 DFBB O=C(OCc1ccc(Oc2cccnc2)cc1)[C@@H]1C[C@H]1[N+](=O)[O-] 95350490 LTPIEVMVIQGVNX-HUUCEWRRSA-N 314.297 2.582 5 40 DFBB CCS[C@H]1CCC[C@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] 96450597 JKYYWMZZQIEFTE-OCCSQVGLSA-N 308.403 2.928 5 40 DFBB Cc1nc(N2CCCCC2)c([N+](=O)[O-])c(N2CCCCC2)n1 5509923 UJEKJVZBLSIGPT-UHFFFAOYSA-N 305.382 2.674 5 40 DFBB CC(C)C(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1Cl 21596343 AFZNIGPUESTIHF-UHFFFAOYSA-N 301.755 2.717 5 40 DFBB C[C@@H]1CCc2c(sc3ncnc(-n4cc([N+](=O)[O-])cn4)c23)C1 72310931 HFSKRQGWZQQXEM-MRVPVSSYSA-N 315.358 2.910 5 40 DFBB Cc1ccc(N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 194623004 WYTKJCSCPFDQQR-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCCC[C@@H]2C)cc1OC 45957579 LKRBCTKWQJTRCZ-JTQLQIEISA-N 308.334 2.769 5 40 DFBB N=C1NC(=O)/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)S1 3898548 CZZAPCPWFCGOCC-KPKJPENVSA-N 315.310 2.993 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1COc2ccccc2O1 9609469 BCTQDFBSIZGHLT-CQSZACIVSA-N 318.260 2.512 5 40 DFBB CC(=O)Nc1ccc(CCNCc2ccc([N+](=O)[O-])cc2)cc1 72270972 NZOYZSYXWBJXSJ-UHFFFAOYSA-N 313.357 2.886 5 40 DFBB Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c(Cl)c1 72332095 LUQZMBGDTUNGDN-UHFFFAOYSA-N 308.725 2.700 5 40 DFBB CCN(C[C@@H]1CCOC1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 84774566 URXCWPXPLDEHHP-NSHDSACASA-N 317.345 2.575 5 40 DFBB CCc1nn(C)c(N2CCC[C@H](c3nccs3)C2)c1[N+](=O)[O-] 95994723 QDSLBWVYPFVRHK-JTQLQIEISA-N 321.406 2.731 5 40 DFBB O=C(NC(=S)Nc1ccccc1)c1ccc([N+](=O)[O-])cc1 238016 CLUCQDRQMGVTGD-UHFFFAOYSA-N 301.327 2.722 5 40 DFBB O=[N+]([O-])c1cccnc1N1CCO[C@H](c2ccc(F)cc2)C1 29528097 RLTHZIORZHWHLJ-AWEZNQCLSA-N 303.293 2.707 5 40 DFBB COc1ccc([C@@H](CO)N(C)Cc2ccc([N+](=O)[O-])cc2)cc1 71904380 WGXMFQLSRPFRSQ-QGZVFWFLSA-N 316.357 2.769 5 40 DFBB O=C(Cc1ccccc1)N1CCN=Cc2cc([N+](=O)[O-])ccc21 73642299 DAGOTPNOZBXREY-UHFFFAOYSA-N 309.325 2.603 5 40 DFBB Cc1ccc(CNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)cc1 20492817 GCBAQDAOTGSMLV-UHFFFAOYSA-N 320.370 2.523 5 40 DFBB Cc1ccc([C@@H](C)NCC(=O)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] 95985984 NJQKPPYZGDUPRL-TZMCWYRMSA-N 319.405 2.812 5 40 DFBB COc1ccc([C@@H](O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 149478728 PAPDDAQERZQYLZ-INIZCTEOSA-N 319.313 2.702 5 40 DFBB CC(C)(C)c1cc(NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])n(C(C)(C)C)n1 66664557 LWGXPFVKYUFDGF-UWVGGRQHSA-N 308.382 2.539 5 40 DFBB Cn1nc([N+](=O)[O-])nc1Oc1ccc(C(=O)c2ccccc2)cc1 4726344 JNICPHYRPBDQGH-UHFFFAOYSA-N 324.296 2.747 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)NCCCc1ccccc1 8192143 QPQPTAJCKXEECO-UHFFFAOYSA-N 313.357 2.756 5 40 DFBB COc1cc(OCC(=O)Nc2ccccc2F)ccc1[N+](=O)[O-] 22259390 JFFCKTLSCWRMIC-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB Cc1nn(CN2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c(=S)n1C 36394585 SOZXTFCTMVWCGS-VIFPVBQESA-N 319.390 2.576 5 40 DFBB O=C1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)c2ccccc2N1 13856363 UVDCGVXIKIOCBI-CMDGGOBGSA-N 323.308 2.593 5 40 DFBB O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(F)cc2F)c1 6510596 OTKYOUYXUDIGGX-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB Cc1ccc(O[C@@H](C)C(=O)Nc2cc(C)on2)c([N+](=O)[O-])c1 7821612 CVHQYJUVTIIXHA-JTQLQIEISA-N 305.290 2.606 5 40 DFBB CS[C@H]1CCCC[C@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96417111 KRGAYQUBBLKZMX-YPMHNXCESA-N 309.391 2.581 5 40 DFBB COC(=O)c1cn(-c2ccc([N+](=O)[O-])cc2F)nc1C(F)F 575441376 JIHBMYDHOGNXFG-UHFFFAOYSA-N 315.207 2.644 5 40 DFBB O=[N+]([O-])c1cc(Br)ccc1N1CCC[C@@H](CO)C1 40415192 MKAABQHKXOUUJX-SECBINFHSA-N 315.167 2.566 5 40 DFBB COc1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 511553 MPZSHLJAXAUADJ-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB CN1C(=O)[C@]2(CCN[C@@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc21 27046934 HXHRRCNUZRAENO-SJLPKXTDSA-N 323.352 2.544 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC(CCO)CC2)c2ncccc12 69598705 FFHYPZIDKLEMSO-UHFFFAOYSA-N 301.346 2.742 5 40 DFBB CCC(C)(C)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 97135443 HNIOVDDQIIUKDG-LBPRGKRZSA-N 306.366 2.613 5 40 DFBB COc1cc(N[C@@H](C)Cn2nc(C)cc2C)ccc1[N+](=O)[O-] 95403120 MWFBRKSYTSMWRC-NSHDSACASA-N 304.350 2.917 5 40 DFBB COc1cc(N2CC[C@H](CSC)C2)c([N+](=O)[O-])cc1F 95412075 ABXXQNYCLIQKJS-VIFPVBQESA-N 300.355 2.932 5 40 DFBB COc1ccc(C)cc1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 5392709 YFALHOULGKQWAO-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB COc1ccc(C)cc1NCC(=O)Nc1ccc([N+](=O)[O-])cc1 7972980 PLLGSLWBKWZGAT-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB COCc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 25822028 OVXWCNFREGARNS-UHFFFAOYSA-N 300.314 2.922 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCc1nc(-c2ccco2)no1 44069510 AJCANRHEEGSOQR-UHFFFAOYSA-N 316.273 2.859 5 40 DFBB O=[N+]([O-])c1ccc2nc(NCCCO)nc(-c3ccccc3)c2c1 2338840 FVEXFDLDVFOEDM-UHFFFAOYSA-N 324.340 2.999 5 40 DFBB C[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)Cn1ccnc1 81801658 PGTCCHVQMWUKDX-JTQLQIEISA-N 322.752 2.511 5 40 DFBB CCCc1nnc(SCC(=O)Nc2cccc([N+](=O)[O-])c2)o1 20033816 DOIBJRJPEGZVRZ-UHFFFAOYSA-N 322.346 2.661 5 40 DFBB O=[N+]([O-])c1ccc(N[C@@H]2CCN3CCCC[C@@H]23)c([N+](=O)[O-])c1 32932669 OJHNUMDCGWTBNO-OLZOCXBDSA-N 306.322 2.542 5 40 DFBB CCOC(=O)C1CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 51159163 UZCPZGMYLSOKEQ-UHFFFAOYSA-N 306.362 2.678 5 40 DFBB Cc1cc(C(=O)N[C@H](C)CC[C@H]2CCCO2)c(N)c([N+](=O)[O-])c1 69977516 RPHZNCUKJMNCPL-VXGBXAGGSA-N 321.377 2.563 5 40 DFBB O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H]2c2ccccc2)nc1NC1CC1 71827979 GFUQSWSZTCCBOZ-CHWSQXEVSA-N 311.345 2.927 5 40 DFBB Cc1c(C(N)=O)c2ccccc2n1C(=O)c1ccccc1[N+](=O)[O-] 216959546 YPWOFUWBUPZPKF-UHFFFAOYSA-N 323.308 2.645 5 40 DFBB C[C@@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H](C)O1 40526303 CGRNDXBNBFNEDU-RKDXNWHRSA-N 313.741 2.889 5 40 DFBB COC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 3559197 KBZHHOCHJUJQCK-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB O=[N+]([O-])c1ccc(NCCOc2ccc3c(c2)OCO3)c(F)c1 52329352 GIFSXHYRVPWKEQ-UHFFFAOYSA-N 320.276 2.954 5 40 DFBB CCc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 5392665 KUUNKISBQNZXQY-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1C 5509647 NYNSWPLCRNVPOB-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB COc1ccccc1CN(C)c1nc2sccn2c1[N+](=O)[O-] 9157088 PRDVBBNPBZZSQR-UHFFFAOYSA-N 318.358 2.949 5 40 DFBB Cc1ccc(C(=O)N2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] 2708964 FWPZJKHQHVFZID-UHFFFAOYSA-N 311.297 2.502 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)c1cn(C)nc1C 69567892 FWZHQMLRLUGRCO-SNVBAGLBSA-N 317.349 2.828 5 40 DFBB CCc1nc(CCNC(=O)c2cccc([N+](=O)[O-])c2)sc1C 69508892 ITDGLGDWTGVLLI-UHFFFAOYSA-N 319.386 2.895 5 40 DFBB Cc1ccc(O[C@H](C)C(=O)Nc2ccc(F)cc2)c([N+](=O)[O-])n1 4892161 MDWNYHHDQNYAQG-SNVBAGLBSA-N 319.292 2.843 5 40 DFBB O=C(NCc1ccc(O)c(F)c1)Nc1ccc([N+](=O)[O-])cc1 72291895 FVRAHMAHWBCPDF-UHFFFAOYSA-N 305.265 2.761 5 40 DFBB Cc1nc(N)nc2c1c(=O)n(-c1ccccc1)c1ccccc21 3844343 IEJZLYDTBCVIPN-UHFFFAOYSA-N 302.337 2.825 5 40 DFBB biogenic C[C@H](OC(=O)[C@H]1C[C@@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])cc1 78556551 HANZSBWKEKJQSI-VQISRLSMSA-N 315.329 2.736 5 40 DFBB Cc1cc(S(C)(=O)=O)ccc1NCc1ccccc1[N+](=O)[O-] 78987653 GQFUOYLIHUVWIZ-UHFFFAOYSA-N 320.370 2.919 5 40 DFBB Cc1nonc1O[C@@H](C)CNc1ccc([N+](=O)[O-])cc1Cl 5361178 YLIPGQUOGQTXLI-ZETCQYMHSA-N 312.713 2.819 5 40 DFBB CC(C)OC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2684948 OIPRCIMWHWMSIZ-UHFFFAOYSA-N 300.292 2.547 5 40 DFBB Cc1nn(CCCC(=O)NCc2ccccc2)c(C)c1[N+](=O)[O-] 215119 PBGBWPMRRHXGGR-UHFFFAOYSA-N 316.361 2.505 5 40 DFBB COC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1C 562840 UKDYXMINHKKEQY-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB Cc1ccc(F)cc1NC(=O)[C@@H](C)Cn1nc([N+](=O)[O-])cc1C 2788716 OJPWIBRCJLVURJ-JTQLQIEISA-N 320.324 2.822 5 40 DFBB Cc1c(NC(=O)c2ccc([N+](=O)[O-])s2)cccc1C(=O)O 57351848 HYFLICFFQUIDMH-UHFFFAOYSA-N 306.299 2.915 5 40 DFBB Cc1cccc(C(=O)OCc2ccc(N(C)C)c([N+](=O)[O-])c2)n1 97086503 NANKLQDIYSBMSY-UHFFFAOYSA-N 315.329 2.721 5 40 DFBB C[C@H](OC(=O)[C@H]1C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] 78556542 ABEGTQJLWHFYNH-GDLCADMTSA-N 315.329 2.736 5 40 DFBB O=C(NCCSCc1ccco1)c1cccc([N+](=O)[O-])c1 138683263 CFMIEVSWRQNBEP-UHFFFAOYSA-N 306.343 2.851 5 40 DFBB COc1cc(N2CC[C@@H]3OCCC[C@H]3C2)c(F)cc1[N+](=O)[O-] 245339467 TVIYNPJJAWJLBG-HZMBPMFUSA-N 310.325 2.748 5 40 DFBB Cc1ccc(C(=O)O)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 6519827 RRXUJALUVXKMIM-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 3151078 KEFUUQKRELHEPX-LBPRGKRZSA-N 320.370 2.977 5 40 DFBB O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1CC1 12521631 SLNKOLMKNYHHPA-UHFFFAOYSA-N 306.365 2.681 5 40 DFBB O=C(NC[C@@H](O)c1ccccc1F)Nc1cccc([N+](=O)[O-])c1 27350919 FSAGMWNEKCGKIK-CQSZACIVSA-N 319.292 2.589 5 40 DFBB Cc1ccccc1NC(=O)CN1CCc2cc([N+](=O)[O-])ccc21 8780482 VZYANQMBUFDQMW-UHFFFAOYSA-N 311.341 2.904 5 40 DFBB Cc1ccc(C(=O)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1C 9154619 JFZHOGSYQPMWDQ-INIZCTEOSA-N 314.341 2.675 5 40 DFBB CC(C)N(C(=O)Cc1ccccc1[N+](=O)[O-])C1CCOCC1 78182714 RGUHERFCWALFAC-UHFFFAOYSA-N 306.362 2.553 5 40 DFBB Cc1nc(COc2ccc(Br)cc2[N+](=O)[O-])no1 96424965 VPXOZKGCOYGWQE-UHFFFAOYSA-N 314.095 2.628 5 40 DFBB O=C(Oc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1312731 FMBGCERYAGCLPW-UHFFFAOYSA-N 306.205 2.861 5 40 DFBB CC[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCS1 76086170 UFJADZZUDHXJBU-CYBMUJFWSA-N 309.391 2.632 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1C[C@H](C)O 97145757 PMDYVEDFVNLATR-STQMWFEESA-N 321.377 2.979 5 40 DFBB Cc1cc(N[C@@H]2CCC[C@H]2C(N)=O)c2cccc([N+](=O)[O-])c2n1 95463621 YNAKUYOHZRALFL-VXGBXAGGSA-N 314.345 2.517 5 40 DFBB CCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cccs1 225135283 RBSUFODAZFVUGS-UHFFFAOYSA-N 312.372 2.872 5 40 DFBB O=C(O[C@@H]1CC[C@H]2CCC[C@@H]1C2=O)c1ccc([N+](=O)[O-])cc1 5030046 NAJGMLORGKZFRW-DDTOSNHZSA-N 303.314 2.899 5 40 DFBB COc1cccc2nc3c(C(=O)NCCN(C)C)cccc3cc12 5541365 ANGFJJDSIPQARK-UHFFFAOYSA-N 323.396 2.688 5 40 DFBB Cc1ccccc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 1385531 DKOQIYXOPUYLEV-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)c1 3149530 AJZIVSSPIIQMMD-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB O=C(COc1cccc([N+](=O)[O-])c1)NCc1cccc(Cl)c1 12582906 QUOUXBCPYNGGNU-UHFFFAOYSA-N 320.732 2.943 5 40 DFBB COc1cc(OC)cc(C(=O)OCc2ccc([N+](=O)[O-])cc2)c1 3248014 HBLSCZNPWSDMKJ-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB COc1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])c(OC)c1 4611243 ILRQZKOUPHOTQU-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB O=C1C/C(=C\c2ccc(O)cc2)C(=O)N1c1cccc([N+](=O)[O-])c1 9485552 BBCCUTRBCHUFMT-XYOKQWHBSA-N 324.292 2.647 5 40 DFBB O=C(CSc1nc2ccc([N+](=O)[O-])cc2o1)N1CCCCC1 500708 GRCYPJHUIQBVBH-UHFFFAOYSA-N 321.358 2.841 5 40 DFBB O=[N+]([O-])c1c(NC[C@H]2Cc3ccccc3O2)nc2ccccn12 25569895 DONJHMSCCMPVLD-GFCCVEGCSA-N 310.313 2.658 5 40 DFBB C[C@H]1CCC[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 12653732 JUCIBDRBUQHWIF-AOOOYVTPSA-N 307.306 2.906 5 40 DFBB O=C1CCCN1CCCNc1ccc([N+](=O)[O-])c2cnccc12 5638093 YVPRFXOQEWLTQR-UHFFFAOYSA-N 314.345 2.567 5 40 DFBB O=[N+]([O-])c1ccc2nc(NCCOC[C@@H]3CCCO3)sc2c1 95397628 WCTIVTBGVKWGFT-NSHDSACASA-N 323.374 2.812 5 40 DFBB CO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1O)c1ccccc1 89531345 VDFUCQPJXCTVLG-CQSZACIVSA-N 302.286 2.627 5 40 DFBB O=C(O)C1=NN(c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 71979025 UDGGDSXHFPMUCZ-HNNXBMFYSA-N 311.297 2.987 5 40 DFBB CC(=O)N1CC[C@H](CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 195553373 YITRCDXXCWDSGP-DZGCQCFKSA-N 319.405 2.764 5 40 DFBB Cc1ccc([C@@H](N)c2n[nH]c(Cc3ccc([N+](=O)[O-])cc3)n2)cc1 95534151 KIYKTIQRWJGULC-MRXNPFEDSA-N 323.356 2.660 5 40 DFBB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 4839324 ZNGVWFJIYHCABA-XXHBBNRNSA-N 318.716 2.560 5 40 DFBB COc1ccc(N/C=C/c2c([N+](=O)[O-])c(C)nn2C)c(OC)c1 100335077 PRFIHCJLLOSDGS-BQYQJAHWSA-N 318.333 2.737 5 40 DFBB O=C(N[C@@H]1CCCSC1)N1CCc2c(cccc2[N+](=O)[O-])C1 95975618 RBQGGCPUWJNANB-GFCCVEGCSA-N 321.402 2.558 5 40 DFBB Cc1nn(CCc2nc(CCC(C)C)no2)c(C)c1[N+](=O)[O-] 78774094 KQXDKAVPKZLVRT-UHFFFAOYSA-N 307.354 2.622 5 40 DFBB Cc1nn(C)c(N[C@H]2CCO[C@H]2c2ccccc2)c1[N+](=O)[O-] 96447440 HNPISTYTXTYEAO-JSGCOSHPSA-N 302.334 2.579 5 40 DFBB Cc1noc(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)n1 53639353 UTKZKZKOHUZULN-UHFFFAOYSA-N 316.361 2.708 5 40 DFBB CC(=O)Nc1ccc(Oc2nc3ccccn3c2[N+](=O)[O-])cc1 29164318 MEZBHDRODSLDEL-UHFFFAOYSA-N 312.285 2.993 5 40 DFBB C[C@H](Sc1n[nH]c(=O)n1C1CC1)c1cccc([N+](=O)[O-])c1 7776155 WAFAMWILNFAQJU-QMMMGPOBSA-N 306.347 2.668 5 40 DFBB COc1c2c(cc3c1[C@H](C[C@@H](O)C(C)C)[N+](C)(C)CC3)OCO2 4029676 YEKBHHKHHZVRNL-UONOGXRCSA-N 322.425 2.505 5 40 DFBB biogenic Cc1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)n1 97049349 LVCXJJSLPDALHF-UHFFFAOYSA-N 300.318 2.928 5 40 DFBB COC(=O)N/C=C/c1cc(Br)ccc1[N+](=O)[O-] 5719897 WFQAJIZQZDDNIV-SNAWJCMRSA-N 301.096 2.684 5 40 DFBB Cc1cc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c(C)o1 3530544 WDGNCIKLOCPBEJ-UHFFFAOYSA-N 318.285 2.600 5 40 DFBB Cc1cc([N+](=O)[O-])nn1CCCC(=O)Nc1cccnc1Cl 215077 HBOOCFJYMUUABG-UHFFFAOYSA-N 323.740 2.567 5 40 DFBB CCc1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 1728616 MQZSWPBDYPUGOS-UHFFFAOYSA-N 307.327 2.925 5 40 DFBB COc1c2c(cc3c1[C@@H](C[C@@H](O)C(C)C)[N+](C)(C)CC3)OCO2 486951 YEKBHHKHHZVRNL-ZIAGYGMSSA-N 322.425 2.505 5 40 DFBB biogenic O=[N+]([O-])c1cccc(-c2ncn(CCOc3ccccc3)n2)c1 69490991 FITKKWIDVGQRLT-UHFFFAOYSA-N 310.313 2.932 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] 5121348 YTSYXAJETUDLRT-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB C[C@]1(CCCO)CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 95982868 QNIVXIFYJKRMOM-OAHLLOKOSA-N 307.350 2.754 5 40 DFBB O=[N+]([O-])c1cccc(-c2nnc3n2N[C@H](c2ccco2)S3)c1 3843204 BJNMEWNKEDECNF-LBPRGKRZSA-N 315.314 2.794 5 40 DFBB biogenic C[N+](C)(C)C[C@@H](O)COCC(c1ccccc1)c1ccccc1 41690049 CBAPXHGMERVCQO-LJQANCHMSA-N 314.449 2.902 5 40 DFBB CN(Cc1cccc(F)c1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 193094601 XBXAEOCQCSXNJC-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB Cc1cccc(N(C)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])n1 96425190 XZRHRLDYSMFUDW-UHFFFAOYSA-N 307.256 2.853 5 40 DFBB CC(=O)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 180253 BXAFWSDZHMBUEV-UHFFFAOYSA-N 320.326 2.598 5 40 DFBB CCCCCC(=O)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 8902429 VFMDFMINJMSNNF-UHFFFAOYSA-N 321.377 2.950 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-] 9114050 UGVIMKPRSVJGRL-HNNXBMFYSA-N 314.297 2.682 5 40 DFBB Cc1nc(S)sc1CC(=O)NCc1ccccc1[N+](=O)[O-] 56876407 VOSXEZIZKYHROV-UHFFFAOYSA-N 323.399 2.507 5 40 DFBB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1 76089462 UBDWHRPPAKTWTH-MJBXVCDLSA-N 319.361 2.920 5 40 DFBB Cc1ccc(NC(=O)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] 14207033 RDYZSYZIQPCOJN-JOCHJYFZSA-N 318.354 2.893 5 40 DFBB COC(=O)c1cc(N(C)Cc2nccs2)cc(C)c1[N+](=O)[O-] 95416563 ATKBPSHYJDNOQO-UHFFFAOYSA-N 321.358 2.783 5 40 DFBB COC(=O)c1oc([C@H](C)Oc2cccnc2[N+](=O)[O-])cc1C 128353871 JDHGGPLKLXZGRE-VIFPVBQESA-N 306.274 2.818 5 40 DFBB Cc1ccc(C(=O)Nc2cccc(C(=O)O)c2)cc1[N+](=O)[O-] 5754067 CBVRFFIUACXESD-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB Cc1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])sc1-c1ccccc1 44492451 PEOQSCKWJAIQNQ-GHMZBOCLSA-N 303.343 2.722 5 40 DFBB CCCn1c(CC)nc2sc3ccccc3c(=O)c2c1=O 2325036 UFQCEMZCHPEYGK-UHFFFAOYSA-N 300.383 2.944 5 40 DFBB CC(=O)c1cccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)c1 8156861 XMCSAQUXLDHJNF-UHFFFAOYSA-N 320.326 2.598 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@@H](C)NC(=O)[C@@H](C)OCC1CC1 71830667 KCIHECUTHOOUNT-GHMZBOCLSA-N 322.361 2.596 5 40 DFBB Cc1ccc(-c2nc(Cn3cccc([N+](=O)[O-])c3=O)cs2)o1 58342507 HJKYSFGFTUBJIF-UHFFFAOYSA-N 317.326 2.830 5 40 DFBB Cc1cc(OC(=O)c2cc3ccccc3o2)c([N+](=O)[O-])c(=O)[nH]1 4248405 WMMUZFPLYGJICO-UHFFFAOYSA-N 314.253 2.557 5 40 DFBB CC(C)CCNC(=O)c1ccc2nc3ccccc3c(=O)n2c1 57477654 YEWUBDXCZJFYBQ-UHFFFAOYSA-N 309.369 2.624 5 40 DFBB Cc1c(C(=O)Nc2ccccc2C(=O)O)cccc1[N+](=O)[O-] 5378381 WKAXJQBQVLHNQP-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB C[C@@H](Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCc2ccccc21 8192898 WTDGDKVNMQLNHH-GFCCVEGCSA-N 311.341 2.985 5 40 DFBB CN(CCC1CC1)C(=O)c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1 97108266 LYOIEACLHDVNGN-UHFFFAOYSA-N 314.345 2.857 5 40 DFBB Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1 72314790 TZXQQYGTOHTBHG-NSHDSACASA-N 305.359 2.972 5 40 DFBB CSc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)ccn1 69559054 KIFWVOBZSBXBNJ-UHFFFAOYSA-N 303.343 2.988 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3ccccc3Cl)CC2)nc1 23701542 DDQIDQUAUAINCD-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB Cc1nn(C)cc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 71899701 PHHBYZVRGFRGPL-QMMMGPOBSA-N 322.752 2.781 5 40 DFBB CCn1nc(C)cc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 75127469 LUWOZPSOGIULTI-NSHDSACASA-N 314.345 2.711 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccccn1 55514828 PUBBMVJTNCVBKQ-MRXNPFEDSA-N 311.341 2.896 5 40 DFBB COc1ccc(/C=C2\N=C(c3ccco3)OC2=O)cc1[N+](=O)[O-] 3148149 ZNPLGMOBJQKAQZ-YFHOEESVSA-N 314.253 2.541 5 40 DFBB C[S@@](=O)CCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 69743020 LPEJCUKAXYYVGO-FQEVSTJZSA-N 310.297 2.794 5 40 DFBB Cc1ccc(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 1644311 KOXMAUXVIHRQAH-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB CCOc1ccc(NC(=O)c2c(C)noc2C)c([N+](=O)[O-])c1 61997288 IGPRHOOIMGJGLV-UHFFFAOYSA-N 305.290 2.851 5 40 DFBB COc1cc(/C=C\c2onc(C)c2[N+](=O)[O-])cc([N+](=O)[O-])c1O 408545374 YJDODEBEWXUKTN-ARJAWSKDSA-N 321.245 2.684 5 40 DFBB CCN(C(=O)CNc1ccccc1[N+](=O)[O-])c1nc(C)cs1 74063613 DLVXHXNYKYGTEK-UHFFFAOYSA-N 320.374 2.825 5 40 DFBB CC(=O)c1ccccc1C(=O)NCCc1ccccc1[N+](=O)[O-] 74067164 RMHRJYWESKSTQG-UHFFFAOYSA-N 312.325 2.770 5 40 DFBB Cc1cc(Br)c(N2CCOCC2)c([N+](=O)[O-])c1 45957703 MVOCHXBQZAZZBL-UHFFFAOYSA-N 301.140 2.502 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)N1CCC[C@@H](C)C1 229860057 WVFRDXIHUPDJRX-DGCLKSJQSA-N 305.378 2.962 5 40 DFBB Cc1ccc(OCC(=O)N[C@H]2CCC[C@@H](C)[C@@H]2C)c([N+](=O)[O-])n1 5970486 KDJZMDIWLKLBRR-WXHSDQCUSA-N 321.377 2.618 5 40 DFBB O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccno1 10253834 IBAPHQVNZZYWOC-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB COC(=O)[C@@H](C)OC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 8401550 NZRDQIDKBVTMRQ-SECBINFHSA-N 319.269 2.573 5 40 DFBB COC(=O)c1ccc([N+](=O)[O-])c(NCc2scnc2C)c1 96007367 FGKCNMRHBWLCJX-UHFFFAOYSA-N 307.331 2.758 5 40 DFBB O=C(NC[C@H]1CCCS1)c1cc(Cl)ccc1[N+](=O)[O-] 96462156 DFLFEZCWUZRAON-SECBINFHSA-N 300.767 2.874 5 40 DFBB C[C@H](OC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])c1ccc(OC(F)F)cc1 71830276 HMDWLQHPEJXKDE-XROYCOCOSA-N 301.245 2.557 5 40 DFBB Cc1cc(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)n(C)n1 97047021 PWGHDWBRAOQNQZ-UHFFFAOYSA-N 309.709 2.647 5 40 DFBB COc1ccc(/C=C\c2onc(C)c2[N+](=O)[O-])cc1[N+](=O)[O-] 408543677 PZQUXTCGPVBALF-XQRVVYSFSA-N 305.246 2.978 5 40 DFBB Cc1c(C(=O)N(C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)cccc1[N+](=O)[O-] 245344092 XKBMCULFPFPLRP-BPLDGKMQSA-N 318.373 2.789 5 40 DFBB C[C@H](OC(=O)[C@@H]1CC=CC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 248319079 PPTUBSSINJWZBK-ZLKJLUDKSA-N 319.313 2.866 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1cccnc1Cl 5675472 PPAZRCUWEJVXQS-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@@H](C)C2)n1 5163886 JFXKQUVPZMIDHL-OUAUKWLOSA-N 322.413 2.660 5 40 DFBB CC[C@@H](Oc1ccc(C)cc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 14189287 ZLMYNPGKMIAZPS-GFCCVEGCSA-N 319.317 2.996 5 40 DFBB C[C@@H](O)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 97232712 AHQMFJZVVKNFDX-RNCFNFMXSA-N 312.753 2.624 5 40 DFBB Cc1nnc(SC[C@H](O)c2cccc([N+](=O)[O-])c2)n1C1CC1 95432526 WFHRZGPCHSCRNU-ZDUSSCGKSA-N 320.374 2.655 5 40 DFBB O=[N+]([O-])c1cnn(CCN2CCS[C@@H](c3ccccc3)C2)c1 95963082 CDZGQKUKLPAVPR-OAHLLOKOSA-N 318.402 2.581 5 40 DFBB O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cnc2ccccc2n1 79550010 SMRILOBQKFBCIC-UHFFFAOYSA-N 308.297 2.719 5 40 DFBB Cc1noc(/C=C/c2cc3c(cc2[N+](=O)[O-])OCO3)c1[N+](=O)[O-] 408543295 NUKFGQDPBUTZMZ-NSCUHMNNSA-N 319.229 2.699 5 40 DFBB Cc1c([N+](=O)[O-])cc(C(=O)N2CCCCCC2)cc1[N+](=O)[O-] 2056247 HVGZUZKKILXTGJ-UHFFFAOYSA-N 307.306 2.828 5 40 DFBB biogenic N[C@@H](c1ccc(F)cc1)c1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 95533251 OCBVFCQKQMXAMA-ZDUSSCGKSA-N 313.292 2.567 5 40 DFBB CC(C)n1c(=O)n(C(C)C)c2cc([N+](=O)[O-])c([N+](=O)[O-])cc21 5003737 BRHIAQOKZFIYBQ-UHFFFAOYSA-N 308.294 2.781 5 40 DFBB Cc1noc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1 25374380 VPFBATKAGAINCP-UHFFFAOYSA-N 319.298 2.858 5 40 DFBB CCO[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 96007639 HUUGJYLAYMYLSH-ZETCQYMHSA-N 306.240 2.977 5 40 DFBB CC1=NN(c2ccccc2)C(=O)[C@H]1C(=O)c1ccc([N+](=O)[O-])cc1 100507434 QHRMOZIIQNCORN-OAHLLOKOSA-N 323.308 2.816 5 40 DFBB CCOc1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 295577 DUXJTMOVMHPYAS-UHFFFAOYSA-N 312.281 2.794 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1 1993768 UFNILELZHTZIHG-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cc1ccc(O[C@H](C)C(=O)N(C)c2ccccc2)c([N+](=O)[O-])n1 4892069 NGBYHJTWATUFBA-GFCCVEGCSA-N 315.329 2.729 5 40 DFBB Cc1c(C(=O)Nc2cccnc2-n2cccn2)cccc1[N+](=O)[O-] 23177336 DHFARVHCRNEHAZ-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB CCN(CC)c1nc(N)c([N+](=O)[O-])c(Nc2ccccc2F)n1 5054776 FWPIHVQVZZMZIZ-UHFFFAOYSA-N 320.328 2.696 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1[N+](=O)[O-] 4506328 UWELNCQEJZBOHT-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 5618200 IOCVTBDTUSMFMC-NEPJUHHUSA-N 304.302 2.509 5 40 DFBB CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1C[C@H]2CCCC[C@@H]2C1 195576750 IUPDFKSMGCABIG-VXGBXAGGSA-N 324.402 2.625 5 40 DFBB C[C@@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccsc1 97237114 OATGUMLDTVUJSX-VIFPVBQESA-N 306.343 2.895 5 40 DFBB Cc1nc(N2CCCCC2)nc(N2CCCCC2)c1[N+](=O)[O-] 4705780 QZCRGPBGOAUZBK-UHFFFAOYSA-N 305.382 2.674 5 40 DFBB CN(C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccsc1 12348373 LEVGDXPDDIJJQT-AWEZNQCLSA-N 319.386 2.689 5 40 DFBB O=[N+]([O-])c1ccc(NCCNCc2ccccn2)c(Cl)c1 7365296 SLAYIFWWMUZUSE-UHFFFAOYSA-N 306.753 2.845 5 40 DFBB CCCCOC(=O)c1cc([N+](=O)[O-])c(N(C)C)c([N+](=O)[O-])c1 4358848 GNLJFUYMSKGSRM-UHFFFAOYSA-N 311.294 2.526 5 40 DFBB CC(C)(NCc1nc(C2CC2)no1)c1ccc([N+](=O)[O-])cc1 195550090 KJXDZPXXEFLLIX-UHFFFAOYSA-N 302.334 2.880 5 40 DFBB Cc1c(N(C)S(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-] 224918728 JZOGKEYBXVZREO-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB C[C@@]1(c2cccs2)NC(=S)N(c2ccc([N+](=O)[O-])cc2)N1 225343270 YRWKREQHVVFCSU-CYBMUJFWSA-N 320.399 2.728 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@]2(c3ccc([N+](=O)[O-])cc3)O[C@H]2C1 242522252 INXVAUGPWTYTKB-XJKSGUPXSA-N 320.345 2.830 5 40 DFBB Cc1nc2ccccc2n1CCNC(=O)c1cccc([N+](=O)[O-])c1 8134410 SZLYWKLQOYRVTC-UHFFFAOYSA-N 324.340 2.683 5 40 DFBB C[C@H](O)CC(C)(C)CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] 87422594 ZXKLHJBFNXFXQV-VIFPVBQESA-N 314.769 2.775 5 40 DFBB C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] 78556540 ABEGTQJLWHFYNH-ZLKJLUDKSA-N 315.329 2.736 5 40 DFBB CN(Cc1cscn1)Cc1nc2cc([N+](=O)[O-])ccc2o1 83169334 SLXDHHSACUBUKY-UHFFFAOYSA-N 304.331 2.825 5 40 DFBB C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)Nc1ccccc1 96449979 DOUSMKAKZHFAAK-LLVKDONJSA-N 315.329 2.531 5 40 DFBB C/C=C/C=C/C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 20854160 SCHSWEYEZMGQQN-NVLXPRRZSA-N 304.302 2.597 5 40 DFBB O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)NCCN=C2c1ccccc1 4018202 YDCUUSHKWPAOTM-UHFFFAOYSA-N 312.285 2.766 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nnc(N2CCCCC2)s1 58173341 GGOLXRKYGMDIOY-UHFFFAOYSA-N 323.403 2.983 5 40 DFBB CN(Cc1ccco1)C(=O)COc1ccc([N+](=O)[O-])cc1Cl 6062491 NIRQLLNTNWRZEK-UHFFFAOYSA-N 324.720 2.879 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1OC 5361850 DBWBEYNFQNFZRT-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CN1CC2(Cc3cc([N+](=O)[O-])ccc31)C(=O)CC(C)(C)CC2=O 9060803 UUKLAVDBSWRVGI-UHFFFAOYSA-N 316.357 2.532 5 40 DFBB CSc1nnc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)s1 40970514 RXSRLIICRYTTPZ-AATRIKPKSA-N 322.371 2.820 5 40 DFBB O=C(Nc1cccc(CNc2ncccc2[N+](=O)[O-])c1)C1CC1 22226739 XYIURQAYWAMBBI-UHFFFAOYSA-N 312.329 2.950 5 40 DFBB O=[N+]([O-])c1cccc(CN2CCN([C@H]3C[C@@H]4CC[C@@H]3C4)CC2)c1 100802226 LYSZMVOIADELTI-KYJSFNMBSA-N 315.417 2.901 5 40 DFBB C[S@](=O)Cc1ccccc1NC(=O)c1ccccc1[N+](=O)[O-] 97139742 VNSGMZPDZMHUTA-JOCHJYFZSA-N 318.354 2.726 5 40 DFBB O=C(COc1cccc(Cl)c1)NCc1ccc([N+](=O)[O-])cc1 1619295 OPYRMIXOYQHGEP-UHFFFAOYSA-N 320.732 2.943 5 40 DFBB CC(C)(O)CN(C(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 1710468 BWMPAYRZCIJGAY-UHFFFAOYSA-N 306.362 2.751 5 40 DFBB CC1=CC[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3F)C(=O)[C@@H]2C1 102553600 OTMTWADLLSVKQZ-WDEREUQCSA-N 304.277 2.580 5 40 DFBB CS[C@@H]1CCC[C@@H]1N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 108360374 VIGZCXGIFZTHTL-SOUVJXGZSA-N 310.419 2.844 5 40 DFBB O=c1c2cnc3cc(C(F)(F)F)ccc3c2sc2nncn12 19796894 KJYLPKAUPPFQHN-UHFFFAOYSA-N 322.271 2.871 5 40 DFBB COC1CCC(N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 87298205 CGAHXXPQULJPBT-UHFFFAOYSA-N 320.389 2.943 5 40 DFBB COc1ccc(C(=O)O)cc1NC(=O)c1cccc([N+](=O)[O-])c1 20140832 IQRDLZNJUMPJBR-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@@H]2C12CC2 4380086 XTOIUIXMPLPZLM-NEBZKDRISA-N 324.336 2.605 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cnn(-c2ccccn2)c1 72292533 BHQQEOROEJVRML-UHFFFAOYSA-N 324.300 2.820 5 40 DFBB O=[N+]([O-])c1cnc2c(c1)CN(Cc1cc(F)cc(F)c1)CC2 225464195 KRSCVJORXYRNKD-UHFFFAOYSA-N 305.284 2.826 5 40 DFBB C[C@H](Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCc2ccccc21 8192894 WTDGDKVNMQLNHH-LBPRGKRZSA-N 311.341 2.985 5 40 DFBB O=C(NC(=S)Nc1ccccc1)c1cccc([N+](=O)[O-])c1 579017 VODZHYNDOQGWQS-UHFFFAOYSA-N 301.327 2.722 5 40 DFBB COc1ccc([C@@H]2CCCCCN2C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])cc1 44372926 BLQLNMFULDYFFU-PMPSAXMXSA-N 318.373 2.804 5 40 DFBB O=[N+]([O-])c1ccc(NCc2nc(-c3ccc(F)cc3)n[nH]2)nc1 69588689 TVIUEVXHEYWVLI-UHFFFAOYSA-N 314.280 2.526 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nc2c(s1)CCC2 6526682 ULKYXCKFIPUFNJ-UHFFFAOYSA-N 303.343 2.721 5 40 DFBB Cc1nn(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1C 69617707 LJEOYZOMHMLXHU-UHFFFAOYSA-N 308.725 2.851 5 40 DFBB O=C(OCCCc1ccncc1)c1ccc(F)cc1[N+](=O)[O-] 95965081 AYYRTODFFXGSIZ-UHFFFAOYSA-N 304.277 2.919 5 40 DFBB Cc1nnc([C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])o1 89736293 UKWVPEJGBMYGSA-CYBMUJFWSA-N 318.333 2.502 5 40 DFBB NC(=O)c1cc([N+](=O)[O-])ccc1OCc1ccccc1Cl 226319109 UEKBBNOWLNFWCK-UHFFFAOYSA-N 306.705 2.926 5 40 DFBB C[C@H]1CCC[C@@](O)(CNc2nc3sccn3c2[N+](=O)[O-])C1 65566749 BUXXNDOIEOBXDL-ZANVPECISA-N 310.379 2.657 5 40 DFBB O=C(O[C@@H]1C[C@H]2CC[C@@H]1C2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5409703 WGQVYOZJPJVTHR-IGJMFERPSA-N 306.274 2.848 5 40 DFBB O=C(Oc1ccccc1)n1c(=O)oc2cc([N+](=O)[O-])ccc21 491453 ZNMNDFYCWQGPKP-UHFFFAOYSA-N 300.226 2.550 5 40 DFBB Cc1cccc(C(=O)Nc2n[nH]c(-c3ccco3)n2)c1[N+](=O)[O-] 12978063 CKRQTKQPDVSDJH-UHFFFAOYSA-N 313.273 2.534 5 40 DFBB CN(Cc1cccs1)C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 5899090 GJEHMGMVUQFEJV-UHFFFAOYSA-N 319.386 2.995 5 40 DFBB Cc1ccc(CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 8770618 OFHSZTNMTNGLCD-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB Cn1c(Sc2ncccc2[N+](=O)[O-])nnc1-c1ccccc1 9192223 BRKHNKMDOGRAPT-UHFFFAOYSA-N 313.342 2.937 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)C2CCCCC2)c1 95962366 UCFISEQQLQRMBV-HNNXBMFYSA-N 306.362 2.574 5 40 DFBB O=C(c1ccccc1Cl)n1c(=O)oc2cc([N+](=O)[O-])ccc21 360930 LWCYTIJTNGPBKW-UHFFFAOYSA-N 318.672 2.845 5 40 DFBB CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(O)cc1 52962612 ULPCOSHLMQFCAB-UHFFFAOYSA-N 315.329 2.614 5 40 DFBB Cc1ccc(C2=NN[C@H]3CC(C)(C)CC(=O)[C@H]23)cc1[N+](=O)[O-] 228922871 ZEORXFZIUKHHGJ-SMDDNHRTSA-N 301.346 2.584 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1ccc(Cl)cc1[N+](=O)[O-] 4121658 KAHSFYVVEJYGAL-OZVVPTBGSA-N 318.716 2.560 5 40 DFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)OCO2 2626237 OQIYCKSIEZQBLM-VMPITWQZSA-N 312.281 2.975 5 40 DFBB O=[N+]([O-])c1ncn(Cc2coc(-c3cccc(Cl)c3)n2)n1 53835987 RULHRDVSKIXJSO-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1Nc1cnn(C[C@@H]2CCCO2)c1 43272481 IGNKPWCVYVWBNW-LBPRGKRZSA-N 306.297 2.853 5 40 DFBB CCCC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5077096 IKXAQXRYLFTPAZ-UHFFFAOYSA-N 300.698 2.530 5 40 DFBB COc1ccc(O)c(C(=O)OCc2ccc([N+](=O)[O-])cc2)c1 19075516 VWSLOEXRCLWALA-UHFFFAOYSA-N 303.270 2.666 5 40 DFBB CCN(Cc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cn1 25072670 WDJSJDJBXQGFOM-UHFFFAOYSA-N 315.329 2.788 5 40 DFBB O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCCCCCC2)cc1 32804253 UVKQIYPOBPGHLU-UHFFFAOYSA-N 312.391 2.691 5 40 DFBB CCCc1cc(C(=O)N(C)Cc2cccc([N+](=O)[O-])c2)[nH]n1 25255535 ALTXJKWXKMNHDW-UHFFFAOYSA-N 302.334 2.543 5 40 DFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1c(F)cccc1F 61997398 DCUZROOWONKISW-UHFFFAOYSA-N 304.208 2.674 5 40 DFBB CCc1cc2nncn2c(SCc2ccccc2[N+](=O)[O-])n1 390833633 KPJQEZVTXCCWHR-UHFFFAOYSA-N 315.358 2.887 5 40 DFBB CCOc1ccc(-c2nn3cnc4ccccc4c3nc2=O)cc1 58047015 VHMSKQPMGZSDKH-UHFFFAOYSA-N 318.336 2.703 5 40 DFBB COC(=O)c1sccc1N/C=C/c1onc(C)c1[N+](=O)[O-] 100278052 QMMWVUYCWVCICA-HWKANZROSA-N 309.303 2.822 5 40 DFBB Cc1ccc(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 3388442 ALOCSHADPMQOPR-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB O=c1nc2c3ccccc3nc(S)n2nc1Cc1ccccc1 32937936 CUFIIJRLASQQAU-UHFFFAOYSA-N 320.377 2.517 5 40 DFBB CCOC(=O)c1cc(N(C)Cc2nccs2)ccc1[N+](=O)[O-] 95412118 LCKGBINYKRFZPR-UHFFFAOYSA-N 321.358 2.864 5 40 DFBB O=[N+]([O-])c1cn(Cc2cccc(OCC(F)(F)F)c2)cn1 79825492 IVNSSJWJXBXSPU-UHFFFAOYSA-N 301.224 2.781 5 40 DFBB O=C(c1cn[nH]c1-c1ccc([N+](=O)[O-])cc1)N1CCCCC1 72328731 CDEUMZGXBNSYJM-UHFFFAOYSA-N 300.318 2.611 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCN([C@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 4724495 PGHIRDZUMYBGEF-JZXOWHBKSA-N 315.417 2.901 5 40 DFBB CCN(CCn1c(C)csc1=O)Cc1cccc([N+](=O)[O-])c1 58304911 WKPRKOCTWNRHAR-UHFFFAOYSA-N 321.402 2.649 5 40 DFBB C[C@H](O)C[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139634030 BACPTLQCQOAGTM-ONGXEEELSA-N 312.753 2.624 5 40 DFBB CC(=O)N1CC[C@@H](CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 97233692 YITRCDXXCWDSGP-ZFWWWQNUSA-N 319.405 2.764 5 40 DFBB Cc1ccc(NC(=O)c2cc(=O)[nH]c3ccccc23)cc1[N+](=O)[O-] 23243718 OHSVQMULKLLFEV-UHFFFAOYSA-N 323.308 2.997 5 40 DFBB CCN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 305120 NPJNXMOLTGZEHG-UHFFFAOYSA-N 306.343 2.810 5 40 DFBB CO[C@]1(C)C[C@@H](N(C)c2nc3ccccn3c2[N+](=O)[O-])C1(C)C 76093039 XZTMPNXCENHCTB-BDJLRTHQSA-N 318.377 2.882 5 40 DFBB CN1C(=O)[C@@]2(CCN[C@H]2c2ccc([N+](=O)[O-])cc2)c2ccccc21 19703125 HXHRRCNUZRAENO-WMZOPIPTSA-N 323.352 2.544 5 40 DFBB biogenic O=[N+]([O-])c1cccc(CS(=O)(=O)NCCC2=CCCCC2)c1 44947935 OBBCIENWKWSUCQ-UHFFFAOYSA-N 324.402 2.905 5 40 DFBB CCOc1ccc(-c2ccc(C(=O)NC(C)=O)o2)c([N+](=O)[O-])c1 85346816 LQXFKUSBEKJZNV-UHFFFAOYSA-N 318.285 2.530 5 40 DFBB O=C1[C@@H](SC2=NCCS2)CCN1c1cccc([N+](=O)[O-])c1 67428289 DRHFVEVUDJKGJB-NSHDSACASA-N 323.399 2.536 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)N1CCC[C@H](C)C1 4902656 WVFRDXIHUPDJRX-AAEUAGOBSA-N 305.378 2.962 5 40 DFBB CC(C)CCNc1nc(N)c([N+](=O)[O-])c(N2CCC[C@H](C)C2)n1 5164052 IXGLTKDEKSLSDZ-NSHDSACASA-N 322.413 2.661 5 40 DFBB Cc1c(C(=O)N2CCCC[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 6417921 YVQDPEFTDCGICW-SECBINFHSA-N 307.306 2.826 5 40 DFBB CC(C)O[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C 95944404 KATSGQSXKOUDBX-KBPBESRZSA-N 306.362 2.917 5 40 DFBB Cc1c(CC(=O)N(C)Cc2ccc(O)cc2)cccc1[N+](=O)[O-] 195544384 OZJILEKKCPGLAT-UHFFFAOYSA-N 314.341 2.810 5 40 DFBB O=[N+]([O-])c1ccc(Sn2cnc3c(S)ncnc32)cc1 16429315 KXGHMWNGMMEQKY-UHFFFAOYSA-N 305.344 2.579 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])cnc1-c1nc2ccccc2s1 16739584 YFQNOXODFPBSLI-UHFFFAOYSA-N 301.283 2.965 5 40 DFBB COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c(OC)c1 5513276 GKSSIVHJZBICRF-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CN[C@H](C(=O)c1ccccc1)[C@H](OC)c1cccc([N+](=O)[O-])c1 57256229 XRTRVAKJWCIIMD-NVXWUHKLSA-N 314.341 2.753 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCc2ccccc21 3538072 MVSBVGDAUCNSHK-UHFFFAOYSA-N 311.341 2.904 5 40 DFBB Cc1nn(CC(=O)N(C2=CCCCC2)C2CC2)c(C)c1[N+](=O)[O-] 7427407 DJNLVBSVDXCPIR-UHFFFAOYSA-N 318.377 2.857 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(NCc2c(C)cc(C)[nH]c2=O)c1 75094677 YNIFWHSDHYBFQZ-UHFFFAOYSA-N 321.308 2.660 5 40 DFBB CCOC(=O)[C@H]1CCCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])C1 46341161 JHZZDUSQCZQSPK-ZDUSSCGKSA-N 320.345 2.577 5 40 DFBB CCN(C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CCCCC1 1473293 ZDFNYMIILZNFRU-HNNXBMFYSA-N 322.405 2.989 5 40 DFBB Cc1ccc(S(=O)(=O)N2C[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 4844418 KBNDEGGNKFKUEN-AAFJCEBUSA-N 318.354 2.649 5 40 DFBB CNC(=O)c1ccc(OCc2c(F)cccc2[N+](=O)[O-])cc1 69744297 DLHBBKBYZNUNOC-UHFFFAOYSA-N 304.277 2.673 5 40 DFBB Cc1ccc(C(=O)NCCN(C)c2ccccc2)cc1[N+](=O)[O-] 10113697 SGCHHWPYESRFHY-UHFFFAOYSA-N 313.357 2.769 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nnc2[nH]c3ccccc3n12 22530151 DGBHUTBMJPTIFX-UHFFFAOYSA-N 312.314 2.665 5 40 DFBB CCCNC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 8883737 RELOIXHIGIMIIC-UHFFFAOYSA-N 316.361 2.596 5 40 DFBB CCOC1=Nc2ccccc2N(c2ccc([N+](=O)[O-])cn2)CN1 38344198 VAKBOACHPMBLNP-UHFFFAOYSA-N 313.317 2.713 5 40 DFBB O=C(NCCCNc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1 79353845 CYCXDVKBHAJBJW-UHFFFAOYSA-N 315.329 2.532 5 40 DFBB NC(=S)c1ccsc1NC(=O)c1ccc([N+](=O)[O-])cc1 12421528 JMBNWQIBBFDNLD-UHFFFAOYSA-N 307.356 2.543 5 40 DFBB COc1ccc(OCCOc2ccc(C)nc2[N+](=O)[O-])cc1 8687528 RBCUVQVROOQHQC-UHFFFAOYSA-N 304.302 2.765 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCn1cccn1 84147833 DSGRFCCQIHFDKL-UHFFFAOYSA-N 317.349 2.620 5 40 DFBB CSC[C@H](C)N(C)C(=O)c1cc(F)cc(C)c1[N+](=O)[O-] 95415256 ALJBIPMXDGLUOD-VIFPVBQESA-N 300.355 2.866 5 40 DFBB Cc1cc(NC(=O)N2CC[C@@H]3OCCC[C@H]3C2)ccc1[N+](=O)[O-] 97095985 GJCOYWCVWGYGKW-WFASDCNBSA-N 319.361 2.936 5 40 DFBB CC[N+]1(C[C@H](O)COC23CC4CC(CC(C4)C2)C3)CCCC1 17316928 HCYKKJUJBVRMGF-NNGLDNROSA-N 308.486 2.963 5 40 DFBB CCCCn1c(CCC)nc([N+](=O)[O-])c1Sc1ncn[nH]1 5501811 LJWVNKIHSXXNFR-UHFFFAOYSA-N 310.383 2.813 5 40 DFBB CC1(C)[C@]2(C(=O)Nc3ccccc3[N+](=O)[O-])CC[C@@]1(C)C(=O)O2 4135348 XXWHHFVELSAZAJ-JKSUJKDBSA-N 318.329 2.655 5 40 DFBB O=C(Oc1c([N+](=O)[O-])cccc1[N+](=O)[O-])C1[C@H]2CCCC[C@H]12 100639936 YEIHKLUYLWIVOO-IUCAKERBSA-N 306.274 2.845 5 40 DFBB COc1ccc(C)nc1NC(=O)c1cc([N+](=O)[O-])c(C)s1 84147864 ALMYNGGUZPUOAO-UHFFFAOYSA-N 307.331 2.929 5 40 DFBB CCc1ccccc1NC(=O)CNc1ccc([N+](=O)[O-])cn1 23673340 VVIUXDMLFAGUID-UHFFFAOYSA-N 300.318 2.603 5 40 DFBB O=C1OCCN1c1cc([N+](=O)[O-])ccc1NCc1ccco1 84432789 OHFVJTVOZWAOOS-UHFFFAOYSA-N 303.274 2.757 5 40 DFBB O=c1[nH]c(O)nc(/C=C\c2cccc3ccccc23)c1[N+](=O)[O-] 33926541 LKJXKHFLDVGUOQ-HJWRWDBZSA-N 309.281 2.707 5 40 DFBB O=C(Nc1ccc(-c2ccco2)cc1F)c1n[nH]cc1[N+](=O)[O-] 390835410 MUSACBCIICNRKI-UHFFFAOYSA-N 316.248 2.969 5 40 DFBB O=[N+]([O-])c1cnc(N(CCO)Cc2ccsc2)c(Cl)c1 78427944 FETOVGFYCHPGCR-UHFFFAOYSA-N 313.766 2.704 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccccc1[N+](=O)[O-] 15411185 JZDRTBAFXCAEFO-UHFFFAOYSA-N 315.285 2.993 5 40 DFBB Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCCCCCN(C)C 65493867 PHYFUDCCLKKSIW-UHFFFAOYSA-N 322.409 2.540 5 40 DFBB COc1ccccc1NC(=O)CNc1cc([N+](=O)[O-])ccc1C 8720602 HGLNIFLFOLHKTG-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB CN(Cc1ccccn1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 95977792 PYDLXYDLHXKKBK-UHFFFAOYSA-N 305.721 2.915 5 40 DFBB Cc1[nH]nc(C(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)c1[N+](=O)[O-] 75388520 ITHFAMVPANDFBE-MWLCHTKSSA-N 318.333 2.833 5 40 DFBB CCN(CC)C(=O)[C@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 4182322 UDVDKLWQHCSBQO-ZDUSSCGKSA-N 305.378 2.680 5 40 DFBB C[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 10434958 KXNARZPBMNWEOT-JTQLQIEISA-N 316.313 2.716 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2noc3ccccc23)cc1 7363542 GGDMNEAXEXIIQW-UHFFFAOYSA-N 319.298 2.537 5 40 DFBB COc1ccc2[nH]c3c(c2c1)CCN[C@H]3c1ccc([N+](=O)[O-])o1 19874123 XQXQYIIUQFRGRJ-INIZCTEOSA-N 313.313 2.913 5 40 DFBB COc1cc(NCCc2nccn2C(F)F)ccc1[N+](=O)[O-] 95403175 FJBCDDDULWVXCW-UHFFFAOYSA-N 312.276 2.850 5 40 DFBB Cc1ncc([N+](=O)[O-])n1C[C@@H](C)C(=O)c1ccc(F)c(F)c1 97378361 JKTWEVDZKIYUIB-MRVPVSSYSA-N 309.272 2.897 5 40 DFBB CC[C@H]1CCCCN1C(=O)CSc1[nH]nc(C)c1[N+](=O)[O-] 249620 LEVDTFAPJPTPPZ-JTQLQIEISA-N 312.395 2.510 5 40 DFBB COc1cc(OCc2ccccc2)c(CC(=O)O)c([N+](=O)[O-])c1 1727775 LWNBRUJIFHTMSR-UHFFFAOYSA-N 317.297 2.810 5 40 DFBB COc1ccc2c(c1OC)C(=O)N(c1cccc([N+](=O)[O-])c1)C2 492716 LTZLSSMGRZFQQP-UHFFFAOYSA-N 314.297 2.772 5 40 DFBB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1cccc([N+](=O)[O-])c1)OC2=O 100261009 HFAXFXXFEHQVNB-HOTGVXAUSA-N 318.329 2.655 5 40 DFBB O=C(N[C@H]1CCOc2ccccc21)c1ccc(F)c([N+](=O)[O-])c1 7312721 PSWCFOOQRZNVBT-ZDUSSCGKSA-N 316.288 2.988 5 40 DFBB CC[C@@]1(C)CCCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1 97114149 ADJALBZEOXPNNF-HNNXBMFYSA-N 306.366 2.614 5 40 DFBB O=C(CCC(=O)NC1CCCCC1)Nc1ccccc1[N+](=O)[O-] 199426423 YQPOKGDLSXVSED-UHFFFAOYSA-N 319.361 2.762 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N(C)S(=O)(=O)c1cccs1 225136764 MNWLBQWCWCYTPD-UHFFFAOYSA-N 312.372 2.790 5 40 DFBB O=c1c2ccccc2ncn1-c1ccc(Cl)cc1[N+](=O)[O-] 362372 SPKMBUJSSVOJFN-UHFFFAOYSA-N 301.689 2.947 5 40 DFBB Cc1c(NC(=O)[C@H](C)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] 46306978 IPOIJYWKLYQXMX-JTQLQIEISA-N 323.349 2.755 5 40 DFBB O=C(NCCOc1ccc([N+](=O)[O-])cc1)NCc1cccs1 69038403 NPXUSQMNSZLFOZ-UHFFFAOYSA-N 321.358 2.535 5 40 DFBB Cc1[nH]nc(C(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)c1[N+](=O)[O-] 75388522 ITHFAMVPANDFBE-KOLCDFICSA-N 318.333 2.833 5 40 DFBB O=C1N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)N1Cc1ccccc1 409194826 CNHPAUWJVKLHKN-XNTDXEJSSA-N 323.308 2.688 5 40 DFBB CO[C@@H](C)CC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 97378958 PRMMUSSEYHUIPI-JTQLQIEISA-N 303.318 2.815 5 40 DFBB CN[C@@H](COC(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 5605316 BDAIIJHUCROYRN-HNNXBMFYSA-N 306.362 2.920 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CCNC(=O)Nc1ccc(Cl)cc1 20030986 DSLNYNCHIXBBGW-UHFFFAOYSA-N 323.740 2.575 5 40 DFBB CCN(c1cccnc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C 103495161 XADFFLDZUUCTAV-UHFFFAOYSA-N 321.358 2.513 5 40 DFBB CCN(c1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CCCC1 96501499 KWZGPYDDVOGUGW-UHFFFAOYSA-N 318.420 2.829 5 40 DFBB COc1ccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1 70874 DXIJPQUYRDSLOL-OQLLNIDSSA-N 324.292 2.948 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCc2ccccc21 10960209 FLIQAKSSDPEVNJ-CQSZACIVSA-N 312.325 2.777 5 40 DFBB Cn1cc(/C=C/c2ccc([N+](=O)[O-])cn2)c(-c2ccncc2)n1 95964516 VJCVQKXQNUFNIY-NSCUHMNNSA-N 307.313 2.956 5 40 DFBB O=C(O)[C@@H](Cc1cccc([N+](=O)[O-])c1)OCc1ccccc1 225127406 IKNICHMYWZWCCQ-OAHLLOKOSA-N 301.298 2.807 5 40 DFBB Cc1cccc(N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 194624884 AZONNTRCZQZGDL-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB C[C@H]1CCO[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 225574909 HELIPBIJOPGYHV-XPTSAGLGSA-N 301.302 2.507 5 40 DFBB COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 183749 GCRZRAYVJVVLMU-UHFFFAOYSA-N 300.314 2.842 5 40 DFBB biogenic Cc1c(NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] 46306975 IPOIJYWKLYQXMX-SNVBAGLBSA-N 323.349 2.755 5 40 DFBB COc1ccc(N(C)C(=O)CCc2cccc([N+](=O)[O-])c2)cn1 83869476 PJHHFDISFFVAHV-UHFFFAOYSA-N 315.329 2.594 5 40 DFBB Cc1cc(C)c(OCC(=O)N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 9725479 CRCOPJLAOMOIMZ-LLVKDONJSA-N 306.362 2.849 5 40 DFBB Cc1ccc(NS(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)cc1 226863048 OTGRYQYMWRRMCJ-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB COCc1cc([N+](=O)[O-])ccc1NC(=O)Cc1cccs1 96461704 UQFLTJSFVAZXAD-UHFFFAOYSA-N 306.343 2.984 5 40 DFBB CN(C)CC(=O)Nc1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1 3145248 HUUFUWXMKRPLBR-UHFFFAOYSA-N 315.329 2.887 5 40 DFBB Cc1cc(C=O)c(C)n1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 408568255 SFQBJQZGJWRSIQ-UHFFFAOYSA-N 304.262 2.609 5 40 DFBB CC1=NN(c2ccccc2)C(=O)[C@@H]1C(=O)c1ccc([N+](=O)[O-])cc1 18240404 QHRMOZIIQNCORN-HNNXBMFYSA-N 323.308 2.816 5 40 DFBB CSc1nnc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)s1 40969940 BAHPHOYZADYDIX-UHFFFAOYSA-N 310.360 2.729 5 40 DFBB CC(C)CCNc1nc(N)c([N+](=O)[O-])c(NCc2ccco2)n1 5219393 SCXOGIWPTDTYCI-UHFFFAOYSA-N 320.353 2.630 5 40 DFBB C[C@H]1C[C@H](C)CN(CCCCNC(=O)c2ccc([N+](=O)[O-])o2)C1 40535199 ZJDJJFFYLWJFMX-STQMWFEESA-N 323.393 2.676 5 40 DFBB Cc1ccc(NC(=O)COc2ccc(C=O)cc2)cc1[N+](=O)[O-] 10967081 BKCVSHHOCRIVOZ-UHFFFAOYSA-N 314.297 2.733 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)N=C1O[C@@H](c3ccccn3)C(O)=C1N2 104240090 LOLLCOQCARJMEZ-AWEZNQCLSA-N 310.269 2.986 5 40 DFBB C[C@H](O)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 97163468 PDIJRMFMGZKVQN-ZETCQYMHSA-N 321.255 2.506 5 40 DFBB CC(=O)Nc1ccc(CCNc2cc(C)c([N+](=O)[O-])cn2)cc1 74747871 NTZRNPOYROWJBT-UHFFFAOYSA-N 314.345 2.911 5 40 DFBB O=[N+]([O-])c1ccc(NCc2nncn2-c2ccccc2)c(F)c1 42100174 CDVSBWPALQBRRG-UHFFFAOYSA-N 313.292 2.927 5 40 DFBB CC1(C)C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)O1 187029720 UWGWPILSHXXYRP-KBPBESRZSA-N 308.378 2.564 5 40 DFBB C[C@@H](C1CC1)n1nccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 96424989 VDSUYPCCBICYQU-NSHDSACASA-N 314.345 2.944 5 40 DFBB COc1ccc(C2=N/C(=C/c3ccccc3[N+](=O)[O-])C(=O)O2)cc1 354576 UHQCMCZDHGTDBI-GXDHUFHOSA-N 324.292 2.948 5 40 DFBB O=[N+]([O-])c1c(Br)sc(N2CCCC2)c1[N+](=O)[O-] 5184960 KFLDZDUTUDDCHE-UHFFFAOYSA-N 322.140 2.927 5 40 DFBB CCOc1ccc(OCCNc2ncccc2[N+](=O)[O-])cc1 20669641 JNTQUFAPHRPTST-UHFFFAOYSA-N 303.318 2.879 5 40 DFBB COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-] 3164530 ZZFBZMVSRXMCKI-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=[N+]([O-])c1c(NC[C@@H](O)c2ccccc2F)nc2ccccn12 58244494 UJUICNGJFIMQPS-GFCCVEGCSA-N 316.292 2.527 5 40 DFBB CN1C2=NC(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)N2c2ccccc21 5111314 YAJCVGNXAVBXFK-XNTDXEJSSA-N 320.308 2.788 5 40 DFBB O=[N+]([O-])c1cc(-c2nc(-c3ccccn3)no2)cc([N+](=O)[O-])c1 4723516 RKJDNXMGLDFTNO-UHFFFAOYSA-N 313.229 2.615 5 40 DFBB Cc1nnc(SC[C@@H](O)c2ccc([N+](=O)[O-])cc2)n1C1CC1 97035084 LGMZBJRPEKJUBV-CYBMUJFWSA-N 320.374 2.655 5 40 DFBB C[N@+]12CCCC[C@@H]1[C@@H](CN1C(=O)c3ccccc3C1=O)CCC2 248088512 UMWVQFMDELFMHV-SOIKWTOOSA-N 313.421 2.692 5 40 DFBB biogenic,in-vitro CN(CC(=O)Nc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 57455903 GKINTEIOMSKNTE-UHFFFAOYSA-N 317.320 2.804 5 40 DFBB Nc1ccc(C(=O)N2CC[C@H]3CCCC[C@H]3C2)cc1[N+](=O)[O-] 33028345 XRPYWDCKSHXQCN-YPMHNXCESA-N 303.362 2.829 5 40 DFBB O=[N+]([O-])c1ccc(NC[C@@H](c2ccco2)N2CCCC2)nc1 25370737 XCISVOBMIDKNHG-ZDUSSCGKSA-N 302.334 2.832 5 40 DFBB O=C([C@H]1C[C@H]2CC[C@H]1O2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 107527365 CBWSKHHAHQOHPK-OWCLPIDISA-N 316.357 2.653 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 3322517 PNMMBLPOUXUPLH-UHFFFAOYSA-N 301.254 2.681 5 40 DFBB Nc1nc(N2CCCCC2)nc(NC2CCCCC2)c1[N+](=O)[O-] 4306012 ONWXAPYTRLWZKT-UHFFFAOYSA-N 320.397 2.702 5 40 DFBB CC1(C)CC(=O)[C@H]2C(c3ccc(Cl)c([N+](=O)[O-])c3)=NN[C@H]2C1 228926744 BRPTUNKFJBLLSU-GWCFXTLKSA-N 321.764 2.929 5 40 DFBB CS[C@H](CO)[C@@H](C)Nc1ccc2ncccc2c1[N+](=O)[O-] 96417309 HTRRIWDAJOAPLP-NOZJJQNGSA-N 307.375 2.667 5 40 DFBB Cc1cccc(/N=c2\oc3ccc([N+](=O)[O-])cc3cc2C(N)=O)c1 4616019 NMSYPPCZNKSVNE-ZPHPHTNESA-N 323.308 2.981 5 40 DFBB Cc1cccc(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])c1 170708055 NCRKVHZURRDKFS-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB Cc1ccc(CNC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 40151224 QBCKOYCBAYDPHA-UHFFFAOYSA-N 314.341 2.989 5 40 DFBB O=C(Nc1nnc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccco1 207527 QJVFOEZQEKFYFB-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB C[C@@H](c1ccccc1)N(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 24686357 UXBHBWHUSSWBGK-LBPRGKRZSA-N 313.357 2.887 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2)C1 12885666 LFZGNMMVJKJWOE-MRXNPFEDSA-N 312.325 2.809 5 40 DFBB O=[N+]([O-])c1cccc(Cn2nnc(-c3ccc(Cl)cc3)n2)c1 3423670 HGSJCPYJBNYQBU-UHFFFAOYSA-N 315.720 2.950 5 40 DFBB O=[N+]([O-])c1ccc(OCCn2nccc2-c2ccncc2)cc1 97082507 STZAPTPVMDURBP-UHFFFAOYSA-N 310.313 2.932 5 40 DFBB COCCN(C(=O)c1cc([N+](=O)[O-])ccc1C)c1ccncc1 79310727 ZERNUXCTMRWBHG-UHFFFAOYSA-N 315.329 2.591 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] 5857511 NTHPQRKSPOQBTH-UHFFFAOYSA-N 312.391 2.856 5 40 DFBB C[N+](C)(C)CCN[P@@](=O)(Oc1ccccc1)c1ccccc1 6482966 LQQMTYWTZFWAPW-QFIPXVFZSA-N 319.365 2.880 5 40 DFBB O=C1CCc2cc(NC(=O)c3cccc([N+](=O)[O-])c3)ccc2N1 9134330 AMOJKFCJJPRHPX-UHFFFAOYSA-N 311.297 2.732 5 40 DFBB O=C(O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 40566564 MDLFKEHLYDIDFI-MRVPVSSYSA-N 318.251 2.915 5 40 DFBB in-vitro Cc1ccccc1OCCNC(=O)c1ccccc1[N+](=O)[O-] 55954541 PXFASLIIGRNUHQ-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)N=c1[nH]c2ccccc2[nH]1 13207765 QSMSOSPCSOTHEY-CMDGGOBGSA-N 308.297 2.545 5 40 DFBB O=C1[C@@H]2Nc3ccccc3N=C2O[C@@H]1c1cccc([N+](=O)[O-])c1 1588562 ARUUAPLLTWATDF-DZGCQCFKSA-N 309.281 2.760 5 40 DFBB O=C(O)C(C(=O)O)[C@@H](O)c1c2ccccc2cc2ccccc12 6576406 VEEGYXRUTFERSX-INIZCTEOSA-N 310.305 2.812 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2CCCCCC2)n1 5215996 IGVGRNICLSNTAA-JTQLQIEISA-N 308.386 2.558 5 40 DFBB COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 4673175 NOUCZZYDAJZVIN-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB CCc1ccc(N(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 224748707 ACDGYSBUFJKHDV-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB CC(C)c1nnc(Sc2nc3ccccn3c2[N+](=O)[O-])n1C 69350538 NHNGYVKGXGFFKG-UHFFFAOYSA-N 318.362 2.646 5 40 DFBB C[N+](C)(C)CCN[P@](=O)(Oc1ccccc1)c1ccccc1 1612989 LQQMTYWTZFWAPW-JOCHJYFZSA-N 319.365 2.880 5 40 DFBB O=[N+]([O-])c1cnc(N(Cc2ccco2)C2CC2)nc1NC1CC1 25494316 FTIWPAWNAWWKEL-UHFFFAOYSA-N 315.333 2.721 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@@H](CN1CCCC1)c1ccccc1 40497160 HUIKEADQPJYFKM-AWEZNQCLSA-N 315.377 2.577 5 40 DFBB COc1cc2c(cc1OC)CN(c1ncccc1[N+](=O)[O-])CC2 20566446 CTHUZLIUSZTHMB-UHFFFAOYSA-N 315.329 2.570 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1CCc1ccccc1 52454281 GCJLUYKWZQPKIZ-CQSZACIVSA-N 300.362 2.930 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(Nc2ccccc2O)c([N+](=O)[O-])c1 4409553 IBORHNBBMRNGQO-UHFFFAOYSA-N 319.229 2.650 5 40 DFBB Cc1ccc([N+](=O)[O-])c(O[C@H](C)C(=O)Nc2cc(C)on2)c1 9114796 PTNODPJZYGJHJT-SNVBAGLBSA-N 305.290 2.606 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC1CCCCC1 9596562 CRSLRFGDJZBNBZ-UHFFFAOYSA-N 312.391 2.762 5 40 DFBB Cc1cccc([C@@H](C)NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1C 71908954 PUGBASIZBIXADL-SNVBAGLBSA-N 302.334 2.734 5 40 DFBB O=c1c([N+](=O)[O-])c(Nc2ccc3c(c2)CCC3)nc2ccccn12 41817327 HPQPVZBEYFXXKO-UHFFFAOYSA-N 322.324 2.835 5 40 DFBB CNc1c([N+](=O)[O-])cnn1-c1ccc(OC(F)(F)F)cc1 4089937 NQSKZPSRWXWWEF-UHFFFAOYSA-N 302.212 2.721 5 40 DFBB COc1ccc(NC(=O)N2C[C@H]3CCC[C@H]3C2)cc1[N+](=O)[O-] 97083131 LOKOMLZLRXYNDF-PHIMTYICSA-N 305.334 2.867 5 40 DFBB CC[C@@H]1CC[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 95459189 OUHRAFJVCABUIK-MWLCHTKSSA-N 307.306 2.906 5 40 DFBB CC(=O)N[C@@H]1CCCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 96453576 YSZWGMPKVFUAKC-LLVKDONJSA-N 311.769 2.662 5 40 DFBB Cc1noc([C@@H]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])C2)n1 269422946 ZUPCUNYFEMPAOZ-SECBINFHSA-N 323.740 2.719 5 40 DFBB COc1ccccc1-n1ncc2c([N+](=O)[O-])cc([N+](=O)[O-])cc21 2190708 PZQAUMQVIQDLEV-UHFFFAOYSA-N 314.257 2.851 5 40 DFBB O=C(C[C@H](C(=O)O)[C@@H](c1ccccc1)[N+](=O)[O-])c1ccccc1 1687175 OXISQRBRNJKOGQ-GOEBONIOSA-N 313.309 2.978 5 40 DFBB Cc1cn2nc(N(C)Cc3cccc([N+](=O)[O-])c3)sc2n1 25581187 KEQFIYAUHYTXQC-UHFFFAOYSA-N 303.347 2.644 5 40 DFBB COc1ccc(C(=O)NN2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] 12779602 WLOKIZNHAHHWNE-QWRGUYRKSA-N 307.350 2.511 5 40 DFBB COc1cc(C(=O)Nc2ccccc2)c([N+](=O)[O-])cc1OC 7609357 VENCJJZKSYRONS-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CCOc1ccc(C(=O)Nc2ncccc2C)cc1[N+](=O)[O-] 9647736 YNVKHPKHHBNOSH-UHFFFAOYSA-N 301.302 2.949 5 40 DFBB C[C@@H](C[C@H]1CCCO1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095527 GDLVQLHVNTVSNR-GXSJLCMTSA-N 312.753 2.936 5 40 DFBB CCN(Cc1cccc(F)c1)c1ccc(C(N)=O)cc1[N+](=O)[O-] 25252002 IHNPLSDPVDPODN-UHFFFAOYSA-N 317.320 2.859 5 40 DFBB Cc1cccc(Cn2c(C)nc3ccc([N+](=O)[O-])cc3c2=O)c1 930664 SPVWQKGFZYAZQL-UHFFFAOYSA-N 309.325 2.970 5 40 DFBB CCc1ccc(NC(=O)c2c(C)cc(C)[nH]c2=O)cc1[N+](=O)[O-] 76713176 UMTLSLUPKCJCFG-UHFFFAOYSA-N 315.329 2.715 5 40 DFBB Cc1c(C(=O)N(C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)cccc1[N+](=O)[O-] 96418849 XKBMCULFPFPLRP-YUELXQCFSA-N 318.373 2.789 5 40 DFBB CN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCC[C@H]1O 13632451 CYXYNNSGAMIYJL-CHWSQXEVSA-N 312.753 2.624 5 40 DFBB Cc1cc(C(=O)N(C)Cc2cnc(C)s2)c(N)c([N+](=O)[O-])c1 69738042 CEPWGXHBFJOPJX-UHFFFAOYSA-N 320.374 2.523 5 40 DFBB Cc1ncc([N+](=O)[O-])n1Cc1ccc(OC[C@@H]2CCCO2)cc1 96489844 FXBDPHOWFPJAIK-HNNXBMFYSA-N 317.345 2.706 5 40 DFBB C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 9909271 QUKFRNYZDZSGLJ-LLVKDONJSA-N 318.304 2.990 5 40 DFBB CC(C)n1cnnc1C1CCN(c2ccc([N+](=O)[O-])cn2)CC1 95455196 FILNEEAYIZMXIG-UHFFFAOYSA-N 316.365 2.546 5 40 DFBB COCC(=O)Nc1ccc(Nc2ccccc2[N+](=O)[O-])cc1 44724935 DKEBXIWFNOJRKX-UHFFFAOYSA-N 301.302 2.923 5 40 DFBB O=C(NC1CCCCC1)c1cc2cccc([N+](=O)[O-])c2oc1=O 7602753 PLWAUNOAAWDLRP-UHFFFAOYSA-N 316.313 2.764 5 40 DFBB O=[N+]([O-])c1cnn(CCN2CCS[C@H](c3ccccc3)C2)c1 95963081 CDZGQKUKLPAVPR-HNNXBMFYSA-N 318.402 2.581 5 40 DFBB CCn1c(=O)n(CC)c2cc([N+](=O)[O-])c(N3CCCCC3)cc21 5318784 BXCBGGJBWGKJKI-UHFFFAOYSA-N 318.377 2.741 5 40 DFBB CCNc1c([N+](=O)[O-])/c(=N/C(=O)c2ccccc2)sn1CC 17140197 IIHYMUICXXVKLZ-PEZBUJJGSA-N 320.374 2.651 5 40 DFBB C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Br)C[C@H](C)O1 226300751 UIDXZCSPVXPLDP-IUCAKERBSA-N 315.167 2.971 5 40 DFBB Cc1ccc(NC(=O)[C@H](C)OCC(F)(F)F)cc1[N+](=O)[O-] 31701945 QABHTTGHWUUGGZ-QMMMGPOBSA-N 306.240 2.809 5 40 DFBB CN(C)C(=O)c1cccc(CCNc2ccc([N+](=O)[O-])cc2)c1 76063533 WNPZDNMVULGMRI-UHFFFAOYSA-N 313.357 2.951 5 40 DFBB O=[N+]([O-])c1ccc(NCc2nc(-c3ccco3)n[nH]2)c(F)c1 69977601 FGKJWCZIELNMSK-UHFFFAOYSA-N 303.253 2.724 5 40 DFBB CCCCC(=O)OCC(=O)Nc1cc(OC)c([N+](=O)[O-])cc1C 5781254 TXSYSBMBCIEPKG-UHFFFAOYSA-N 324.333 2.584 5 40 DFBB Cc1nc(CC(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c(C)s1 166194489 NLZGCVVTRXGQPR-UHFFFAOYSA-N 307.331 2.555 5 40 DFBB CC(C)=CC(=O)OCC(=O)Nc1cc(C)c(C)cc1[N+](=O)[O-] 4870760 XCLYDYIZJMOANS-UHFFFAOYSA-N 306.318 2.660 5 40 DFBB CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)Nc1cccc([N+](=O)[O-])c1 32816252 TWEKDWIHJPZCJU-CYBMUJFWSA-N 319.361 2.570 5 40 DFBB Cc1cc(C(=O)NCCN(C)c2ccccc2)ccc1[N+](=O)[O-] 10113700 SGDUZJXLIDOMFB-UHFFFAOYSA-N 313.357 2.769 5 40 DFBB O=C(Nc1nnc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 20496129 VZZNUBHDUORAED-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB Cc1cc(C)nc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 5935369 IQCWNOXKJDFOEK-UHFFFAOYSA-N 316.273 2.767 5 40 DFBB Cc1nn(C)c(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1C 71185354 INMRNGCWOMSUIT-UHFFFAOYSA-N 308.725 2.851 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)OCc2cnc(C)s2)c1 58247170 MSXQOTZEPYFZRF-UHFFFAOYSA-N 308.315 2.725 5 40 DFBB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 16385794 VTAPUJBSGAMKHF-XXHBBNRNSA-N 318.716 2.560 5 40 DFBB C[C@H]1CCCC[C@@H]1OCc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 69439971 YOHVVIWOMFPTTI-HZMBPMFUSA-N 317.345 2.927 5 40 DFBB O=C(c1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4703641 WNCHBWOMAZUGOW-UHFFFAOYSA-N 311.341 2.557 5 40 DFBB C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCS1 97095551 SENCUPJSBRSPMC-QMMMGPOBSA-N 300.767 2.826 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CCO)c2cccs2)c1 95445780 CGQXYYLVCWNOBD-GFCCVEGCSA-N 320.370 2.818 5 40 DFBB Cc1[nH]nc(C(=O)Nc2c(F)cccc2NC2CC2)c1[N+](=O)[O-] 89522603 VMYDKFJYQQLIOT-UHFFFAOYSA-N 319.296 2.592 5 40 DFBB Cc1nccn1C[C@H]1CCCN1c1cccc(F)c1[N+](=O)[O-] 225596829 WDZMLJGCCNAULR-GFCCVEGCSA-N 304.325 2.908 5 40 DFBB CC(C)c1nc([C@H](CO)Nc2ncccc2[N+](=O)[O-])cs1 585141595 DEVNHTWMXQHLDD-VIFPVBQESA-N 308.363 2.715 5 40 DFBB O=C(NC1CC1)[C@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 50933560 SKFZHRHTRMAVDF-JTQLQIEISA-N 323.780 2.743 5 40 DFBB Cn1c(SC[C@H]2CCCO2)nnc1-c1ccc([N+](=O)[O-])cc1 1332934 XRXJOZFMPRCLTD-GFCCVEGCSA-N 320.374 2.661 5 40 DFBB Cc1[nH]nc(C(=O)N(C)Cc2ccc(Cl)s2)c1[N+](=O)[O-] 84019433 CWYKRBBSLZUIBI-UHFFFAOYSA-N 314.754 2.613 5 40 DFBB COc1ccc(C(=O)NN2[C@@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] 12779608 WLOKIZNHAHHWNE-PHIMTYICSA-N 307.350 2.511 5 40 DFBB O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)Nc1ccccc1 6788911 NRKFXBBAVSQBNY-VOTSOKGWSA-N 312.281 2.975 5 40 DFBB COc1cc([C@@H]2NC[C@H](c3ccc([N+](=O)[O-])cc3)O2)ccc1O 19643013 MGHHNWNXFHDEBT-HZPDHXFCSA-N 316.313 2.669 5 40 DFBB CCC[C@H]1C[C@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 75373722 JDQUKFHBYWOWNB-XHDPSFHLSA-N 314.345 2.699 5 40 DFBB CCOC(=O)N1CCC(Nc2cccc(OC)c2[N+](=O)[O-])CC1 181211806 LRHGRUDBBRXDFY-UHFFFAOYSA-N 323.349 2.636 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1 5915857 ZGJRCKCLISGNTI-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(C(N)=O)cc1 32851039 AJEQCSSQAWWYGM-LBPRGKRZSA-N 313.357 2.887 5 40 DFBB CC(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])cn1)C2 54125399 QRZUFKGQDNHZIR-UHFFFAOYSA-N 312.329 2.511 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N(C1CCCC1)C1CC1 24687151 RLHLXOGMBZQPOH-UHFFFAOYSA-N 310.375 2.691 5 40 DFBB COc1ccc(NC(=O)c2ccc3c(c2)COC3)c([N+](=O)[O-])c1 64384272 GXORWMWIIVDJBN-UHFFFAOYSA-N 314.297 2.886 5 40 DFBB C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CN1C1CC1 97162528 GUOQVSMJYZRFNC-MWLCHTKSSA-N 323.780 2.603 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1C[C@H]1CCC2(CCCC2)O1 225552768 WUVGKEZUAUMSFQ-GFCCVEGCSA-N 318.329 2.995 5 40 DFBB Cc1ccc([C@@H](N)c2n[nH]c(-c3ccccc3[N+](=O)[O-])n2)cc1 95534091 XJPVASSYBBIWAK-CQSZACIVSA-N 309.329 2.736 5 40 DFBB CC[C@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCO1 40526294 MWTVWJOPUYUWCX-JTQLQIEISA-N 313.741 2.891 5 40 DFBB O=C(NCc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 354177 SKVYFEUJFFJIQL-UHFFFAOYSA-N 324.292 2.631 5 40 DFBB COc1ccccc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 32721983 HHGNASBOLONHFX-UHFFFAOYSA-N 316.269 2.584 5 40 DFBB CCN(c1ccccc1)c1cc2c(cc1[N+](=O)[O-])no[n+]2[O-] 4773714 WIZSSLGCZLOGIJ-UHFFFAOYSA-N 300.274 2.527 5 40 DFBB Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1C(=O)NC1CCCCC1 504203 XDBITEWDACEDFY-UHFFFAOYSA-N 308.382 2.688 5 40 DFBB O=C1CS[C@H](c2ccc([N+](=O)[O-])o2)N1Cc1ccccc1 3182216 MWCZOCCCZJKBJD-CQSZACIVSA-N 304.327 2.962 5 40 DFBB O=C(O)Cc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 17053082 NVLBLTXQEUZETJ-UHFFFAOYSA-N 315.285 2.866 5 40 DFBB Cc1ccc(NC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c(O)c1 9468838 BTXICFSUWNQJAW-UHFFFAOYSA-N 315.329 2.927 5 40 DFBB NCc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 199826670 ZKKDSANVPMHWPQ-UHFFFAOYSA-N 305.721 2.959 5 40 DFBB CCC[C@H](C)NC(=O)CN(CC)Cc1cccc([N+](=O)[O-])c1 40088660 VBLNRVFWDOYTSZ-ZDUSSCGKSA-N 307.394 2.722 5 40 DFBB CCN(Cc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 5455300 SBCBYMGFYQNYLP-UHFFFAOYSA-N 320.370 2.806 5 40 DFBB CN1CCc2c1nc(-c1ccc([N+](=O)[O-])cc1)c1c2N(C)CC1 1616084 LSEPAJZJDIHBAY-UHFFFAOYSA-N 310.357 2.641 5 40 DFBB CCN(CC)c1nc(N)c([N+](=O)[O-])c(Nc2cccc(C)c2)n1 5052931 IXDPHEBCBMSZSO-UHFFFAOYSA-N 316.365 2.865 5 40 DFBB O=[N+]([O-])c1ccc2nc(NCCCn3ccnc3)sc2c1 91424653 AEPBCCHVYAKNRI-UHFFFAOYSA-N 303.347 2.903 5 40 DFBB CCN(Cc1cccc([N+](=O)[O-])c1)Cc1ccoc1C(=O)OC 30967602 SXHDWQXRPCGGNM-UHFFFAOYSA-N 318.329 2.997 5 40 DFBB N[C@@H](Cc1ccccc1)c1n[nH]c(-c2ccc([N+](=O)[O-])cc2)n1 95534842 NOLNVMURYDUXPU-AWEZNQCLSA-N 309.329 2.622 5 40 DFBB Cc1ccc(C(=O)NCCNc2c(Cl)cccc2[N+](=O)[O-])o1 5547647 BUPYAZZXASBLHH-UHFFFAOYSA-N 323.736 2.992 5 40 DFBB CC(=O)COc1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1 42304 HFOIUAWVALGTAR-UHFFFAOYSA-N 315.281 2.782 5 40 DFBB O=C(COC(=O)c1ccccc1F)Nc1ccc([N+](=O)[O-])cc1 6059667 IDADRVWNDCBYSF-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cc1ccc(NC(=O)[C@@H](C)OC[C@H]2CCCCO2)cc1[N+](=O)[O-] 58431473 DLWKREZGDRDRMF-TZMCWYRMSA-N 322.361 2.816 5 40 DFBB O=C(COC(=O)c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] 4703711 BDAGBZXQHQOWDQ-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cc1cnc(N(C)[C@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 95411547 DLPMOPVKLAVBDY-CQSZACIVSA-N 301.346 2.858 5 40 DFBB O=[N+]([O-])c1ccc(CNCCN2CCc3ccccc3C2)cc1 32809026 DQFYUBSEHKRQST-UHFFFAOYSA-N 311.385 2.743 5 40 DFBB Cc1ccccc1[C@@H]1CCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 95393546 QQLWFGJWBVHLAB-ZDUSSCGKSA-N 314.345 2.912 5 40 DFBB O=c1c2c(O)cccc2oc2cc3c(c(O)c12)[C@H]1C=CO[C@H]1O3 14715640 CWYJYLXZMAUSNI-GJEGPGMTSA-N 310.261 2.703 5 40 DFBB biogenic,in-vitro O=c1c2ccccc2c2ccccc2c(=O)n1Cc1cccnc1 110495 QPRYDPVHWOFFEX-UHFFFAOYSA-N 314.344 2.958 5 40 DFBB O=C1C[C@H](c2ccccc2)CN1C(=O)c1ccc([N+](=O)[O-])cc1 264392 AERCIWRBCUTEFD-AWEZNQCLSA-N 310.309 2.751 5 40 DFBB Cc1csc(-c2cccc(OC(=O)[C@H]3C[C@H]3[N+](=O)[O-])c2)n1 65491539 SZIYJNCCPQLVIR-NWDGAFQWSA-N 304.327 2.689 5 40 DFBB Cc1c(CN[C@H](C)c2nnc3ccccn23)cccc1[N+](=O)[O-] 97111408 IGTQFEYTCXVNQQ-GFCCVEGCSA-N 311.345 2.797 5 40 DFBB COC(=O)COc1cccc(/C=C/c2onc(C)c2[N+](=O)[O-])c1 408607731 UOTWJMXIMXRCSW-VOTSOKGWSA-N 318.285 2.613 5 40 DFBB Cc1nc(C)c(C(=O)NCCNc2ccccc2[N+](=O)[O-])s1 53639179 KZYXHKCUBWSDEF-UHFFFAOYSA-N 320.374 2.510 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CC(=O)c1cc(C)n(C2CC2)c1C 26106242 NCOWEZWXWLIAMJ-UHFFFAOYSA-N 302.334 2.736 5 40 DFBB Cc1ccc2oc(C(=O)NCc3ccccc3[N+](=O)[O-])cc2n1 69895578 DXZOUOKEZVKSRM-UHFFFAOYSA-N 311.297 2.974 5 40 DFBB COCCNC(=S)Nc1cc2ncccc2c2cccnc12 408974310 DZEMTVGHTVOTHN-UHFFFAOYSA-N 312.398 2.716 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]1C[C@@H](C)O 97145753 PMDYVEDFVNLATR-OLZOCXBDSA-N 321.377 2.979 5 40 DFBB CCO[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C12CCC2 96423439 ATBCIQKYYXHTSK-LSDHHAIUSA-N 318.373 2.601 5 40 DFBB CCOc1ccc(Oc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 3341216 HGAKFDSLHRYVLM-UHFFFAOYSA-N 302.286 2.885 5 40 DFBB Cc1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c([N+](=O)[O-])cc1C 100237434 TUQAATQHHZTGNV-GVARAGBVSA-N 312.325 2.523 5 40 DFBB O=C(Cn1cnc([N+](=O)[O-])c1)Nc1cccc(Cl)c1Cl 35918 YYTRQBDEVPZZMC-UHFFFAOYSA-N 315.116 2.737 5 40 DFBB CSc1nc2c(c(=O)n1-c1ccc([N+](=O)[O-])cc1)SCC2 213980 XEVJBICOUFDWGI-UHFFFAOYSA-N 321.383 2.511 5 40 DFBB O=C(COc1cccnc1[N+](=O)[O-])NC1CCCCCCC1 21095767 CCQGYYYGNHEVIA-UHFFFAOYSA-N 307.350 2.598 5 40 DFBB O=[N+]([O-])c1ccc(O)c(-c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 3901194 RRGHTLYUKZWSNJ-UHFFFAOYSA-N 300.230 2.752 5 40 DFBB O=c1c2cnc3ccc([N+](=O)[O-])cc3c2[nH]n1-c1ccccc1 34925907 YNDJJQCOKFBUME-UHFFFAOYSA-N 306.281 2.775 5 40 DFBB O=C(NCCOc1cccc(Cl)c1)c1ccc([N+](=O)[O-])o1 47023316 HHRWEMMGCINWQY-UHFFFAOYSA-N 310.693 2.650 5 40 DFBB C[C@H]1CCCN(C(=O)CNC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 195550095 OKEVFJBXDBAVNJ-ZDUSSCGKSA-N 319.405 2.678 5 40 DFBB C[C@H](C[C@H]1CCCO1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095528 GDLVQLHVNTVSNR-MWLCHTKSSA-N 312.753 2.936 5 40 DFBB Cc1nn(C)c(C)c1OC(=O)/C=C/c1ccccc1[N+](=O)[O-] 96424030 JTRIWTCBEDOQNW-CMDGGOBGSA-N 301.302 2.564 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)O)c1 3194445 LBKVGDPSOYPBOQ-BQYQJAHWSA-N 312.281 2.945 5 40 DFBB O=c1nc(SCc2ccc([N+](=O)[O-])cc2)c2c([nH]1)CCCC2 4317089 WOUKUJYOCWOUCZ-UHFFFAOYSA-N 317.370 2.849 5 40 DFBB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 60379550 QXNYDNMTJYUTKX-SNVBAGLBSA-N 316.361 2.712 5 40 DFBB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2739975 ODYLVNNFONTPPI-NXEZZACHSA-N 324.720 2.854 5 40 DFBB Cc1cc(C)c(NC(=O)Cn2c([N+](=O)[O-])cnc2C)c(C)c1 730792 ASMNJBKJJULHEK-UHFFFAOYSA-N 302.334 2.664 5 40 DFBB O=C1OC(c2ccc([N+](=O)[O-])cc2)=N/C1=C/c1ccc(O)cc1 1735814 MUXRKJVUDYSSFT-NTEUORMPSA-N 310.265 2.645 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1ccccc1C1=NCCCN1 139953 PXAGMJKDPBBOOC-UHFFFAOYSA-N 314.370 2.881 5 40 DFBB COc1ccc(CCOC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 7122480 WDCXUDUWGZVAQD-UHFFFAOYSA-N 316.313 2.585 5 40 DFBB O=C1OC(c2ccccc2)=N/C1=C/c1cc([N+](=O)[O-])ccc1O 35618458 QIQHRYFDXTWGFB-UKTHLTGXSA-N 310.265 2.645 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@H](C)C2)n1 4306030 ZNYAEDLRANXLOJ-QWRGUYRKSA-N 322.413 2.517 5 40 DFBB CC[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1nccs1 97080108 AEBRLVHTSSZLAO-CQSZACIVSA-N 321.358 2.812 5 40 DFBB CC[C@@]1(C)CN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CCO1 187881607 PUMCQCMLOBTTJV-LRDDRELGSA-N 321.377 2.866 5 40 DFBB COc1ccc2ccccc2c1[C@@H]1NC(=O)NC(C)=C1[N+](=O)[O-] 358541 QEGNZDLOMNXGNP-AWEZNQCLSA-N 313.313 2.711 5 40 DFBB CC[N+](C)(C)CCOc1ccc(OCC[N+](C)(C)CC)cc1 1683308 RKYDCIRNULMJAS-UHFFFAOYSA-N 310.482 2.637 5 40 DFBB O=C(O)c1cccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 1689067 CEDNTPHUESTPLE-UHFFFAOYSA-N 304.214 2.994 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1CCOCC1 97050428 WRIVEZYJTYFJMH-UHFFFAOYSA-N 318.251 2.979 5 40 DFBB O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCc2cnccc21 97084692 TUWZVGJRLWNNAP-UHFFFAOYSA-N 303.705 2.846 5 40 DFBB Cc1[nH]nc(C(=O)Nc2ccc(OCC3CC3)cc2)c1[N+](=O)[O-] 95396542 JIFDXSLSDGNFLG-UHFFFAOYSA-N 316.317 2.667 5 40 DFBB CC1(C)CC(=O)[C@H]2C(c3ccc(Cl)c([N+](=O)[O-])c3)=NN[C@@H]2C1 228926755 BRPTUNKFJBLLSU-MFKMUULPSA-N 321.764 2.929 5 40 DFBB COc1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 5514685 ULRKKNMILWMDIV-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB COc1cc2oc3c(OC)cccc3c(=O)c2c(O)c1OC 14764110 FFVKXGZKJBHJMS-UHFFFAOYSA-N 302.282 2.678 5 40 DFBB biogenic,in-vitro CSc1cccc(NC(=O)COc2cccnc2[N+](=O)[O-])c1 7779575 RKVSREGULLUJRG-UHFFFAOYSA-N 319.342 2.729 5 40 DFBB O=[N+]([O-])c1ccc(CNC[C@H]2COc3ccccc3O2)cc1 36062136 ZVFMCHZKQINZFX-AWEZNQCLSA-N 300.314 2.524 5 40 DFBB O=c1[nH]c(O)nc(/C=C/c2ccc3ccccc3c2)c1[N+](=O)[O-] 33620026 VYABZHHAVIWURU-SOFGYWHQSA-N 309.281 2.707 5 40 DFBB CCCN1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(C)=O)c2)C1 225818161 RZHGVBKPXDJNDB-CYBMUJFWSA-N 305.378 2.941 5 40 DFBB COCCCNC(=O)c1cc2c(ccc3ccccc32)oc1=O 5660721 CCSIFIUVKMLNTL-UHFFFAOYSA-N 311.337 2.713 5 40 DFBB Cc1cccc(CNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1 10448376 WSHICOHSIIROGQ-UHFFFAOYSA-N 320.370 2.690 5 40 DFBB Cc1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2739430 BNHBFFPZKJFPEY-UHFFFAOYSA-N 315.285 2.993 5 40 DFBB COc1ccccc1NC(=O)COc1cc(C)ccc1[N+](=O)[O-] 9054417 LNPCNRXTOHNFSX-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB O=C1[C@@H]2CCCC[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 100556086 LLGYMIYRWVKWTJ-NXEZZACHSA-N 308.721 2.928 5 40 DFBB COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)c1 12729881 ZCFRIBKNTRHANR-HNNXBMFYSA-N 316.361 2.713 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccncc1 97145781 JQQFKXCODSJBDM-UHFFFAOYSA-N 300.318 2.928 5 40 DFBB Cn1cc(N2CCC[C@@H](Nc3cccc(F)c3[N+](=O)[O-])C2)cn1 78367687 QQFNOFMPWVXJKP-LLVKDONJSA-N 319.340 2.548 5 40 DFBB O=[N+]([O-])c1ccccc1NCCc1noc(-c2ccccn2)n1 95397413 CEWFHJSADWTKPZ-UHFFFAOYSA-N 311.301 2.694 5 40 DFBB C[C@H]1CC[C@@H](CCC(=O)N(C)Cc2ccc([N+](=O)[O-])cc2)O1 95404149 MXKLNUBQQPESSA-WFASDCNBSA-N 306.362 2.901 5 40 DFBB O=C(NC[C@H](O)c1ccccc1F)Nc1ccc([N+](=O)[O-])cc1 32826221 SZQIIMBWEBRERI-AWEZNQCLSA-N 319.292 2.589 5 40 DFBB COc1ccc([C@@H]2CC(N)=NN2c2ccc([N+](=O)[O-])cc2)cc1 222547627 ZOEMBQMMLINPCO-HNNXBMFYSA-N 312.329 2.827 5 40 DFBB CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C12CCC2 96423441 ATBCIQKYYXHTSK-HUUCEWRRSA-N 318.373 2.601 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)OCCO2 15411263 VTDWYBNQFVJNFO-UHFFFAOYSA-N 314.297 2.927 5 40 DFBB CC(=O)Nc1nc(SCc2ccc([N+](=O)[O-])cc2)ns1 4944047 PUTQCNROORYEIK-UHFFFAOYSA-N 310.360 2.697 5 40 DFBB CCc1[nH]ncc1C(=O)N(CC)Cc1cccc([N+](=O)[O-])c1 69485020 MOUJQJPQTMHVHS-UHFFFAOYSA-N 302.334 2.543 5 40 DFBB CCCCN(C(=O)Cn1nc(C)c([N+](=O)[O-])c1C)[C@@H](C)CC 7786336 RAFJPKYXQNGJMM-NSHDSACASA-N 310.398 2.835 5 40 DFBB Cc1noc(C)c1[C@H](C)CNC(=O)Nc1ccncc1[N+](=O)[O-] 195557374 KYSYNMPZCBWPCD-MRVPVSSYSA-N 319.321 2.520 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N(C)S(=O)(=O)c1ccc(F)cc1 224918346 ZLUSJIHRMHXUGL-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB O=C1OC(c2ccc([N+](=O)[O-])cc2)=N/C1=C\c1ccccc1O 1735805 ASXFFUYKEYLKAK-LCYFTJDESA-N 310.265 2.645 5 40 DFBB CC[C@H]1CCCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 30144052 AHGWJGRNVVUBRH-ZDUSSCGKSA-N 317.389 2.606 5 40 DFBB Cc1ccc([S@@](=O)c2ccc([N+](=O)[O-])c3nonc23)cc1 6487912 FRBRHPUZSWIODD-NRFANRHFSA-N 303.299 2.606 5 40 DFBB CS[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96417108 KRGAYQUBBLKZMX-WCQYABFASA-N 309.391 2.581 5 40 DFBB O=c1ccn(Cc2csc(-c3cccs3)n2)cc1[N+](=O)[O-] 96468068 SQGFGUHQLGREIM-UHFFFAOYSA-N 319.367 2.990 5 40 DFBB Cc1cc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)ccc1[N+](=O)[O-] 96402855 MCWPAFYSVHKMIW-ZDUSSCGKSA-N 314.345 2.646 5 40 DFBB O=C(CCNc1ccccc1[N+](=O)[O-])NCc1ccccc1F 11660742 CESUVJOFTBVCJL-UHFFFAOYSA-N 317.320 2.852 5 40 DFBB C[C@H]1C[C@H](C)CN(CCCNC(=O)c2cccc([N+](=O)[O-])c2)C1 13673837 FUGLVOLTNUAYMU-KBPBESRZSA-N 319.405 2.693 5 40 DFBB Cc1c(C(=O)NCCOc2ccccc2)cccc1[N+](=O)[O-] 15555099 VVXYXKBOADIMBF-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB Cc1cccc(OCCNC(=O)c2ccccc2[N+](=O)[O-])c1 18147360 ULJGRFPNTGWEQI-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB Cc1cc(C(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)o1 33778940 JBJRUJFIHVMTQN-UHFFFAOYSA-N 318.285 2.600 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)NC1CCCCC1 7380993 AZNXRULXFRVSHN-LLVKDONJSA-N 321.377 2.853 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC(c2ccccc2)=NO1 41776060 CMCNAQGSZZZAJH-OAHLLOKOSA-N 311.297 2.727 5 40 DFBB O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F 17032076 UMTZIGJKVNAMAJ-NXEZZACHSA-N 310.281 2.563 5 40 DFBB O=C(Nc1cc(-c2ccncc2)n[nH]1)c1ccccc1[N+](=O)[O-] 69571501 ZCBDAPZBRKEOSE-UHFFFAOYSA-N 309.285 2.632 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(Nc2ccccc2F)n1 4305911 PJXQQCVONVSTSQ-UHFFFAOYSA-N 320.328 2.918 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CCO)c1cccs1 72294028 NVZBSIXSRYPLER-GFCCVEGCSA-N 321.358 2.902 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H]1C[C@@H](C)O 97145751 PMDYVEDFVNLATR-CHWSQXEVSA-N 321.377 2.979 5 40 DFBB CCS[C@H]1CCC[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] 96450594 JKYYWMZZQIEFTE-JSGCOSHPSA-N 308.403 2.928 5 40 DFBB COc1ccc(C(=O)NCCN(C)C)c2nc3ccccc3cc12 5541370 VYYGUDPHNMYNOZ-UHFFFAOYSA-N 323.396 2.688 5 40 DFBB CCOc1ccc2[nH]c(SCC(=O)OC)c([N+](=O)[O-])c2c1 4475638 UWKKSXZZUHALEQ-UHFFFAOYSA-N 310.331 2.740 5 40 DFBB c1ccc2cc3c(NCCN4CCNCC4)ccnc3cc2c1 22860302 FJPLPCGDJZZCOZ-UHFFFAOYSA-N 306.413 2.705 5 40 DFBB CC(C)(C)c1cnc(SCCn2cc([N+](=O)[O-])ccc2=O)o1 95446265 GVASNDRJUYJSHC-UHFFFAOYSA-N 323.374 2.834 5 40 DFBB C[C@@H](Nc1cccc(NC(=O)CO)c1)c1ccccc1[N+](=O)[O-] 95404411 ZEFYQYPVRQQMPE-LLVKDONJSA-N 315.329 2.699 5 40 DFBB COc1cc(N2CCC[C@H](n3cccn3)C2)c(F)cc1[N+](=O)[O-] 95982713 PZPOGGMQCKSLGT-NSHDSACASA-N 320.324 2.781 5 40 DFBB CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)c2ccc(F)cc21 96432418 TUUPGKXXSQKOFY-UHFFFAOYSA-N 315.304 2.831 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@@]2(c3ccc([N+](=O)[O-])cc3)O[C@@H]2C1 242522249 INXVAUGPWTYTKB-CJNGLKHVSA-N 320.345 2.830 5 40 DFBB O=C(c1ccccc1)c1cccc(NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])c1 58426277 ZKKOQZSFINPJQN-LSDHHAIUSA-N 310.309 2.521 5 40 DFBB COc1ccc(NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)cc1 20493018 PNBZYDWOAAISKT-UHFFFAOYSA-N 322.342 2.545 5 40 DFBB COC(=O)c1c(C)cccc1NC(=O)c1cccc([N+](=O)[O-])c1 9390137 DVXUINAFZIMUNS-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB CN(Cc1nc2ccsc2c(=O)[nH]1)c1ccccc1[N+](=O)[O-] 97094781 ZTBCBPRUSPQPKF-UHFFFAOYSA-N 316.342 2.529 5 40 DFBB Cc1cccc(OCc2nc3ccccc3c(=O)[nH]2)c1[N+](=O)[O-] 97021468 BNRGLFZBXCMONR-UHFFFAOYSA-N 311.297 2.719 5 40 DFBB O=[N+]([O-])c1ccc(CCSc2ncnc3nc[nH]c23)cc1 72287756 DMBJHNWULUYUID-UHFFFAOYSA-N 301.331 2.596 5 40 DFBB C[C@@]1(CCCO)CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 95982869 QNIVXIFYJKRMOM-HNNXBMFYSA-N 307.350 2.754 5 40 DFBB O=[N+]([O-])c1cnc(OCC(F)(F)F)c(Br)c1 95917988 RKXYCFFXBJGPMH-UHFFFAOYSA-N 301.018 2.693 5 40 DFBB in-vitro O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCOc1ccccc1 15555101 UZOQJQGENRAOEI-MDZDMXLPSA-N 312.325 2.803 5 40 DFBB COc1ccccc1C(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 332885 MYODHYJPLHUAKW-UHFFFAOYSA-N 315.281 2.643 5 40 DFBB Cc1cccc(Nc2nc(N3CCCC3)nc(N)c2[N+](=O)[O-])c1 4305959 OPVDKXGYNZMBRV-UHFFFAOYSA-N 314.349 2.619 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC1CCN(c2ncccn2)CC1 95406081 JVJYZNJSLLUHCE-UHFFFAOYSA-N 313.361 2.774 5 40 DFBB O=C(O)c1cn(Cc2c(Cl)cccc2Cl)nc1[N+](=O)[O-] 408716383 MKHOICDKHNXHAQ-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB O=[N+]([O-])c1ccn(Cc2ccc(Br)cc2F)n1 71978421 FDDBXGNYZSVCSD-UHFFFAOYSA-N 300.087 2.741 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H](CC3)[C@@H]2C1=O 17032426 BPBSXZMLLWDWFB-JLUCKKNBSA-N 312.325 2.605 5 40 DFBB O=C(OCC(=O)c1ccc(Cl)s1)c1ccc([N+](=O)[O-])o1 3240585 LOIRMQRHJUPFLM-UHFFFAOYSA-N 315.690 2.942 5 40 DFBB Cc1ccc(NC(=O)[C@H](C)OC[C@H]2CCCCO2)cc1[N+](=O)[O-] 58431476 DLWKREZGDRDRMF-GXTWGEPZSA-N 322.361 2.816 5 40 DFBB C[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(S(C)(=O)=O)cc1 36785935 NZUSTFDQTZIQTJ-JTQLQIEISA-N 321.358 2.566 5 40 DFBB Cn1ncc2c(Oc3ccc(Cl)cc3[N+](=O)[O-])ncnc21 12792750 FMDVOQWLTZHKHV-UHFFFAOYSA-N 305.681 2.717 5 40 DFBB O=C(O)[C@H]1CS[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N1 5772192 CXEPVJPUZWVNTN-RNCFNFMXSA-N 320.326 2.643 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCC1(c2ccccc2)CC1 8753914 LMVVQZAUTDYTBQ-UHFFFAOYSA-N 310.353 2.985 5 40 DFBB O=[N+]([O-])c1cc(CF)ccc1-c1noc(C2CCNCC2)n1 390822882 MMMSLZXGPMQCBW-UHFFFAOYSA-N 306.297 2.581 5 40 DFBB Cc1c(C(=O)NC[C@@H](c2ccco2)N(C)C)cccc1[N+](=O)[O-] 10328270 SYNCMCABFZRXTM-AWEZNQCLSA-N 317.345 2.529 5 40 DFBB C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 549535 UBSSWYJCLIMYPC-JTQLQIEISA-N 310.313 2.962 5 40 DFBB CC(C)(C)c1ncc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cn1 58249328 FNXLTBMCPRTJTF-UHFFFAOYSA-N 314.345 2.864 5 40 DFBB CSc1ccc(C(=O)NCc2cccnc2)cc1[N+](=O)[O-] 13135189 HGMBNACGNMLZOB-UHFFFAOYSA-N 303.343 2.642 5 40 DFBB Nc1ccc(C(=O)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-] 5694687 JSQAVEWJKJGNSC-UHFFFAOYSA-N 305.721 2.760 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1ccc(C)cc1 4891877 QCQSVGODHDEOGY-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(NC[C@@H](O)c2ccsc2)c1 96446549 BSLSGPNYBDILCZ-GFCCVEGCSA-N 312.322 2.950 5 40 DFBB O=[N+]([O-])c1cccc(C[S@@](=O)Cc2nnsc2Cl)c1 32801280 DIAUTORQDAKOQT-IBGZPJMESA-N 317.779 2.549 5 40 DFBB O=C(O[C@H]1CC[C@@H]2CCC[C@@H]1C2=O)c1ccc([N+](=O)[O-])cc1 104098474 NAJGMLORGKZFRW-BPNCWPANSA-N 303.314 2.899 5 40 DFBB O=C(c1ccccc1)c1cccc(NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])c1 58426272 ZKKOQZSFINPJQN-GJZGRUSLSA-N 310.309 2.521 5 40 DFBB O=C(O[C@@H]1CCOC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 78948236 XQWXJSXCCQBBBI-MRVPVSSYSA-N 305.208 2.559 5 40 DFBB CCc1nc2c(c(=O)c3ccccc3n2C)c(=O)n1C1CCCC1 5428974 AEDFEQWPTBPSDH-UHFFFAOYSA-N 323.396 2.926 5 40 DFBB COC(=O)c1ccc(Cl)c(Cn2c([N+](=O)[O-])cnc2C)c1 96004640 FBJMYGOKZFSFDX-UHFFFAOYSA-N 309.709 2.588 5 40 DFBB Cc1cc(NC(=O)NC[C@H](O)c2ccsc2)ccc1[N+](=O)[O-] 97049336 IUKLERVQWGTWLL-ZDUSSCGKSA-N 321.358 2.820 5 40 DFBB O=c1c2c(O)cccc2oc2cc3c(c(O)c12)[C@@H]1C=CO[C@H]1O3 14715644 CWYJYLXZMAUSNI-SKLCBMLGSA-N 310.261 2.703 5 40 DFBB biogenic,in-vitro COc1ccccc1OC(=O)COc1ccc([N+](=O)[O-])cc1 38459 IWXLIYWNMWOLQX-UHFFFAOYSA-N 303.270 2.588 5 40 DFBB CCOc1ncccc1C(=O)OCc1cccc([N+](=O)[O-])c1 5559623 KCWIFABJAXQKEE-UHFFFAOYSA-N 302.286 2.746 5 40 DFBB CCO[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 96007640 HUUGJYLAYMYLSH-SSDOTTSWSA-N 306.240 2.977 5 40 DFBB O=C(NCCc1nccs1)c1c(Cl)cccc1[N+](=O)[O-] 71894117 PIEDDVDFSZLVMT-UHFFFAOYSA-N 311.750 2.677 5 40 DFBB C[C@H]1CCc2c(sc3ncnc(-n4cc([N+](=O)[O-])cn4)c23)C1 72310932 HFSKRQGWZQQXEM-QMMMGPOBSA-N 315.358 2.910 5 40 DFBB O=c1ccn(Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] 84613319 BDXIURAXNCTRFO-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB CC(C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2O)C1=O 409018276 SVSLPTHRFAVACG-IZZDOVSWSA-N 308.315 2.745 5 40 DFBB O=[N+]([O-])c1cc(Cl)c(NCCc2nnc[nH]2)c(Cl)c1 127042110 FWEWHUOEDFZOGV-UHFFFAOYSA-N 302.121 2.674 5 40 DFBB Cc1cccc(C(=O)N2CCC[C@@H](N3CCCC3)C2)c1[N+](=O)[O-] 69812358 NDXDYNLTRWVNFA-CQSZACIVSA-N 317.389 2.604 5 40 DFBB CN(C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 3271045 NEUHQFDBFDTHLW-UHFFFAOYSA-N 320.345 2.543 5 40 DFBB O=C(NCC1(c2ccccc2)CC1)c1ccc([N+](=O)[O-])c(O)c1 35271375 YNIDLRSRHGYGIO-UHFFFAOYSA-N 312.325 2.762 5 40 DFBB Cc1ncsc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 71799842 KDGQAXLPPXTFDE-QMMMGPOBSA-N 303.343 2.951 5 40 DFBB C[C@@]1(CO)CCCN1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 97376691 WOYMHIAWTQPWKK-ZDUSSCGKSA-N 313.741 2.627 5 40 DFBB O=[N+]([O-])c1ccc(F)c2ncc(I)cc12 68577600 PQIMKBNDMNRRQG-UHFFFAOYSA-N 318.045 2.887 5 40 DFBB CCOC(=O)[C@@H]1CCCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])C1 46341159 JHZZDUSQCZQSPK-CYBMUJFWSA-N 320.345 2.577 5 40 DFBB Cc1cc(OC(=O)c2cccc3ccccc23)c([N+](=O)[O-])c(=O)[nH]1 4248385 PSXKLCWAJZFDOA-UHFFFAOYSA-N 324.292 2.964 5 40 DFBB CCN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 20001394 LEBMDAWDWOXHQB-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nncn1C 71803658 SYRWYORJIODGCG-UHFFFAOYSA-N 308.363 2.803 5 40 DFBB CC(C)Cn1ccc2cc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])ccc21 84575378 BMQRJUMQBRKSFM-UKRRQHHQSA-N 301.346 2.901 5 40 DFBB O=C(N1CCc2ncc([N+](=O)[O-])cc2C1)C1(c2ccccc2)CC1 95992863 JPYMPBVBHPYNTK-UHFFFAOYSA-N 323.352 2.606 5 40 DFBB O=[N+]([O-])[C@H]1C[C@@H]1c1nc(-c2cc(Br)cs2)no1 78774475 LIPASYYTGKJUDX-WDSKDSINSA-N 316.136 2.693 5 40 DFBB CN(Cc1ccccn1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 40556284 ZKICQFRAYALPLW-UHFFFAOYSA-N 305.721 2.915 5 40 DFBB Cc1cccc(CNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c1 20110203 RFSLPLSKTKRHPA-UHFFFAOYSA-N 320.370 2.523 5 40 DFBB Cc1cccc2nc(C(=O)OCc3cccc([N+](=O)[O-])c3)cn12 25038119 NCDTZUQHDOAOBH-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB C[N+]1(C[C@H](O)COc2ccc(Cl)cc2Cl)CCCC1 41690085 RBEXVCSPLQMHCM-LBPRGKRZSA-N 305.225 2.974 5 40 DFBB CC[N+](C)(C)C[C@@H]1C(=O)O[C@@]23[C@@H](CC[C@@]4(C)O[C@H]42)[C@H](C)CC[C@H]13 16956600 BGJJAOTZPPPJJJ-PFGRGRLXSA-N 322.469 2.608 5 40 DFBB Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)Nc1cc(F)ccc1F 2788363 KVPBJCHRNLHGGU-MRVPVSSYSA-N 324.287 2.653 5 40 DFBB CC(C)N(Cc1cnn(C)c1)C(=O)c1cc(F)ccc1[N+](=O)[O-] 69528551 VUSGQOIWYJZGKD-UHFFFAOYSA-N 320.324 2.518 5 40 DFBB COc1ccc([C@H]2CC(N)=NN2c2ccc([N+](=O)[O-])cc2)cc1 222547692 ZOEMBQMMLINPCO-OAHLLOKOSA-N 312.329 2.827 5 40 DFBB O=C(Nc1ccnn1CC1CC1)c1ccc([N+](=O)[O-])cc1F 96476164 BJLKKGRWFYMBFE-UHFFFAOYSA-N 304.281 2.593 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1OCCn1cccn1 97371703 HKUQNUXDNQOSBE-UHFFFAOYSA-N 301.224 2.889 5 40 DFBB Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)c1ccccc1 494719 DPLUPFDHVBNDAY-UHFFFAOYSA-N 324.134 2.745 5 40 DFBB CC(C)C(NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C(C)C 20455424 KUPUVMHLSULHOE-UHFFFAOYSA-N 314.407 2.695 5 40 DFBB Cc1cc(NC(=O)NC[C@H](O)c2ccccc2)ccc1[N+](=O)[O-] 97049345 RTRSHXSIRKZUBE-HNNXBMFYSA-N 315.329 2.758 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@H](C)NC(=O)[C@@H](C)OCC1CC1 71830666 KCIHECUTHOOUNT-WDEREUQCSA-N 322.361 2.596 5 40 DFBB CCc1ccc([C@H]2COCCN2c2ccc([N+](=O)[O-])cn2)o1 96453863 OYUWEQPPADSXJP-CYBMUJFWSA-N 303.318 2.723 5 40 DFBB COc1cc(N(C)Cc2c(C)noc2C)c([N+](=O)[O-])cc1F 95411813 OFTXQORMXMGMRY-UHFFFAOYSA-N 309.297 2.984 5 40 DFBB C[C@H]1CCc2noc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 11915496 RXXAVBQKKQADPD-VIFPVBQESA-N 301.302 2.960 5 40 DFBB CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccs1 19902102 FNWGSKICNPZGJG-ZDUSSCGKSA-N 319.386 2.689 5 40 DFBB COc1ccc([C@@H](CNc2ncccc2[N+](=O)[O-])N(C)C)cc1 21363906 UYIOCALDCVGACH-OAHLLOKOSA-N 316.361 2.713 5 40 DFBB Cc1nc2ccc([N+](=O)[O-])cc2c(=O)n1Cc1cccc(F)c1 930669 LYILATXKILGDTP-UHFFFAOYSA-N 313.288 2.801 5 40 DFBB O=C(O)c1cccc(Oc2ccc(C(=O)O)c([N+](=O)[O-])c2)c1 1689776 SDHPBOVVJDIAGF-UHFFFAOYSA-N 303.226 2.784 5 40 DFBB Cc1cc2nnc(SCc3ccc([N+](=O)[O-])cc3)n2c(C)n1 32922504 NIQUWGATJAZOKZ-UHFFFAOYSA-N 315.358 2.942 5 40 DFBB Cc1ccc(C(=O)NCCCN2CCCCCC2)cc1[N+](=O)[O-] 10111089 DUUYGXOKEQFHIE-UHFFFAOYSA-N 319.405 2.899 5 40 DFBB COc1ccc(NC(=O)CNc2ccc([N+](=O)[O-])cc2)cc1 6651458 BNXMOGZUSGZMBB-UHFFFAOYSA-N 301.302 2.654 5 40 DFBB COc1ccc(C(=O)Oc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 6784509 DEJWKALCBGTJDF-UHFFFAOYSA-N 317.253 2.551 5 40 DFBB Cc1cccc(C(=O)N[C@H](C)Cc2ccc(O)cc2)c1[N+](=O)[O-] 95427626 URRYDCFIYMWOKF-GFCCVEGCSA-N 314.341 2.970 5 40 DFBB O=C(Nc1ccc(-c2ccccn2)cn1)c1ccc([N+](=O)[O-])o1 89883973 HQDHZGKXJPGACK-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB Cn1ncc2c1N=C(O)CS[C@H]2c1ccc([N+](=O)[O-])cc1 49550150 FTLGVVNGVKSHSU-LBPRGKRZSA-N 304.331 2.753 5 40 DFBB CO[C@@]1(C)CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 230261480 RGZMTZBNLCTLQX-AWEZNQCLSA-N 312.753 2.889 5 40 DFBB CN(C)C[C@@H](CNc1ncc([N+](=O)[O-])s1)c1ccccc1 252508940 XYITYNZSWHEERK-GFCCVEGCSA-N 306.391 2.809 5 40 DFBB COc1ccc(C(=O)N2CCc3ccccc3C2)cc1[N+](=O)[O-] 180942 OLKSECGVMYDRGG-UHFFFAOYSA-N 312.325 2.802 5 40 DFBB CCCc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)o1 7342090 VMQRKLVLTRBWON-UHFFFAOYSA-N 307.331 2.905 5 40 DFBB O=[N+]([O-])c1cc(Cl)c2c(I)n[nH]c2c1 14983154 VTLMWXADEHEFRL-UHFFFAOYSA-N 323.477 2.729 5 40 DFBB CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 97374571 LUHSKKCHPMHRID-UHFFFAOYSA-N 308.240 2.855 5 40 DFBB CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O 13668556 GXFYFQLDDZPCAT-DGCLKSJQSA-N 312.753 2.624 5 40 DFBB CCCc1nc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)no1 6204941 TXQUXTZHCUUIMJ-UHFFFAOYSA-N 324.724 2.514 5 40 DFBB O=C(Cn1ccc2c([N+](=O)[O-])cccc21)NCc1cccs1 69972077 UZYDTMRAZVHPCI-UHFFFAOYSA-N 315.354 2.927 5 40 DFBB O=[N+]([O-])c1c(N2CCC[C@H]2c2cccnc2)nc2ccccn12 21760188 UBWSGCULSUHZID-ZDUSSCGKSA-N 309.329 2.979 5 40 DFBB O=[N+]([O-])c1cccc(Nc2ccc3nonc3c2[N+](=O)[O-])c1 4016550 LSVSINNXAJHMRT-UHFFFAOYSA-N 301.218 2.783 5 40 DFBB O=[N+]([O-])c1ccc(NCCc2nnc3n2CCCC3)c(Cl)c1 96011421 FGNPEBVWYONHHA-UHFFFAOYSA-N 321.768 2.831 5 40 DFBB COC(=O)[C@H](C)OC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 8401543 NZRDQIDKBVTMRQ-VIFPVBQESA-N 319.269 2.573 5 40 DFBB O=Cc1ccc(OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1 408600235 XFAOPUXLNAMDJW-UHFFFAOYSA-N 318.260 2.564 5 40 DFBB O=[N+]([O-])c1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(O)c1 100004378 JYKKIAIZBAHDKX-UHFFFAOYSA-N 320.217 2.860 5 40 DFBB CCCNC(=O)CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F 57139798 AXOVDDKPJQRYAY-UHFFFAOYSA-N 319.283 2.942 5 40 DFBB O=[N+]([O-])c1ccc(NCc2cccc(Cn3cncn3)c2)cc1 58366294 QJOPOEUKLWZGSV-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB CCCN(CCC)c1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 5174137 XTHSJCATZGIZLX-UHFFFAOYSA-N 311.294 2.828 5 40 DFBB CC(C)n1cnnc1C1CCN(c2ncccc2[N+](=O)[O-])CC1 95455192 KHMPNYGYBNJYSX-UHFFFAOYSA-N 316.365 2.546 5 40 DFBB CC(C)C[C@@H](CN(C)C)NC(=O)Nc1ccccc1[N+](=O)[O-] 32934679 LZRCNEDYCXNUSQ-LBPRGKRZSA-N 308.382 2.693 5 40 DFBB Cc1nc(N[C@@H](C(C)C)[C@H](O)C(F)(F)F)ccc1[N+](=O)[O-] 521394142 VXNAQQBXHBFCGU-QWRGUYRKSA-N 307.272 2.658 5 40 DFBB Cc1nc(COc2cc([N+](=O)[O-])ccc2Br)no1 225532928 GTABATIKAZLKLX-UHFFFAOYSA-N 314.095 2.628 5 40 DFBB COc1ccc(NC(=O)N(C)Cc2cccnc2)c([N+](=O)[O-])c1 40488030 BFDONHUTVOPPQQ-UHFFFAOYSA-N 316.317 2.662 5 40 DFBB CC(=O)Nc1cccc2c1CCN(c1ncccc1[N+](=O)[O-])C2 54125370 CKROZCHIMVUNNK-UHFFFAOYSA-N 312.329 2.511 5 40 DFBB C[N+]1(CC[C@](O)(c2ccccc2)c2cccs2)CCOCC1 769 HJDYAOBDPZQHOD-SFHVURJKSA-N 318.462 2.851 5 40 DFBB in-man C[C@H]1CCC[C@H](C)N1C[C@H](O)COc1ccc([N+](=O)[O-])cc1 3896365 WARJEQFOTAACKB-YDHLFZDLSA-N 308.378 2.597 5 40 DFBB O=C(Nc1ccn(Cc2ccccc2)n1)c1ccc([N+](=O)[O-])o1 46794252 PMFKTLRWDJBDJP-UHFFFAOYSA-N 312.285 2.685 5 40 DFBB CNc1snc(C)c1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 84026769 BFRLHNPJWNVDPT-MRVPVSSYSA-N 320.374 2.892 5 40 DFBB Cc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCCC3)n2)c1 5156580 VTYUYENDAHTABW-UHFFFAOYSA-N 314.349 2.619 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccccc2[N+](=O)[O-])C1 67800664 MMTLDQWOGUSHKN-LLVKDONJSA-N 308.334 2.983 5 40 DFBB Cc1ccc(OCC(=O)Nc2ccc(F)cc2F)c([N+](=O)[O-])n1 9713878 ATUDFGTUPZFKTO-UHFFFAOYSA-N 323.255 2.594 5 40 DFBB O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccncc1F 84425363 KADHOHHDBWMNMJ-UHFFFAOYSA-N 312.260 2.929 5 40 DFBB O=C(NCc1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 40106968 RXVORBZVDPWZDF-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB CS[C@H]1CC[C@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 95990195 HIYQQSZQPANSQN-YUMQZZPRSA-N 316.329 2.887 5 40 DFBB COC(=O)c1ccc(Nc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 5586677 VUUDEWDUADVXGI-UHFFFAOYSA-N 316.269 2.823 5 40 DFBB CN(C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccs1 23105475 ATNNHIKQLPLQQG-CYBMUJFWSA-N 319.386 2.689 5 40 DFBB Cc1c(C(=O)N[C@@H](C)COCC(F)(F)F)cccc1[N+](=O)[O-] 58412434 INBWSJPNDGVKEV-QMMMGPOBSA-N 320.267 2.600 5 40 DFBB C[C@@H]1CC[C@@H](CCC(=O)N(C)Cc2ccc([N+](=O)[O-])cc2)O1 95404148 MXKLNUBQQPESSA-DOMZBBRYSA-N 306.362 2.901 5 40 DFBB Cc1ccc([C@H](C)NCC(=O)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] 95985985 NJQKPPYZGDUPRL-OCCSQVGLSA-N 319.405 2.812 5 40 DFBB O=[N+]([O-])c1c(Nc2ccccn2)ncnc1Nc1ccccn1 5391138 ZNWNLMYGMUBKBC-UHFFFAOYSA-N 309.289 2.662 5 40 DFBB C[N+](C)(C)CCOCCOC(=O)Nc1ccc(Cl)cc1 5535209 YGOBNXOLKJSQKK-UHFFFAOYSA-O 301.794 2.611 5 40 DFBB O=C(COc1ncnc2ccccc12)Nc1cccc([N+](=O)[O-])c1 3228696 UCADDIXIHWSGOX-UHFFFAOYSA-N 324.296 2.556 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)N1CCc2sccc2C1 58158865 JTQGWKQLWAKZLP-UHFFFAOYSA-N 317.370 2.653 5 40 DFBB O=C(OCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])o1 8428011 LTHDVIUWSIHEAT-UHFFFAOYSA-N 313.269 2.731 5 40 DFBB O=[N+]([O-])c1ccc(NCCc2nncn2C2CC2)c2ccncc12 71911599 QVDRBYWOZBZWIA-UHFFFAOYSA-N 324.344 2.724 5 40 DFBB COCc1cc([N+](=O)[O-])ccc1NCc1c(C)cc(C)[nH]c1=O 95407721 KAHBLKYLHJTUTO-UHFFFAOYSA-N 317.345 2.658 5 40 DFBB C[C@@H]1CCO[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 225574943 HELIPBIJOPGYHV-YMTOWFKASA-N 301.302 2.507 5 40 DFBB C[C@@H](Oc1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1 96956342 OYMONPHECZHPSA-LLVKDONJSA-N 311.301 2.711 5 40 DFBB COc1ccc(NC(=O)c2cccnc2Cl)c([N+](=O)[O-])c1 5526785 KOYYZFOLGNLUEP-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB Cc1ccc([C@H](C)NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 13938177 DYMIIJNLLPBJBQ-LBPRGKRZSA-N 320.370 2.943 5 40 DFBB Cc1cc(C)n(-c2ccc(Cn3cc([N+](=O)[O-])ccc3=O)cc2)n1 30533066 BEVZBCDEVKRLTQ-UHFFFAOYSA-N 324.340 2.607 5 40 DFBB COc1ccc(CN(C)C(=O)[C@@H]2C[C@H]3C=C[C@H]2C3)cc1[N+](=O)[O-] 100794264 NKXDQNROEDBBPO-FPMFFAJLSA-N 316.357 2.774 5 40 DFBB O=[N+]([O-])c1cc([N+](=O)[O-])c2ccc(N3CCCCC3)nc2c1O 1710643 DMSOJAGNIDGGKU-UHFFFAOYSA-N 318.289 2.747 5 40 DFBB CC(C)COC[C@H](O)CNc1ccc([N+](=O)[O-])cc1Cl 36391481 HLQPZRIQBGJMSL-LLVKDONJSA-N 302.758 2.694 5 40 DFBB Cc1c(C(=O)OCC(=O)NC2CCCCC2)cccc1[N+](=O)[O-] 3444703 LYVXOWGTQCLPAA-UHFFFAOYSA-N 320.345 2.509 5 40 DFBB CO[C@H]1CCC[C@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145838 RANGKTILZDMNRL-RISCZKNCSA-N 307.350 2.901 5 40 DFBB COc1ccc([C@H](O)[C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 96485325 CINCMBUGBGAPPG-BDJLRTHQSA-N 317.345 2.841 5 40 DFBB C[C@@H](NC[C@@H](O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 6007943 YJRADHWTWDJRKO-CZUORRHYSA-N 316.357 2.685 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(NC2CCCCC2)c([N+](=O)[O-])c1 26508806 WTCIHWMTXPCXJQ-UHFFFAOYSA-N 309.278 2.946 5 40 DFBB COCc1ccccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-] 76018401 YYOUODRBUNOFKM-UHFFFAOYSA-N 312.325 2.944 5 40 DFBB CCOCCCNC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 95456087 RDFJCFDZSGNEEI-UHFFFAOYSA-N 301.730 2.796 5 40 DFBB O=[N+]([O-])c1ccc(SCC[S@](=O)c2ccccc2)nc1 89847810 KXVOHIXWNVTKIW-HXUWFJFHSA-N 308.384 2.890 5 40 DFBB O=[N+]([O-])c1cccc(N[C@@H](c2ccccc2)S(=O)(=O)O)c1 5493696 OPLPOUCFFJDJJY-CYBMUJFWSA-N 308.315 2.593 5 40 DFBB CC(C)[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1Cl 5118542 NWYJZAPGGDQWLD-SECBINFHSA-N 300.742 2.788 5 40 DFBB CC[C@H](Oc1ccc(C)cc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 14189289 ZLMYNPGKMIAZPS-LBPRGKRZSA-N 319.317 2.996 5 40 DFBB O=C(Nc1ccccc1)c1cc([N+](=O)[O-])cc2c1OCCO2 65623071 KGBDZSFQSCUXQB-UHFFFAOYSA-N 300.270 2.618 5 40 DFBB O=C(c1ccc2[nH]cnc2c1)N1CCc2ccc([N+](=O)[O-])cc2C1 84451965 BUEIZPFBNZDPPW-UHFFFAOYSA-N 322.324 2.670 5 40 DFBB COC(=O)c1cnc(N2CCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 225632076 DGVCYEVMJIVLSU-LLVKDONJSA-N 317.301 2.711 5 40 DFBB C[C@H](C[C@@H]1CCCO1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095526 GDLVQLHVNTVSNR-KOLCDFICSA-N 312.753 2.936 5 40 DFBB COc1c(I)ccc(Cl)c1[N+](=O)[O-] 98211028 WRURCGZMBJERKV-UHFFFAOYSA-N 313.478 2.861 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(NCc2ccccc2)c([N+](=O)[O-])c1 5002573 GCDDGQDXDKLREW-UHFFFAOYSA-N 317.257 2.813 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C1CCCCC1 6637036 OSZPXSKFMKWYLS-UHFFFAOYSA-N 321.377 2.806 5 40 DFBB CCCCn1cc[n+](CCc2nc3c([N+](=O)[O-])cccc3[nH]2)c1 13003154 PMVRBZPDEGJYPA-UHFFFAOYSA-N 314.369 2.603 5 40 DFBB CCOC(=O)c1cc(Br)c(OC)c([N+](=O)[O-])c1 20168537 JXCVACLARUCMAW-UHFFFAOYSA-N 304.096 2.543 5 40 DFBB Cc1ccc(CN2CCC[C@H]2Cn2ccnc2)cc1[N+](=O)[O-] 188409530 HHUDGMBAHPMDJM-HNNXBMFYSA-N 300.362 2.764 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 72295042 CPUMGJMLHVPDGN-BNOWGMLFSA-N 319.361 2.838 5 40 DFBB CCc1cc([N+](=O)[O-])cc(Br)c1N1CCOCC1 226315147 JKCYBTALNSTHCE-UHFFFAOYSA-N 315.167 2.756 5 40 DFBB CC1=CC[C@@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3F)C(=O)[C@H]2C1 102553606 OTMTWADLLSVKQZ-QWRGUYRKSA-N 304.277 2.580 5 40 DFBB Cc1cc(C)cc(NC(=O)COc2ccc(C)nc2[N+](=O)[O-])c1 9636844 YNVGEHAOMFAUJH-UHFFFAOYSA-N 315.329 2.933 5 40 DFBB CN(C)[C@H](CNC(=O)Nc1ccccc1[N+](=O)[O-])c1ccco1 24234293 FFOZCGIWWRPKGK-CYBMUJFWSA-N 318.333 2.612 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc3c(n2)[nH]c2ccccc23)nc1 2543372 LUWHVDDEDBDVDL-UHFFFAOYSA-N 324.325 2.961 5 40 DFBB Cc1c(C(=O)O)sc2nc(-c3cccc([N+](=O)[O-])c3)cn12 33418272 JILFXSWJWKBMJT-UHFFFAOYSA-N 303.299 2.978 5 40 DFBB C[N+]1(C[C@@H](O)COc2ccc(Cl)cc2Cl)CCCC1 41690087 RBEXVCSPLQMHCM-GFCCVEGCSA-N 305.225 2.974 5 40 DFBB CCC[C@@H](C)NC(=O)CN(CC)Cc1ccccc1[N+](=O)[O-] 40087768 LFIPUFPNJHSIBQ-CYBMUJFWSA-N 307.394 2.722 5 40 DFBB O=C(Nc1ccccc1F)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2780081 VWOJHSAICULOJX-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 3166760 WSRROVAMYBYUEE-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=[N+]([O-])c1cnc(NCCCOC2CCOCC2)c(Cl)c1 76063502 TUPBGSRZHRAUGF-UHFFFAOYSA-N 315.757 2.641 5 40 DFBB Cc1cc(C)n2c(SCc3ccc([N+](=O)[O-])cc3)nnc2n1 3270341 JUFUZFKKROFSOG-UHFFFAOYSA-N 315.358 2.942 5 40 DFBB Cc1cc(C(=O)NCCOCc2ccccc2)ccc1[N+](=O)[O-] 177072086 NWBLSIXDBKGFKD-UHFFFAOYSA-N 314.341 2.850 5 40 DFBB O=C(O)COc1cc(O)c2c(=O)c3cc(Cl)ccc3oc2c1 5345498 JJGNYINAFGVMAH-UHFFFAOYSA-N 320.684 2.769 5 40 DFBB Cc1cc(N(C)C[C@H]2CCOC2)c2cc([N+](=O)[O-])ccc2n1 96008498 HFHYDEIJZUHVKS-GFCCVEGCSA-N 301.346 2.924 5 40 DFBB O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F 17032074 UMTZIGJKVNAMAJ-UWVGGRQHSA-N 310.281 2.563 5 40 DFBB CC(C)=C1[C@H]2C=C[C@H]1[C@@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21 253560465 AVKFLDKUMSOHKX-VDERGJSUSA-N 324.336 2.853 5 40 DFBB COc1ncnc(Sc2ccc(Cl)cc2[N+](=O)[O-])c1N 340959 WZDFSINRNAZLQQ-UHFFFAOYSA-N 312.738 2.780 5 40 DFBB CC[N+](C)(CC)CCC[C@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O 4723006 YXUAYPZTVHXYSJ-HRCADAONSA-N 309.474 2.817 5 40 DFBB O=[N+]([O-])c1cccnc1NCc1cccc(Cn2cccn2)c1 54837004 FCLUVAONGGTTSL-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc([N+](=O)[O-])c1 5717275 LWKBPNVUZYUIID-UHFFFAOYSA-N 301.258 2.684 5 40 DFBB Cc1cccc(OCCNC(=O)c2cccc([N+](=O)[O-])c2)c1 18147362 MKZGVCLSCMLEBA-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB COc1ccc(-n2c(C)nc3ccccc3c2=O)c([N+](=O)[O-])c1 207354 AMKHIGNMZSQPHB-UHFFFAOYSA-N 311.297 2.611 5 40 DFBB COC(=O)c1ccn(-c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 12395992 YDRMVEHNRMDTDT-UHFFFAOYSA-N 315.207 2.586 5 40 DFBB NC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 73640123 UKRMRMXCUVMFQP-UHFFFAOYSA-N 311.091 2.716 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc(F)cc1F 255558 XXZVDFMPIJKYJF-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB COc1ccccc1NC(=O)[C@@H](C)n1nc(C)c([N+](=O)[O-])c1C 341131 ZRRFHYWAKSQKQV-LLVKDONJSA-N 318.333 2.616 5 40 DFBB O=C(NCc1ccc(F)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3093747 DNTBZEUXYSEVQB-UHFFFAOYSA-N 319.248 2.572 5 40 DFBB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)c1ccc([N+](=O)[O-])cn1 13012931 BHHNFSLMUFKZPZ-LBPRGKRZSA-N 324.344 2.768 5 40 DFBB Cc1[nH]ncc1CCCNC(=O)c1cccc(Cl)c1[N+](=O)[O-] 80599989 LJRBNZBLLBUOMD-UHFFFAOYSA-N 322.752 2.642 5 40 DFBB CC[C@@H]1COCCN1C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 96455216 HFQRNGPTQPNQRV-TZMCWYRMSA-N 321.377 2.785 5 40 DFBB Cc1cc(NC(=O)N2C[C@H]3CCCN3C[C@@H]2C)ccc1[N+](=O)[O-] 97096001 WKOKHEYPKGPHDA-GXTWGEPZSA-N 318.377 2.604 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCN([C@H]3C[C@@H]4CC[C@@H]3C4)CC2)cc1 100803000 PGHIRDZUMYBGEF-NUJGCVRESA-N 315.417 2.901 5 40 DFBB CC(=O)c1ccc(NC[C@H](CO)Cc2ccco2)c([N+](=O)[O-])c1 12753909 CGSRDCAYYYUAPH-GFCCVEGCSA-N 318.329 2.654 5 40 DFBB CC(=O)c1ccc(N2CCC[C@@H](N3CCCC3)C2)c([N+](=O)[O-])c1 48343303 ORSWSRVJLMPWBP-OAHLLOKOSA-N 317.389 2.862 5 40 DFBB CCCCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 8780268 AGDLBWLMBOBHSJ-UHFFFAOYSA-N 305.378 2.728 5 40 DFBB CC1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 6637361 NQCMFDRITXOCBH-UHFFFAOYSA-N 311.769 2.919 5 40 DFBB COC[C@H](C)C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 95943182 NATDLOJNVVGVAL-VIFPVBQESA-N 303.318 2.672 5 40 DFBB CC(C)(NC(=O)c1ccncc1F)c1ccc([N+](=O)[O-])cc1 79630895 DZHIUUCPBIOIPU-UHFFFAOYSA-N 303.293 2.794 5 40 DFBB COc1ccc(C)cc1S(=O)(=O)Nc1ccc([N+](=O)[O-])cc1 223254202 NWKDXMNDKNNJPV-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB CC(=O)c1c(C)cc(C)c(Cn2cc([N+](=O)[O-])ccc2=O)c1C 28187258 NLDDYDBODHLGLN-UHFFFAOYSA-N 314.341 2.933 5 40 DFBB Cc1ccc(NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])cc1 3502556 UVRUTLCQCJUMOS-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC([C@@H](O)c3ccccc3)CC2)nc1 22406233 HBOABQFYABPMNL-KRWDZBQOSA-N 313.357 2.940 5 40 DFBB CC(C)(C)OC(=O)Cn1ccc(-c2ccc([N+](=O)[O-])cc2)n1 91695961 UZKMUGSFHCGVNT-UHFFFAOYSA-N 303.318 2.800 5 40 DFBB CCn1cnnc1[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 89310066 WTWBXKRTWANGME-AWEZNQCLSA-N 315.377 2.586 5 40 DFBB CN(C)c1cccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c1 390833005 ANGVFBNZBKLOJE-UHFFFAOYSA-N 313.357 2.633 5 40 DFBB O=C(NCc1ccco1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 8180727 QLIFFZVOEXGLPE-UHFFFAOYSA-N 301.302 2.692 5 40 DFBB CCOC(=O)c1ccc([C@@H](O)c2ccccc2)c([N+](=O)[O-])c1 21990614 JIOSDTQFIXMHSE-HNNXBMFYSA-N 301.298 2.853 5 40 DFBB O=C1Nc2ccccc2[C@@]12CCN[C@@H]2c1ccc([N+](=O)[O-])cc1 61719461 UCBLNISWHNMWHE-NVXWUHKLSA-N 309.325 2.519 5 40 DFBB COc1ccc(OCC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 3471981 PDPWAZPCHIRJDN-UHFFFAOYSA-N 317.297 2.726 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCOC1 96007649 RHABJYJXIGVMDH-QMMMGPOBSA-N 318.251 2.979 5 40 DFBB CN(C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccs1 23105473 ATNNHIKQLPLQQG-ZDUSSCGKSA-N 319.386 2.689 5 40 DFBB Cc1ccc(C(=O)O)cc1NC(=O)c1ccccc1[N+](=O)[O-] 12030688 NFLROBNSFALMTC-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])ccc1Oc1cccc([N+](=O)[O-])c1 1677208 QXCOVIYBYGBDIX-UHFFFAOYSA-N 304.214 2.994 5 40 DFBB CC1=C(C)C[C@@H](C(=O)O)[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)C1 4651859 GILTVGMGRNATNP-UONOGXRCSA-N 318.329 2.981 5 40 DFBB CS(=O)(=O)Nc1ccc2sc3ccccc3c(=O)c2c1 4783700 GZGABLSPCYMMDZ-UHFFFAOYSA-N 305.380 2.786 5 40 DFBB Cc1nc(-c2ccc(NC[C@@H]3CCCO3)c([N+](=O)[O-])c2)no1 9669031 SIBFYOKHOTWURN-NSHDSACASA-N 304.306 2.544 5 40 DFBB CCOCCC(=O)Nc1ccc([N+](=O)[O-])c(Br)c1 95991452 VAGLMWMGSOCWNB-UHFFFAOYSA-N 317.139 2.722 5 40 DFBB O=[N+]([O-])c1ccc(OCCn2cccn2)c(Br)c1 77955771 MYGSJXSSEYCPJF-UHFFFAOYSA-N 312.123 2.633 5 40 DFBB Cc1cc(S(=O)(=O)Nc2cc(C(C)C)[nH]n2)ccc1[N+](=O)[O-] 96469247 GTEOJBMIJRGHQR-UHFFFAOYSA-N 324.362 2.551 5 40 DFBB Cc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1[N+](=O)[O-] 253670 PMIDROXZNFCCLL-RYUDHWBXSA-N 304.302 2.509 5 40 DFBB O=C(COc1cccnc1[N+](=O)[O-])Nc1ccccc1Cl 2625419 HAKLQPBEICKKFS-UHFFFAOYSA-N 307.693 2.661 5 40 DFBB CCCCS(=O)(=O)c1nc2ccc([N+](=O)[O-])cc2s1 1737141 UMUQMVREVLOMTE-UHFFFAOYSA-N 300.361 2.778 5 40 DFBB O=C(COC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(F)cc1 1918915 VSQCDIAZRGMWAM-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB C[C@H](OC(=O)C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5117489 RVRBWWZHOWEEAC-ZETCQYMHSA-N 312.709 2.528 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1)N1C=CC(C(F)(F)F)=NCC1 5860978 PQBPOYZTKCUIPX-UHFFFAOYSA-N 313.235 2.568 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(C)n2)c1 79082655 MVCSBZOVGLOKSS-UHFFFAOYSA-N 308.315 2.725 5 40 DFBB COc1ccc(CNc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 314089029 GTBXFWALBKCLLC-UHFFFAOYSA-N 302.286 2.914 5 40 DFBB O=c1c2ccccc2ncn1CCCNc1ccc([N+](=O)[O-])cc1 12360125 XNUQYVUFIOXYIU-UHFFFAOYSA-N 324.340 2.807 5 40 DFBB O=C(Nc1nc(-c2ccncc2)cs1)c1ccc([N+](=O)[O-])o1 4063467 CGBVRMMQZJTHDL-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(SCc3ccco3)cc21 20178537 XURZKNUSOASDBE-UHFFFAOYSA-N 319.342 2.671 5 40 DFBB CNc1ccc(C(=O)c2ccccc2C(=O)O)cc1[N+](=O)[O-] 3887869 IWYFGKJOJCJJBV-UHFFFAOYSA-N 300.270 2.566 5 40 DFBB Cc1c(CSCc2nnnn2C2CC2)cccc1[N+](=O)[O-] 78555675 WGOXXWCVDMPNRO-UHFFFAOYSA-N 305.363 2.658 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1C[C@@H]1CCC2(CCCC2)O1 225552745 WUVGKEZUAUMSFQ-LBPRGKRZSA-N 318.329 2.995 5 40 DFBB CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@](O)(CC(C)C)C1 5296634 ABVZMMRXUJWCMH-HNNXBMFYSA-N 305.334 2.551 5 40 DFBB Cc1ccc(OS(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)c1 16086044 JKWXQIIQKXPVDD-UHFFFAOYSA-N 307.327 2.979 5 40 DFBB C[C@H](OC(=O)c1ccc2nncn2c1)c1ccc([N+](=O)[O-])cc1 73091714 SCBBXGCFJWNVDV-JTQLQIEISA-N 312.285 2.556 5 40 DFBB Cc1cc(C)nc(SCC(=O)c2cccc([N+](=O)[O-])c2)n1 580822 DPJZEEFBSSSVAS-UHFFFAOYSA-N 303.343 2.977 5 40 DFBB CC(=O)Cn1nc([N+](=O)[O-])nc1Sc1ccc(Cl)cc1 2194837 ATQXPMQCQWCWOY-UHFFFAOYSA-N 312.738 2.580 5 40 DFBB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1c1ccc(Cl)cc1[N+](=O)[O-] 4121659 KAHSFYVVEJYGAL-XXHBBNRNSA-N 318.716 2.560 5 40 DFBB C[C@@H]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 4902661 QCMXOCZIINIRHH-SNVBAGLBSA-N 311.769 2.919 5 40 DFBB O=C(NCCNc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 4703604 AAGMIKKLMQMYKY-UHFFFAOYSA-N 309.709 2.683 5 40 DFBB O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC2(CCCCC2)CC1 69464111 PHGIWZQUKDRTCJ-UHFFFAOYSA-N 320.393 2.754 5 40 DFBB CCN(C)c1nc(N)c([N+](=O)[O-])c(Nc2ccc(C)c(C)c2)n1 5253068 BVLKQVGUVZLFIZ-UHFFFAOYSA-N 316.365 2.784 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@H](CO)C2)c(C(F)(F)F)c1 40452901 JNPNEIFVXQBUJX-VIFPVBQESA-N 304.268 2.822 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCc1cc(F)cc2c1OCOC2 69842845 QCEDSLBMAIRNFS-UHFFFAOYSA-N 319.292 2.916 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1SC 515906 DMTQSOCAUPSGEG-UHFFFAOYSA-N 319.342 2.973 5 40 DFBB O=C(Nc1cccc(CNc2ccc([N+](=O)[O-])cn2)c1)C1CC1 24776869 WYOMQRADIRWGAM-UHFFFAOYSA-N 312.329 2.950 5 40 DFBB CC(C)(C)c1ncc(NC(=O)c2ccccc2[N+](=O)[O-])cn1 58225367 WPFIPVQMEMLTOW-UHFFFAOYSA-N 300.318 2.935 5 40 DFBB O=[N+]([O-])c1c(NC[C@@H](O)c2ccccc2F)nc2sccn12 58244488 WMOJLHZVUVPKFB-SNVBAGLBSA-N 322.321 2.589 5 40 DFBB CO[C@@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(C)C 72511521 CGNHORVNVNYPHX-NSHDSACASA-N 300.742 2.649 5 40 DFBB O=C(OC[C@H]1COc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 230261 NDQMLLNUSKDSOY-CYBMUJFWSA-N 315.281 2.592 5 40 DFBB O=C(O)C(C(=O)O)[C@H](O)c1c2ccccc2cc2ccccc12 1593359 VEEGYXRUTFERSX-MRXNPFEDSA-N 310.305 2.812 5 40 DFBB O=[N+]([O-])c1ccc([C@@H](O)CNc2cnc3ccccc3n2)cc1 26134730 RRCSFRFSEKKQHI-HNNXBMFYSA-N 310.313 2.684 5 40 DFBB Cc1c(C(=O)Oc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] 3552320 AIWACTHGSLJEDD-UHFFFAOYSA-N 301.254 2.851 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=[S@]2c1ccccc1 239563089 VGSDTSNHRDFNOG-IBGZPJMESA-N 308.340 2.517 5 40 DFBB CCSC1=NCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl 4119777 ALQMEKFMBQVCOQ-UHFFFAOYSA-N 313.766 2.813 5 40 DFBB Cc1cccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)c1 3383733 UFHJFVGIWARFHM-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(NC2CCCCC2)n1 4306000 QNPCTIDHZGAREG-VIFPVBQESA-N 308.386 2.922 5 40 DFBB CN(C1CCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl 48375394 BTEXYXFVUWUCNB-UHFFFAOYSA-N 318.782 2.811 5 40 DFBB COc1ccc([C@H](CO)N(C)Cc2ccc([N+](=O)[O-])cc2)cc1 71904379 WGXMFQLSRPFRSQ-KRWDZBQOSA-N 316.357 2.769 5 40 DFBB O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 3301536 ROYQMXVXLSMLCT-UHFFFAOYSA-N 315.281 2.723 5 40 DFBB Cc1ccc(NC(=O)CSc2nnc(C)s2)c([N+](=O)[O-])c1 5054419 BHLBOJMKINBPDW-UHFFFAOYSA-N 324.387 2.794 5 40 DFBB C[C@@H]1CCCC[C@]12NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C2=O 14071234 XHMJFJKYYHYPLV-BZNIZROVSA-N 317.345 2.596 5 40 DFBB O=c1c2ccccc2cnn1-c1cc(Cl)ccc1[N+](=O)[O-] 4740987 NALIKFRNOWDDRN-UHFFFAOYSA-N 301.689 2.947 5 40 DFBB O=[N+]([O-])c1ccc2nc(NCCOC[C@H]3CCCO3)sc2c1 95397629 WCTIVTBGVKWGFT-LLVKDONJSA-N 323.374 2.812 5 40 DFBB Cc1cc(C)n(C[C@@H](C)CNCc2cc(O)ccc2[N+](=O)[O-])n1 89594086 CBTIZINZUAIJHB-NSHDSACASA-N 318.377 2.540 5 40 DFBB CC(C)(C)OC(=O)N1CCC(CCn2nccc2[N+](=O)[O-])CC1 194532332 IMRCEJSMYGJGTG-UHFFFAOYSA-N 324.381 2.829 5 40 DFBB CSCCCCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 87113319 CPDLUSLEZSTICX-UHFFFAOYSA-N 323.418 2.806 5 40 DFBB CCOC(=O)c1cnc2c(ccc3c(O)c([N+](=O)[O-])cnc32)c1 95080521 SVVWANINJIPEPI-UHFFFAOYSA-N 313.269 2.574 5 40 DFBB Cc1ccc([N+](=O)[O-])c(NCC(C)(C)CCS(C)(=O)=O)c1 95410409 DZHFXPNHORWXHP-UHFFFAOYSA-N 314.407 2.776 5 40 DFBB COc1ccccc1/C=C1\N=C(c2ccc([N+](=O)[O-])cc2)OC1=O 315329 UTJNMHDBWIPVDL-UVTDQMKNSA-N 324.292 2.948 5 40 DFBB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(c1ccc([N+](=O)[O-])cc1)C2=O 5231741 SHXWIOVGQIERGV-BLLLJJGKSA-N 302.330 2.911 5 40 DFBB Cc1ccc(C)n1NC(=O)CSc1ccc([N+](=O)[O-])cc1 59549617 XVPOCMNGLWFZMJ-UHFFFAOYSA-N 305.359 2.876 5 40 DFBB CC(=O)c1ccc(Oc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 6905892 GKTJBMAYDSRIGP-UHFFFAOYSA-N 300.270 2.689 5 40 DFBB Cc1ccc(CN(C)C(=O)CCOc2ccccc2[N+](=O)[O-])o1 54941617 ANNMAYBADLYFLH-UHFFFAOYSA-N 318.329 2.924 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(N2C[C@H](C)C[C@@H](C)C2)n1 4306031 ZNYAEDLRANXLOJ-GHMZBOCLSA-N 322.413 2.517 5 40 DFBB O=[N+]([O-])c1cccnc1NC[C@H](c1ccco1)N1CCCC1 15171875 WPGILECCDXZIPW-CYBMUJFWSA-N 302.334 2.832 5 40 DFBB N=C1NC(=O)/C(=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)S1 5027266 WIXHPRFJYXUIND-XYOKQWHBSA-N 314.326 2.524 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H]3C=C[C@H](CC3)[C@H]2C1=O 2967815 BPBSXZMLLWDWFB-HGSJOUDDSA-N 312.325 2.605 5 40 DFBB CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)c2ccccc2)c1 95974945 HHHFBPXCKKLCKG-OAHLLOKOSA-N 302.330 2.773 5 40 DFBB CC/C=C/CCn1cc(Br)cc([N+](=O)[O-])c1=O 186268930 HPHALGCULQQIEG-ONEGZZNKSA-N 301.140 2.875 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)C1CC1 29269211 JCMVXQWPQCEDBF-UHFFFAOYSA-N 300.314 2.922 5 40 DFBB O=C(Nc1n[nH]c(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 12903779 NAXYFXFRBQJVMM-UHFFFAOYSA-N 309.285 2.632 5 40 DFBB COc1ccc(OCC(=O)N(C)C2CCCCC2)c([N+](=O)[O-])c1 6561098 JEIDLADZSCBQOD-UHFFFAOYSA-N 322.361 2.773 5 40 DFBB O=[N+]([O-])c1ccc(NCC2(O)CCOCC2)cc1C(F)(F)F 96446531 ZMNPWQWGQPALFF-UHFFFAOYSA-N 320.267 2.567 5 40 DFBB O=C1NC(c2ccc([N+](=O)[O-])cc2)=N/C1=C\c1ccc(F)cc1 5569247 QSMPVVNPLDOENU-ZROIWOOFSA-N 311.272 2.651 5 40 DFBB COc1ccc2c(c1OC)C(=O)N(c1ccc([N+](=O)[O-])cc1)C2 4597861 DATVMTCBVLCBTL-UHFFFAOYSA-N 314.297 2.772 5 40 DFBB O=c1onc(-c2cccs2)n1Cc1cccc([N+](=O)[O-])c1 58356970 OOHVPJTUJCZANW-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])c1 3896263 FDNBTWDCFRAGEC-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=C(O)/C=C\C(=O)Nc1ccc2oc(=O)c3ccccc3c2c1 31647995 ZTKDUXFMFYGBPZ-FPLPWBNLSA-N 309.277 2.526 5 40 DFBB COc1cc(N2CCC[C@@H]2Cn2ccnc2C)ccc1[N+](=O)[O-] 225598200 CDIYOCAFEGJFJO-CQSZACIVSA-N 316.361 2.777 5 40 DFBB CC[S@](=O)[C@@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C)C1 267409404 RKACEZLURLGEQM-FTFVXWMISA-N 311.407 2.790 5 40 DFBB C[C@@H](Oc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 55797977 UDHQGVWLSFUOFZ-GFCCVEGCSA-N 300.314 2.679 5 40 DFBB O=[N+]([O-])c1ccc(-c2cc(-c3ccco3)n3ncnc3n2)cc1 12321978 PKCCAMHIKUDMJB-UHFFFAOYSA-N 307.269 2.960 5 40 DFBB CCNc1ncc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)s1 95429507 DAQJXCPYOAJDPU-UHFFFAOYSA-N 318.358 2.639 5 40 DFBB CC(C)OCCCn1cc([N+](=O)[O-])c(-c2ccc(F)cn2)n1 521395044 YEWCYHXLCGJFNC-UHFFFAOYSA-N 308.313 2.808 5 40 DFBB CCc1cnc(CCNC(=O)c2cc(F)ccc2[N+](=O)[O-])s1 81204602 MBCOAPWJTDNRJN-UHFFFAOYSA-N 323.349 2.725 5 40 DFBB CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1ncn(C)c1=S 57103900 UFERUNHJKBBGRI-UHFFFAOYSA-N 321.406 2.727 5 40 DFBB CCc1ccc(NC(=O)COCC(F)(F)F)cc1[N+](=O)[O-] 40548508 IPQFVIHDRZUSNT-UHFFFAOYSA-N 306.240 2.675 5 40 DFBB O=[N+]([O-])c1ccc(CCn2cnc3c(Cl)ncnc32)cc1 1609823 DYODDZLYLWSZJE-UHFFFAOYSA-N 303.709 2.631 5 40 DFBB O=[N+]([O-])c1nn(-c2ccccc2)[n+]([O-])c1NC1CCCCCC1 4968651 IHIGRRXPIYOUNL-UHFFFAOYSA-N 317.349 2.549 5 40 DFBB Cc1c(NC(=O)c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] 8268014 JFYFOVGHKRQRPM-UHFFFAOYSA-N 314.297 2.927 5 40 DFBB O=C(COC(=O)CC1CCCC1)Nc1ccc(F)c([N+](=O)[O-])c1 3363424 LKMMTWGJASKNOO-UHFFFAOYSA-N 324.308 2.796 5 40 DFBB C[C@@H](Nc1nc(Cl)nc(N)c1[N+](=O)[O-])[C@H]1C[C@H]2CC[C@H]1C2 110552208 FOHGDLUCLPXOLZ-RYPBNFRJSA-N 311.773 2.857 5 40 DFBB O=C(NC[C@@H]1CCCS1)c1cc(Cl)ccc1[N+](=O)[O-] 96462155 DFLFEZCWUZRAON-VIFPVBQESA-N 300.767 2.874 5 40 DFBB O=[N+]([O-])c1cnn(CCN[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 130222392 KVAMYHJVFADLLK-VHSXEESVSA-N 306.288 2.502 5 40 DFBB C[C@H]1C[C@@H](C)n2nccc2N1C(=O)Cc1cccc([N+](=O)[O-])c1 96425041 OTLFVIICEKNDCQ-NWDGAFQWSA-N 314.345 2.720 5 40 DFBB O=[N+]([O-])c1cc(Br)cc([C@@H](O)C(F)(F)F)c1 1857793229 RFQAGULHLKWJLB-SSDOTTSWSA-N 300.030 2.953 5 40 DFBB O=C(NC[C@@H](O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 32760805 UPFIMGVLQXBXAI-CQSZACIVSA-N 320.732 2.712 5 40 DFBB COc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 3515349 JIHWULXNTGDUBF-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB COCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N 97000186 PORFHQJTLBPXSY-UHFFFAOYSA-N 301.302 2.576 5 40 DFBB COc1cc(NCCc2cn3ccccc3n2)ccc1[N+](=O)[O-] 76061533 JMINGUPFUILVBV-UHFFFAOYSA-N 312.329 2.906 5 40 DFBB CCN(C(=O)[C@H](C)Oc1cccnc1[N+](=O)[O-])c1ccccc1 7045017 BWAIWDWOLNSINT-LBPRGKRZSA-N 315.329 2.810 5 40 DFBB COc1ccc(NC(=O)c2cc(Cl)ccn2)cc1[N+](=O)[O-] 97082820 MOLGVTFPUHHTTF-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc2[nH]ccc2c1 71903709 REOJGLAWIYOSEF-UHFFFAOYSA-N 317.326 2.877 5 40 DFBB Cn1cc(CNCc2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 95431714 AFYRXNBITFPZLP-UHFFFAOYSA-N 314.267 2.637 5 40 DFBB CC(C)(NC(=O)CCc1ccccn1)c1ccc([N+](=O)[O-])cc1 89761853 UWVLELIJYZIZQT-UHFFFAOYSA-N 313.357 2.974 5 40 DFBB Cc1nn(C)cc1C(=O)OCc1ccc([N+](=O)[O-])cc1Cl 180254760 RDICZQALNVULGV-UHFFFAOYSA-N 309.709 2.647 5 40 DFBB CCCc1cc(=O)[nH]c(SCc2csc([N+](=O)[O-])c2)n1 47171740 QCVPIKGTMICQJD-UHFFFAOYSA-N 311.388 2.984 5 40 DFBB Cc1nc(NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])sc1-c1ccccc1 44492447 PEOQSCKWJAIQNQ-MNOVXSKESA-N 303.343 2.722 5 40 DFBB Cc1ccccc1NC(=O)Cn1ncc2c([N+](=O)[O-])cccc21 97102716 PCUDPFNJGUMDEI-UHFFFAOYSA-N 310.313 2.892 5 40 DFBB COc1ccc([C@@H](CO)N(C)Cc2cccc([N+](=O)[O-])c2)cc1 83864183 VSZOOHGGOWLTJW-QGZVFWFLSA-N 316.357 2.769 5 40 DFBB CNc1snc(C)c1C(=O)OCc1csc([N+](=O)[O-])c1 84026868 IOWOYXSGEZBBKT-UHFFFAOYSA-N 313.360 2.820 5 40 DFBB O=[N+]([O-])c1cccc(-c2ccc3nnc(-c4cccnc4)n3n2)c1 409422181 WZOIMLZHYAMVNX-UHFFFAOYSA-N 318.296 2.762 5 40 DFBB Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3CC2)cc1[N+](=O)[O-] 100522373 FUMNLCOHMGSPJE-GVARAGBVSA-N 312.325 2.605 5 40 DFBB CC(C)(C)c1nnc2n1N=C(c1cccc([N+](=O)[O-])c1)CS2 27525973 UGDBQXDJZXGCRQ-UHFFFAOYSA-N 317.374 2.842 5 40 DFBB C[C@@H]1CCCC[C@@H]1NC(=O)NCCNc1ccccc1[N+](=O)[O-] 12642033 SSXCYYNRGIPZMF-OLZOCXBDSA-N 320.393 2.885 5 40 DFBB C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC1CCCCC1 6062692 HBAOYLLWRMMORD-NSHDSACASA-N 320.345 2.589 5 40 DFBB CCc1nc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 78164292 RIGLNMWSHGYWNZ-UHFFFAOYSA-N 315.358 2.921 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1OCC1CCNCC1 42783042 KAXSDPQWHOKJPX-UHFFFAOYSA-N 304.268 2.992 5 40 DFBB Cc1nc(C)c(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])o1 95436694 TUGVUTFJFYNCCI-UHFFFAOYSA-N 301.302 2.793 5 40 DFBB O=[N+]([O-])c1cccc2c1nnn2CNc1cccc2cccnc12 5338226 HSLVLDIIMSHZJR-UHFFFAOYSA-N 320.312 2.957 5 40 DFBB COc1ccc(C(=O)[C@@H](C)Oc2ccc(C)nc2[N+](=O)[O-])cc1 5970342 RRWRRVXBHZNJIQ-LLVKDONJSA-N 316.313 2.957 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C1CC1)[C@@H](C)C1CC1 30337041 QNXDHKOLHCKTNF-NSHDSACASA-N 324.402 2.855 5 40 DFBB COC(=O)c1noc(C)c1COc1cc(C)ccc1[N+](=O)[O-] 12396661 VVKNDEWSBOISCG-UHFFFAOYSA-N 306.274 2.565 5 40 DFBB O=C(Nc1ccc(C(=O)O)cc1)Nc1ccc([N+](=O)[O-])cc1 4892440 WAMAJEDCQWPNLF-UHFFFAOYSA-N 301.258 2.937 5 40 DFBB N[C@@H](Cc1ccccc1)c1n[nH]c(-c2ccccc2[N+](=O)[O-])n1 95534838 RHPUPHUTMGUYDV-ZDUSSCGKSA-N 309.329 2.622 5 40 DFBB CCc1nc(CCNC(=O)c2cccc(C)c2[N+](=O)[O-])cs1 69441772 DUZATWAJSHUGCL-UHFFFAOYSA-N 319.386 2.895 5 40 DFBB COc1ccc(C(=O)Oc2ccc(C=O)cc2[N+](=O)[O-])cc1 221922 MLCDSPRIRLTSIL-UHFFFAOYSA-N 301.254 2.635 5 40 DFBB O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(F)cc2)ccc1F 304410 SFNPQAYBVTVUPA-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB COc1c([N+](=O)[O-])cc(Cl)c([N+](=O)[O-])c1Br 12505268 CLRRHFYLLKMFLL-UHFFFAOYSA-N 311.475 2.928 5 40 DFBB Cc1cccc(C(=O)N[C@H](C)c2c(C)nn(C)c2C)c1[N+](=O)[O-] 95395611 CAOIHKVIBBGALQ-SNVBAGLBSA-N 316.361 2.745 5 40 DFBB CCc1ccc(NC(=O)N[C@@H](C)c2cnn(C)c2)cc1[N+](=O)[O-] 95403804 NZWZZLVPQRYPLU-JTQLQIEISA-N 317.349 2.773 5 40 DFBB O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc(-c2ccncc2)n[nH]1 95962355 CQCXCNHOGFMECS-UHFFFAOYSA-N 323.312 2.561 5 40 DFBB COc1ccc(C2=N/C(=C/c3cccc([N+](=O)[O-])c3)C(=O)O2)cc1 430738 NUQAKBHOJXKLPT-XNTDXEJSSA-N 324.292 2.948 5 40 DFBB Cc1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)cccc1[N+](=O)[O-] 38646 FXXSORVGKIPXPK-MNOVXSKESA-N 306.318 2.733 5 40 DFBB C[C@@H]1CCCC[C@]12NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C2=O 2619918 CLLNGRROACEWTM-BZNIZROVSA-N 317.345 2.596 5 40 DFBB Cc1c(C(=O)Nc2nnc(C3CC3)s2)cccc1[N+](=O)[O-] 2616679 YRJVKNLFVUXGHO-UHFFFAOYSA-N 304.331 2.884 5 40 DFBB Cc1nn(C)cc1COC(=O)c1ccc([N+](=O)[O-])cc1Cl 2783014 DNADZZZLTWOHDB-UHFFFAOYSA-N 309.709 2.647 5 40 DFBB O=Cc1cc([N+](=O)[O-])ccc1Sc1ccc([N+](=O)[O-])cn1 408605211 LAGLVGZDOJTSLN-UHFFFAOYSA-N 305.271 2.862 5 40 DFBB CCn1ccs/c1=N\C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 408561974 MGOWECSXRIKIQW-OWBHPGMISA-N 311.750 2.872 5 40 DFBB CCS[C@@H]1CCC[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 96450514 LTTSQBUCCBYJIJ-ZIAGYGMSSA-N 308.403 2.928 5 40 DFBB O=C(c1ccc(O)cc1F)N1CCc2ccc([N+](=O)[O-])cc2C1 164756208 JZEOOKBMVVQSME-UHFFFAOYSA-N 316.288 2.638 5 40 DFBB CCN(CC)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 4182323 SAPCUOAGJIIDAQ-CYBMUJFWSA-N 305.378 2.680 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]3C2=O)C42CC2)cc1[N+](=O)[O-] 101024772 OJTCDNPDVDMLQF-NZBPQXDJSA-N 324.336 2.605 5 40 DFBB COc1ccc(C(=O)OCC(=O)c2ccccc2)cc1[N+](=O)[O-] 3228800 WBMXITBTBXNKHC-UHFFFAOYSA-N 315.281 2.643 5 40 DFBB COc1ccc(NC(=O)NCc2cccs2)cc1[N+](=O)[O-] 96008052 NXSYEUHSOUUYAI-UHFFFAOYSA-N 307.331 2.987 5 40 DFBB Cc1c(C(=O)Nc2ccc(C(=O)O)c(O)c2)cccc1[N+](=O)[O-] 20141009 ATZPVDALVZDBKQ-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[C@@H](O)C1 69509815 OSHLWNXEXIMVKF-ZCFIWIBFSA-N 310.659 2.838 5 40 DFBB C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1ccccc1 70909031 BCTLHXGCWKRLCY-ZDUSSCGKSA-N 314.341 2.721 5 40 DFBB CC(=O)c1ccc(N2CCN(C3CCCC3)CC2)c([N+](=O)[O-])c1 32779320 BBEHCQMZZUPDGI-UHFFFAOYSA-N 317.389 2.862 5 40 DFBB CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccsc1 32857867 IQLOUDAJIJDLCN-UHFFFAOYSA-N 319.386 2.751 5 40 DFBB O=C(NCc1ccc(-n2cccn2)cc1)c1ccccc1[N+](=O)[O-] 32925601 XOTKXPPIVGFMCN-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB CC(=O)N[C@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 97048440 YIYHXOAYERGIJG-JSGCOSHPSA-N 305.378 2.565 5 40 DFBB Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1C(=O)NCc1ccccc1 533758 HRIXUNUQWKTUIQ-UHFFFAOYSA-N 316.361 2.556 5 40 DFBB Cc1ccc(C(=O)N2CCN(c3sccc3[N+](=O)[O-])CC2)o1 97033907 YTXXHAFCMINNLA-UHFFFAOYSA-N 321.358 2.520 5 40 DFBB Cc1cc(C)cc([C@@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)c1 97108015 HQVIXLRWAGDYMX-GFCCVEGCSA-N 314.345 2.564 5 40 DFBB O=[N+]([O-])c1cccc(C(=S)NCc2ccc3c(c2)OCO3)c1 408572049 GIPATXOFISWLAC-UHFFFAOYSA-N 316.338 2.789 5 40 DFBB O=C(COC(=O)CC1CCCC1)Nc1ccccc1[N+](=O)[O-] 6592238 TYCGRMMMAJJEQX-UHFFFAOYSA-N 306.318 2.657 5 40 DFBB CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 75145387 YKIIOOPNJZXZSB-VQISRLSMSA-N 308.353 2.979 5 40 DFBB Cc1n[nH]c(Sc2ccc([N+](=O)[O-])cc2C(=O)OC(C)C)n1 70462414 KAGARGABZSFQQN-UHFFFAOYSA-N 322.346 2.738 5 40 DFBB C[C@@H](O)C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139634425 BACPTLQCQOAGTM-MWLCHTKSSA-N 312.753 2.624 5 40 DFBB CN(Cc1ncnn1C)c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 96486670 QGJOKNPFCHOKIP-UHFFFAOYSA-N 319.365 2.537 5 40 DFBB COc1ccc(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc1Cl 7391651 CUDSYUVYTPJERQ-UHFFFAOYSA-N 323.736 2.953 5 40 DFBB Cc1ccc(NC(=O)N(CC(C)(C)O)C(C)C)cc1[N+](=O)[O-] 84190215 KGHCKZVQIXBXIR-UHFFFAOYSA-N 309.366 2.916 5 40 DFBB COc1cccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 21028622 VCDWQBZZQJOKGN-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB COc1cccc([C@@H](CNc2ncccc2[N+](=O)[O-])N(C)C)c1 7979760 NCCZWWSQALYEPH-OAHLLOKOSA-N 316.361 2.713 5 40 DFBB C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 9364773 FXPXAFYGDLTUCZ-LLVKDONJSA-N 324.340 2.891 5 40 DFBB Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Cl 71899700 PHHBYZVRGFRGPL-MRVPVSSYSA-N 322.752 2.781 5 40 DFBB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc([N+](=O)[O-])c1 9667445 RUNXNYLXDLFKJZ-NSHDSACASA-N 318.354 2.735 5 40 DFBB CCn1c(C)nnc1SCc1cc([N+](=O)[O-])ccc1OC 78729607 RPTUYUGLKQENHD-UHFFFAOYSA-N 308.363 2.816 5 40 DFBB O=C(NC[C@@H]1CCOCO1)c1cc2ccccc2c2cccnc12 95427588 CNNKZXVKEAZTEW-AWEZNQCLSA-N 322.364 2.881 5 40 DFBB O=C(CSCc1cccc([N+](=O)[O-])c1)NCc1ccco1 408726210 JXIJNFLSUQJMCO-UHFFFAOYSA-N 306.343 2.737 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCCOc2ccc(F)cc21 53583104 CFNIUWCNVNVURJ-LLVKDONJSA-N 306.297 2.793 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccc(C)cc1 7952656 TXHKKGDCWLADPY-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB Cn1cc(CNCC2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 78979857 QHQUOQSYZRQXON-UHFFFAOYSA-N 300.362 2.885 5 40 DFBB Cc1cccc(N2CCN(c3ccc([N+](=O)[O-])c(C)n3)CC2)c1 82238003 BIRIAQZTFOYVTD-UHFFFAOYSA-N 312.373 2.933 5 40 DFBB CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)c2ccc[nH]2)c1 14018365 MXOMINPOTIZSDY-UHFFFAOYSA-N 320.326 2.685 5 40 DFBB CCc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 14255661 QKQIDYZTLGDYRH-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB COCc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])s1 25304405 FGSUHNKTIHQDEO-UHFFFAOYSA-N 306.343 2.733 5 40 DFBB C[N+]1(Cc2ccccc2)CC[C@]2(C(N)=O)C[C@@H]1Cc1ccccc12 104116798 NAHKIIKMXCWXGZ-FJOSRBEHSA-O 321.444 2.775 5 40 DFBB CCC(CC)N(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 12854953 LGYYANPFWXEACJ-UHFFFAOYSA-N 300.380 2.712 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1COc2ccccc2O1 9609471 BCTQDFBSIZGHLT-AWEZNQCLSA-N 318.260 2.512 5 40 DFBB COC(=O)c1oc([C@@H](C)Oc2cccnc2[N+](=O)[O-])cc1C 128353659 JDHGGPLKLXZGRE-SECBINFHSA-N 306.274 2.818 5 40 DFBB O=[N+]([O-])c1cnc(Nc2ccccn2)nc1Nc1ccccn1 5337264 IHHSIVSTIFKXLQ-UHFFFAOYSA-N 309.289 2.662 5 40 DFBB O=c1c([N+](=O)[O-])cccn1Cc1ccc(OC(F)(F)F)cc1 161715296 MLIXVBLMLNBHCZ-UHFFFAOYSA-N 314.219 2.703 5 40 DFBB Nc1nc(-c2cccc(O)c2)nc2c1c(=O)oc1ccccc12 5741259 GTLKQFVHQMVWQB-UHFFFAOYSA-N 305.293 2.691 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CC(=O)c1c(C)n(C)c2ccccc12 4945552 JSQBIEJFIHDTMZ-UHFFFAOYSA-N 312.329 2.783 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Nc1ccccc1 8381409 XJWHZHRYCHUOAN-UHFFFAOYSA-N 301.258 2.684 5 40 DFBB CCOc1ccc(NCc2csc([N+](=O)[O-])c2)c(C(N)=O)c1 78903879 YEURMECYKLRHRF-UHFFFAOYSA-N 321.358 2.766 5 40 DFBB CCN(CC(=O)N[C@H](C)C(C)C)Cc1ccccc1[N+](=O)[O-] 40087774 XNKUCFGCAAQHCC-CYBMUJFWSA-N 307.394 2.577 5 40 DFBB Cc1cnc(OCC(=O)N[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 96451057 GOHNWYFZLZTJMX-JTQLQIEISA-N 321.358 2.616 5 40 DFBB Cc1nnc(COc2cc([N+](=O)[O-])ccc2Br)o1 225532976 YPWYRXJZSJZWBQ-UHFFFAOYSA-N 314.095 2.628 5 40 DFBB CC(=O)c1ccc(N[C@@H]2c3ccccc3C[C@@H]2O)c([N+](=O)[O-])c1 53602072 HEYUNRWHLBEUQO-DLBZAZTESA-N 312.325 2.868 5 40 DFBB CC(C)CNc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@@H](C)C2)n1 13768231 ZNYAEDLRANXLOJ-PHIMTYICSA-N 322.413 2.517 5 40 DFBB O=C(COc1ncnc2ccccc12)Nc1ccccc1[N+](=O)[O-] 6536254 XBPMNYFHVNYFLF-UHFFFAOYSA-N 324.296 2.556 5 40 DFBB CC(C)c1ccc(C(=O)N(C)c2nncs2)cc1[N+](=O)[O-] 188217324 UFUBVWMHQYWTHX-UHFFFAOYSA-N 306.347 2.846 5 40 DFBB O=[N+]([O-])c1ccc(-c2nc(CN3CCOCC3)cs2)s1 31333596 ZFIBLEGGEPZAOM-UHFFFAOYSA-N 311.388 2.612 5 40 DFBB COc1cccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1OC 5169461 LJDVMGWFZLJMDL-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)N1CCC[C@@H](C)C1 13371997 WVFRDXIHUPDJRX-YPMHNXCESA-N 305.378 2.962 5 40 DFBB O=C(Oc1ccc2oc(=O)sc2c1)c1ccc([N+](=O)[O-])cc1 94607 GEEOLKWKBRNEQP-UHFFFAOYSA-N 317.278 2.982 5 40 DFBB biogenic CN(C)c1ccc(C(=O)NCc2cccs2)cc1[N+](=O)[O-] 12608315 HBLOPDFOHIRPPS-UHFFFAOYSA-N 305.359 2.652 5 40 DFBB CCc1nn(C)cc1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1O 97114581 QUOXOMREFRMIHZ-UHFFFAOYSA-N 324.724 2.502 5 40 DFBB O=[N+]([O-])c1ccc(N[C@H]2CCN3CCCC[C@@H]23)c([N+](=O)[O-])c1 32932670 OJHNUMDCGWTBNO-STQMWFEESA-N 306.322 2.542 5 40 DFBB COc1ccc(Nc2ncccc2[N+](=O)[O-])cc1NC(C)=O 24214146 GPUNSGODIWKXNJ-UHFFFAOYSA-N 302.290 2.700 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1NC[C@H]([C@@H]1CCOC1)N1CCCC1 44976805 APHADQOHQAZUCW-MLGOLLRUSA-N 323.368 2.647 5 40 DFBB Cc1ccc(F)cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 5126814 ZIQLPUKEKLUFKR-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB CN(C1CCCC1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 32770719 FFSROPCZAZWCBA-UHFFFAOYSA-N 318.782 2.811 5 40 DFBB O=[N+]([O-])C[C@H](OCCCCCCO)C(Cl)(Cl)Cl 1557951 BIMNXYOIXCLXHZ-QMMMGPOBSA-N 308.589 2.571 5 40 DFBB C[N+]1(Cc2ccccc2)CC[C@@]2(C(N)=O)C[C@@H]1Cc1ccccc12 1870400 NAHKIIKMXCWXGZ-ZBUVYOTDSA-O 321.444 2.775 5 40 DFBB Cc1c(NC(=O)c2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] 14287377 GNZXUJHKTCKIDE-JOCHJYFZSA-N 318.354 2.893 5 40 DFBB COc1ccc2c(c1)CN(CCc1ccc([N+](=O)[O-])cc1)CO2 31771899 HOWSKLVZJSJUMT-UHFFFAOYSA-N 314.341 2.998 5 40 DFBB COc1cc(N[C@H](C)C(=O)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] 96429376 SKXDHPKFSAAPPX-VXGBXAGGSA-N 321.377 2.805 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)c1ccccc1 16088937 OTCQFLJPUMIOCV-GFCCVEGCSA-N 320.370 2.943 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1csnn1 11914890 LDRWWKBENYXOFL-UHFFFAOYSA-N 318.236 2.717 5 40 DFBB O=[N+]([O-])c1ccccc1NCCS(=O)(=O)Cc1ccccc1 41620951 ZNYJYXRJBFAXPO-UHFFFAOYSA-N 320.370 2.622 5 40 DFBB CC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 42102668 NSHXZICZHVUDEB-NSHDSACASA-N 312.391 2.625 5 40 DFBB O=[N+]([O-])c1cc(Br)ccc1OC[C@@H]1CCCNC1 42775692 UIGOMKCDUOMMMJ-SECBINFHSA-N 315.167 2.736 5 40 DFBB Cc1ccc(NC(=O)CCn2cnc([N+](=O)[O-])c2)cc1Cl 24256452 NNTQUULYPZJTFD-UHFFFAOYSA-N 308.725 2.782 5 40 DFBB CC(C)[C@@H](CNC(=O)Nc1ccccc1[N+](=O)[O-])N1CCCC1 12738794 VIGZYYGQLPLORU-OAHLLOKOSA-N 320.393 2.837 5 40 DFBB O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(F)cc2F)c1 5428635 MXNWMNCCYYWVGI-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB Cc1nn(C)c(NCCc2nc3c(s2)CCCC3)c1[N+](=O)[O-] 95980018 GZCKVTJLLHZEKY-UHFFFAOYSA-N 321.406 2.627 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccsc2)cc1F 95978085 CVQBMEKZUNBYNF-UHFFFAOYSA-N 302.308 2.596 5 40 DFBB O=C1[C@H](c2cccc([N+](=O)[O-])c2)OC2=Nc3ccccc3N[C@@H]12 1588563 ARUUAPLLTWATDF-ZFWWWQNUSA-N 309.281 2.760 5 40 DFBB O=[N+]([O-])c1c(NC[C@@H]2Cc3ccccc3O2)nc2sccn12 46483806 PFCNVIJKDHEXER-JTQLQIEISA-N 316.342 2.720 5 40 DFBB CCN(C[C@@H]1CCOC1)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 95447724 PCPUAGQFGYXCOK-NSHDSACASA-N 317.345 2.575 5 40 DFBB COc1ccc(C(=O)Nc2cccc([C@H](C)O)c2)cc1[N+](=O)[O-] 226274666 ODLHIEDWRIUCKJ-JTQLQIEISA-N 316.313 2.909 5 40 DFBB CCc1ccccc1N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224743120 MDCDQGGGYJONJF-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB COCc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)c1 25335563 IWDFSJQRQBRTMM-UHFFFAOYSA-N 302.286 2.699 5 40 DFBB CCC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 884865 STJMTXFSTXRCER-UHFFFAOYSA-N 303.274 2.789 5 40 DFBB O=C(O[C@H]1C[C@@H]2CCC[C@@H]21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1767610 OPZSYSWUWGXACD-HJIKLVIJSA-N 306.274 2.848 5 40 DFBB O=C(NCc1ccco1)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 8378569 JJKKSGPWDBMEQZ-UHFFFAOYSA-N 324.296 2.575 5 40 DFBB CCN(Cc1cccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 24740832 SFCYPRJBCWYIMF-UHFFFAOYSA-N 319.386 2.777 5 40 DFBB CN(CCOc1ccccc1F)C(=O)c1ccc([N+](=O)[O-])cc1 12975097 AXQDFQRDIXBMGW-UHFFFAOYSA-N 318.304 2.885 5 40 DFBB O=[N+]([O-])c1ncccc1OCc1cc(Cl)c2c(c1)OCCO2 8132116 DQXVUSMPLPQAMR-UHFFFAOYSA-N 322.704 2.993 5 40 DFBB Cc1c(NC(=O)N(CCN(C)C)CC(C)C)cccc1[N+](=O)[O-] 75105213 UYRATYMXTKDFSG-UHFFFAOYSA-N 322.409 2.955 5 40 DFBB O=C([C@@H]1C[C@H]2CC[C@H]1O2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 107527361 CBWSKHHAHQOHPK-BZUAXINKSA-N 316.357 2.653 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2ccccc21 12746107 JHEGYBWFXYOGNJ-MRXNPFEDSA-N 312.325 2.777 5 40 DFBB O=C(O)c1cn(Cc2ccc(Cl)c(Cl)c2)nc1[N+](=O)[O-] 408716082 IRMWKPAXZAQUCA-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2)cccc1C(=O)O 20140879 SQWOSNNVYFHIRQ-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB CS(=O)(=O)c1ccc(NOCc2ccccc2)c([N+](=O)[O-])c1 67948688 VSVOHRVTYCHOLY-UHFFFAOYSA-N 322.342 2.542 5 40 DFBB Cc1c(NCC(=O)N2CCc3ccccc32)cccc1[N+](=O)[O-] 3273112 ABYPBEKNSIRDNU-UHFFFAOYSA-N 311.341 2.904 5 40 DFBB CC(C)(C)c1cc(NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])n(C(C)(C)C)n1 66664559 LWGXPFVKYUFDGF-VHSXEESVSA-N 308.382 2.539 5 40 DFBB Cc1cc(C)c(O[C@@H](C)C(=O)Nc2cc(C)on2)c([N+](=O)[O-])c1 9365182 RRPKNMUQAAKDON-NSHDSACASA-N 319.317 2.914 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCC(=O)N1CCCCCCC1 83957418 ZFZDJIFWQGGQNF-UHFFFAOYSA-N 321.377 2.808 5 40 DFBB O=C(O)c1cc(OCc2ccc(F)cc2)cc([N+](=O)[O-])c1O 216846137 QDKVRNLXYLGLDK-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB CC[C@@H]1C[N@@+]2(C)CCc3cc(OC)c(OC)cc3[C@H]2CC1=O 247694114 YQACESCIPWFYQC-KPAZRMRSSA-N 304.410 2.747 5 40 DFBB Nc1c(Br)cc(OCC(F)(F)F)cc1[N+](=O)[O-] 169800481 PBOUFFACIRFOSM-UHFFFAOYSA-N 315.045 2.881 5 40 DFBB Cc1ccc(OCC(=O)N[C@H](C)c2ccccc2)c([N+](=O)[O-])n1 12693900 QDEKEUKMQOFAIX-GFCCVEGCSA-N 315.329 2.554 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1c1nc2ccccc2[nH]1 79097774 UUSNQFMBLPPZKX-GFCCVEGCSA-N 312.333 2.546 5 40 DFBB Cc1cc(C(=O)Nc2cccnc2-n2cccn2)ccc1[N+](=O)[O-] 23170635 JUDBAVOPGOPDRJ-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB O=C(Nc1ccc(N2CCCC2)nc1)c1ccccc1[N+](=O)[O-] 25057968 MELBGYDNFWNGEK-UHFFFAOYSA-N 312.329 2.842 5 40 DFBB CO[C@@H]1CCCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1 119833791 INCMXBABFSGAJC-GFCCVEGCSA-N 307.350 2.854 5 40 DFBB CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 29484604 CXJZZMAGPZDBSE-UHFFFAOYSA-N 314.297 2.643 5 40 DFBB Cc1cc(C)n2nc(Sc3ncc([N+](=O)[O-])cc3C)nc2n1 92585076 FZCQGVHOGJNJQT-UHFFFAOYSA-N 316.346 2.504 5 40 DFBB C[C@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 16091284 GZVCVJIIHYNKNV-GFCCVEGCSA-N 320.370 2.677 5 40 DFBB C[C@@H](OC(=O)c1ccc2nncn2c1)c1ccc([N+](=O)[O-])cc1 73091716 SCBBXGCFJWNVDV-SNVBAGLBSA-N 312.285 2.556 5 40 DFBB O=C(Nc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2780087 LWQHDJCWULFHBF-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB COc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC 9647823 PRHMEGDMTOGZNW-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB Cc1cc(NC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)ccc1[N+](=O)[O-] 97096000 WKOKHEYPKGPHDA-JSGCOSHPSA-N 318.377 2.604 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 5107050 VRUZMSRTUADYFF-UHFFFAOYSA-N 315.281 2.628 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2oc1=O 5669463 OCJXWRGYNHKVTL-UHFFFAOYSA-N 310.265 2.954 5 40 DFBB Cc1cnc(NCCCCn2c(C)cccc2=O)c([N+](=O)[O-])c1 78658827 VNVAKTMTJRXGJG-UHFFFAOYSA-N 316.361 2.661 5 40 DFBB Cc1ccccc1NS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 226862844 KXLTZPAHLZGXMF-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB O=[N+]([O-])c1cnn(CCN2CCc3c(Cl)cccc3C2)c1 96445732 DXQFTAFPSHOEDH-UHFFFAOYSA-N 306.753 2.503 5 40 DFBB C[C@H](C1CC1)N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 58356241 MYGRWWXBLNUVAW-SNVBAGLBSA-N 302.334 2.875 5 40 DFBB CCOc1ccc([N+](=O)[O-])cc1CNC1CCN(C2CC2)CC1 69528685 CDAVVJDAGHQQCK-UHFFFAOYSA-N 319.405 2.710 5 40 DFBB O=C(N[C@H](c1nccs1)C1CC1)c1cccc([N+](=O)[O-])c1O 96481524 HRQDWWLRRKHUID-NSHDSACASA-N 319.342 2.638 5 40 DFBB CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](O)(CC(C)C)C1 5296662 ABVZMMRXUJWCMH-OAHLLOKOSA-N 305.334 2.551 5 40 DFBB NC(=O)c1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 483281 FXMLWUXZAUGCSP-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB O=C(Nc1cc2cccnc2c2cccnc12)N1CCOCC1 6045379 BEERWCGMRXWXLW-UHFFFAOYSA-N 308.341 2.647 5 40 DFBB CCOc1ccc(CNc2c([N+](=O)[O-])c(C)nn2C)cc1F 70014359 RAUBAQDUXDFXDT-UHFFFAOYSA-N 308.313 2.787 5 40 DFBB CC(=O)c1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)nc1 96485504 OEDWRCBJWFAVDA-UHFFFAOYSA-N 313.313 2.764 5 40 DFBB CNC(=O)c1ccc(OC)c(NCc2csc([N+](=O)[O-])c2)c1 96427431 ITBCGAAGQAQPBQ-UHFFFAOYSA-N 321.358 2.637 5 40 DFBB O=C(NCCSc1ccccn1)c1cccc([N+](=O)[O-])c1 20240029 WCFAYFKGPOURED-UHFFFAOYSA-N 303.343 2.512 5 40 DFBB Cc1c(C(=O)n2cc(C(N)=O)c3ccccc32)cccc1[N+](=O)[O-] 216960515 XDUVODHOJIJPMZ-UHFFFAOYSA-N 323.308 2.645 5 40 DFBB Cc1ccc(/N=c2\oc3ccc([N+](=O)[O-])cc3cc2C(N)=O)cc1 100087391 FYTCRLDUSVVBTR-ZPHPHTNESA-N 323.308 2.981 5 40 DFBB CCc1nnc(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])n1C 69418873 GCNYHMUIHZDRMT-UHFFFAOYSA-N 306.347 2.640 5 40 DFBB COc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cn2)cc1 160287026 SIUBKQZRIAUHHD-UHFFFAOYSA-N 319.342 2.729 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1cc([N+](=O)[O-])ccc1Cl 4156094 GLNDITBXXHRKJS-OZVVPTBGSA-N 318.716 2.560 5 40 DFBB COc1cc(C)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 8907941 SFOKYLQBVVWCPR-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB COc1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1 2807118 WDCVVUHGOMOJNR-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CN(CCNC(=O)c1cc(F)ccc1[N+](=O)[O-])C1CCCCC1 69709052 NXIDQPYPPWFVMX-UHFFFAOYSA-N 323.368 2.728 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(F)ccc1O 80002135 GVQORZBAIFSZBU-UHFFFAOYSA-N 304.277 2.712 5 40 DFBB Cc1c(C(=O)N[C@H]2CCCCC[C@H]2C(=O)O)cccc1[N+](=O)[O-] 95964688 AKGAXROBZLEVRC-OLZOCXBDSA-N 320.345 2.667 5 40 DFBB CC(C)OCCCNc1cnc([N+](=O)[O-])c(Br)c1 521398658 XDMROVDFUPPLDI-UHFFFAOYSA-N 318.171 2.979 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](c2ccccc2)C1 13011793 AQSAYGSFWCVMGU-MRXNPFEDSA-N 312.325 2.809 5 40 DFBB O=c1oc2cc([N+](=O)[O-])ccc2n1CNc1cccc(F)c1 2451262 VMGJKNMKSQZWFE-UHFFFAOYSA-N 303.249 2.711 5 40 DFBB C[C@@H](Cn1cccc([N+](=O)[O-])c1=O)C(=O)c1ccc(F)c(F)c1 97082086 CBQORCQBKSQRLP-VIFPVBQESA-N 322.267 2.554 5 40 DFBB O=C(Nc1cccc(F)c1)c1n[nH]c2ccc([N+](=O)[O-])cc12 28026941 BTXWRBQLXPBSPY-UHFFFAOYSA-N 300.249 2.863 5 40 DFBB C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])c1)c1cccc2ccccc12 12787369 QHTXMBRDDOSSIZ-GFCCVEGCSA-N 324.340 2.822 5 40 DFBB CC1CCC2(CC1)NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C2=O 3457995 YIIVWHFYMCJZRB-UHFFFAOYSA-N 317.345 2.596 5 40 DFBB Cc1cc(NCc2cccc3c2OCCO3)ncc1[N+](=O)[O-] 74749886 FZFAPWLMTZLBOY-UHFFFAOYSA-N 301.302 2.682 5 40 DFBB CC(=O)N[C@H](C)C1CCN(c2cccc(C)c2[N+](=O)[O-])CC1 225460302 CCZCCVPKQCYRAM-GFCCVEGCSA-N 305.378 2.644 5 40 DFBB CCc1noc(CC)c1CC(=O)Nc1ccc([N+](=O)[O-])c(C)n1 96475310 WPKGMTBLNHPUNF-UHFFFAOYSA-N 318.333 2.592 5 40 DFBB CCn1c(Cn2nc(C)c([N+](=O)[O-])c2C)nc2c(F)cccc21 69455364 GQBAOZVQLZIASB-UHFFFAOYSA-N 317.324 2.965 5 40 DFBB C[C@@H](C(=O)OC(C)(C)C)N(C)CCOc1ccccc1[N+](=O)[O-] 72311437 OZIXBRMHVGGFSR-LBPRGKRZSA-N 324.377 2.636 5 40 DFBB O=C(NCCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1 177050847 YXCNXUKBFIHNST-UHFFFAOYSA-N 300.314 2.541 5 40 DFBB CCOc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])cc1 40936997 RWRKHLYHQPRMFM-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB COc1cccc(COCCNc2cc(N)ccc2[N+](=O)[O-])c1 330032055 HODMLVAQIQPGLK-UHFFFAOYSA-N 317.345 2.814 5 40 DFBB Cc1cnc(OCC(=O)N[C@H](C)c2cccs2)c([N+](=O)[O-])c1 96451058 GOHNWYFZLZTJMX-SNVBAGLBSA-N 321.358 2.616 5 40 DFBB COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc(OC)c1 185748 NFTSDOZGZXXXGN-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccnc1S 29829177 UKJXISFLDGSDDF-UHFFFAOYSA-N 303.343 2.551 5 40 DFBB Nc1ccc(C(=O)N2CC[C@@H]3CCCC[C@H]3C2)cc1[N+](=O)[O-] 33028344 XRPYWDCKSHXQCN-AAEUAGOBSA-N 303.362 2.829 5 40 DFBB CCN(C(=O)COc1ccc(C)nc1[N+](=O)[O-])c1ccccc1 12533099 HJZFMFWQTGELFL-UHFFFAOYSA-N 315.329 2.730 5 40 DFBB O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]2CC[C@H]1C2 104860309 QTGLGMYKENMJQX-RWMBFGLXSA-N 303.362 2.559 5 40 DFBB COc1cc([C@H]2NC[C@@H](c3ccc([N+](=O)[O-])cc3)O2)ccc1O 19643009 MGHHNWNXFHDEBT-HOTGVXAUSA-N 316.313 2.669 5 40 DFBB CCN(CC)CCCCCNC(=O)c1ccc([N+](=O)[O-])cc1 255187413 DJTXMIBLCPQQIH-UHFFFAOYSA-N 307.394 2.837 5 40 DFBB C[C@H](O)c1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cc1 53601803 ACWCFZJNBIPCQY-VIFPVBQESA-N 318.358 2.969 5 40 DFBB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5944026 FWMZYGAEPXRDNX-UWVGGRQHSA-N 324.720 2.854 5 40 DFBB Cn1ccnc1[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccccc1 17590199 DCODRBYIFKFBAW-OAHLLOKOSA-N 309.329 2.925 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccn(CC(F)F)n1 79014704 KJWMVZXOZKPGDL-UHFFFAOYSA-N 311.248 2.700 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1OCc1noc(C2CCOCC2)n1 95438571 CYZCERGUURAXPB-UHFFFAOYSA-N 319.317 2.759 5 40 DFBB CCc1cc(NC(=O)[C@H]2CCCO2)c2cc([N+](=O)[O-])ccc2n1 95997601 IFAUNMPEYMFXBR-OAHLLOKOSA-N 315.329 2.823 5 40 DFBB Cc1cccc(C)c1OCCNC(=O)c1ccc([N+](=O)[O-])o1 47024040 UHRIXMAWIUOYLB-UHFFFAOYSA-N 304.302 2.613 5 40 DFBB Cc1cnc(OCc2nc(-c3ccco3)no2)c([N+](=O)[O-])c1 96451064 OVFONDQESCJHMF-UHFFFAOYSA-N 302.246 2.520 5 40 DFBB Cc1nn(Cc2cncc(Br)c2)c(C)c1[N+](=O)[O-] 32315736 CICOSIKHJLHADK-UHFFFAOYSA-N 311.139 2.614 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1CCCCCCC1 48637961 RVHNEKJSNCSDSF-UHFFFAOYSA-N 319.361 2.762 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc(N(C)C)c1 40509274 AKURRBSQXKCZLY-UHFFFAOYSA-N 313.357 2.933 5 40 DFBB COc1ccccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 577659 DUDBZYBCVRKRJF-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc([S@@](C)=O)cc1 72298069 MKQGHQFJRAEXOM-QFIPXVFZSA-N 318.354 2.893 5 40 DFBB O=C(O)[C@@H]1CS[C@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 83237250 JQYLQCWCUUOGKX-GXFFZTMASA-N 320.326 2.643 5 40 DFBB O=[N+]([O-])c1cccc(CSc2nnc(-c3cnccn3)o2)c1 1378713 PWMOWQLNLWJZMN-UHFFFAOYSA-N 315.314 2.727 5 40 DFBB C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCCCC1 6052055 UUMXVNDXDGKHPI-LLVKDONJSA-N 320.345 2.589 5 40 DFBB CC(C)=C1[C@@H]2C=C[C@@H]1[C@H]1C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]21 100072076 RWCBIWIPRCRLLY-DPDCMNJDSA-N 324.336 2.853 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(c2ccccc2)=NO1 41776059 CMCNAQGSZZZAJH-HNNXBMFYSA-N 311.297 2.727 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1cccc2cn[nH]c12 25255724 SSZIWKJWKFDAFE-UHFFFAOYSA-N 310.313 2.743 5 40 DFBB O=C(CSc1ncccc1[N+](=O)[O-])NC1CCCCCC1 58367890 JWQUDUJHPSQCSF-UHFFFAOYSA-N 309.391 2.921 5 40 DFBB Cc1cc(C)c(O[C@H](C)C(=O)Nc2cc(C)on2)c([N+](=O)[O-])c1 9365183 RRPKNMUQAAKDON-LLVKDONJSA-N 319.317 2.914 5 40 DFBB CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 75145383 YKIIOOPNJZXZSB-KMUNFCNLSA-N 308.353 2.979 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)NCC2CCCCC2)c1 224483338 RGFHLKIXYANYCC-UHFFFAOYSA-N 312.391 2.595 5 40 DFBB COCCNc1ccccc1CNc1ncccc1[N+](=O)[O-] 95417586 DRXNLCPUBVUNNO-UHFFFAOYSA-N 302.334 2.660 5 40 DFBB COc1ccc(N(C)C(=O)c2ccc([N+](=O)[O-])c(C)c2)cn1 58218682 ZVHFILZMIDQYAK-UHFFFAOYSA-N 301.302 2.583 5 40 DFBB CCOC(=O)c1cc2c(=O)c3cc(F)ccc3oc2nc1C 2508404 FYLNZFVLINTLNR-UHFFFAOYSA-N 301.273 2.965 5 40 DFBB Cc1cc(Cl)ccc1NC(=O)COc1cccnc1[N+](=O)[O-] 5970810 VACDPWDKRBVVGG-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB CC(C)n1ccc(C(=O)OCCc2ccccc2[N+](=O)[O-])n1 89894093 KQCRULRHPSCFHP-UHFFFAOYSA-N 303.318 2.772 5 40 DFBB Cc1cccc(C(=O)N[C@@H](C)c2c(C)nn(C)c2C)c1[N+](=O)[O-] 95395610 CAOIHKVIBBGALQ-JTQLQIEISA-N 316.361 2.745 5 40 DFBB O=C(O)c1cn(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc12 216960643 FQDRYANSLWHDTP-UHFFFAOYSA-N 310.265 2.936 5 40 DFBB Cc1noc(C)c1CN1C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc21 94992579 DUKBOHZLFOXPNF-JTQLQIEISA-N 317.301 2.514 5 40 DFBB CCc1nc(CN(C)c2nc3ccccn3c2[N+](=O)[O-])cs1 63255482 HBNHJRVNXJKAAT-UHFFFAOYSA-N 317.374 2.898 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])OCc1cccc([N+](=O)[O-])c1 3228184 GLTSBPDKKOAMRC-UHFFFAOYSA-N 316.269 2.789 5 40 DFBB O=C(NCc1ccccc1)c1cc2cccc([N+](=O)[O-])c2oc1=O 7602747 DTYPDORJFUEPTP-UHFFFAOYSA-N 324.292 2.631 5 40 DFBB CC(=O)c1cccc(NCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 7957513 QWLPJNDICVXKOE-UHFFFAOYSA-N 313.313 2.848 5 40 DFBB O=C(c1ccoc1)N1CCC(Nc2cccc([N+](=O)[O-])c2)CC1 69413741 XVSODDDRSHRRLV-UHFFFAOYSA-N 315.329 2.905 5 40 DFBB C[C@H](O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 226273982 UVIUPXFJHJUNSM-NSHDSACASA-N 300.314 2.829 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1F)N1CCCCCCC1 59012013 DJJZFVNPLNURNE-UHFFFAOYSA-N 310.325 2.905 5 40 DFBB O=C1NC2(CCCCCC2)C(=O)N1Cc1cccc([N+](=O)[O-])c1 3610273 NYIKKUHOMGXPSG-UHFFFAOYSA-N 317.345 2.740 5 40 DFBB CCCCC(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 5755773 HTVRXIMBIFGAFL-JTQLQIEISA-N 324.333 2.664 5 40 DFBB CS(=O)(=O)c1ccc(NCC2CCCCC2)c([N+](=O)[O-])c1 9220869 AQPATRGXHYJHJQ-UHFFFAOYSA-N 312.391 2.991 5 40 DFBB COc1ccccc1[C@@H]1NC[C@@H](c2ccc([N+](=O)[O-])cc2)O1 19805526 RUPFSSOHHXJTKI-JKSUJKDBSA-N 300.314 2.963 5 40 DFBB Cc1noc(C)c1CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 78878055 PIKNSHPGUSOCTF-UHFFFAOYSA-N 323.736 2.826 5 40 DFBB O=[N+]([O-])c1c(NCc2cccc3c2OCO3)nc2ccccn12 60451520 ROOHETGNUXWNGD-UHFFFAOYSA-N 312.285 2.583 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OCC(F)(F)F 31702021 YJTFBKSMEGVSAL-QMMMGPOBSA-N 306.240 2.809 5 40 DFBB COC(=O)c1cccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c1 50171 SCVPSLNQLFBBFF-UHFFFAOYSA-N 301.254 2.601 5 40 DFBB CC(=O)c1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3128528 AWFKJLWKGJXRCM-UHFFFAOYSA-N 320.326 2.598 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 3429484 IZNKQAYLJQBZIV-UHFFFAOYSA-N 315.281 2.723 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc([N+](=O)[O-])c1 3515374 MANNDORKENHPAU-UHFFFAOYSA-N 317.257 2.521 5 40 DFBB CC(C)c1n[nH]c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 6201235 SAAZYHDWPCUTGV-UHFFFAOYSA-N 321.362 2.567 5 40 DFBB Cc1ccc(OCCNC(=O)c2ccccc2[N+](=O)[O-])cc1 5545281 LSWOOFZOQYSZRD-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB COCCNC(=S)Nc1cc2cccnc2c2ncccc12 408975103 HNAUXMWDFUBSFQ-UHFFFAOYSA-N 312.398 2.716 5 40 DFBB O=C(NCc1ccco1)c1cn[nH]c1-c1ccc([N+](=O)[O-])cc1 72329399 MDQJGOLTELMWCT-UHFFFAOYSA-N 312.285 2.508 5 40 DFBB Cc1cccc(CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])c1 223725578 UZQKDBRASYHGIK-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB Cc1c(NC(=O)c2ccccc2C(=O)O)cccc1[N+](=O)[O-] 38859 UEAPULVBSRZXTA-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB Cc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1F 7256845 BFUVWPPGUSCHJV-UHFFFAOYSA-N 317.320 2.884 5 40 DFBB COc1ccccc1NC(=O)CNc1ccc(F)c([N+](=O)[O-])c1 7972839 WFHCBRRXEPAHSF-UHFFFAOYSA-N 319.292 2.793 5 40 DFBB O=c1ccc(-c2ccccc2)nn1Cc1ccc([N+](=O)[O-])cc1 5388283 KAKGVSQTKZXWQS-UHFFFAOYSA-N 307.309 2.867 5 40 DFBB CC(C)=C1[C@H]2C=C[C@H]1[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]21 253560466 AVKFLDKUMSOHKX-XOUADPBQSA-N 324.336 2.853 5 40 DFBB O=C(Nc1ccccc1[N+](=O)[O-])c1cc(=O)c2ccccc2o1 3892319 ITPUFZRVHCYCTC-UHFFFAOYSA-N 310.265 2.954 5 40 DFBB CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CCCCC1 6001493 VVNYCZXZLHUHIF-AWEZNQCLSA-N 308.378 2.599 5 40 DFBB CNC(=O)COc1cccc(Oc2ccc([N+](=O)[O-])cc2F)c1 301948056 HTWMEWDIXFFXSC-UHFFFAOYSA-N 320.276 2.651 5 40 DFBB O=[N+]([O-])c1cnn(CCSc2ncnc3ccsc23)c1 74783223 CHXOLQOFANFYFU-UHFFFAOYSA-N 307.360 2.588 5 40 DFBB C[C@@H]1CCCN(C(=O)CNC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 195550092 OKEVFJBXDBAVNJ-CYBMUJFWSA-N 319.405 2.678 5 40 DFBB Cc1noc(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)n1 49027285 UTAJLBUMUUWOHK-UHFFFAOYSA-N 314.257 2.799 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1NCc1ccc(-n2ccnc2)nc1 58537487 UYWXSZGUIVFJID-UHFFFAOYSA-N 313.292 2.927 5 40 DFBB NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 335083 BUMZZVDKLUBFQQ-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB Cc1ncsc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 71799843 KDGQAXLPPXTFDE-MRVPVSSYSA-N 303.343 2.951 5 40 DFBB C[C@@H](c1cccs1)N(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 32851093 CPRYYYKKBQFCJN-JTQLQIEISA-N 319.386 2.948 5 40 DFBB C[C@H](OC[C@@H]1CCCCO1)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 71795770 WKERCXADUMPRTR-WFASDCNBSA-N 322.361 2.532 5 40 DFBB CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccsc1 12348387 SJOBYGKPSFNQQC-AWEZNQCLSA-N 319.386 2.689 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NCc1cc(=O)n2ccccc2n1 25597124 TWBRFNOJLKKHOA-UHFFFAOYSA-N 310.313 2.523 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)NCCCc2ccccc2)cc1 2101097 HUBLVFKRBSSIFI-UHFFFAOYSA-N 320.370 2.506 5 40 DFBB COc1cc([N+](=O)[O-])ccc1N[C@H]1OC(=O)c2ccccc21 4140845 FPOCCEURNADLDU-AWEZNQCLSA-N 300.270 2.885 5 40 DFBB Cc1c(NC(=O)Cc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] 4141732 POQMFCVDSIARTG-UHFFFAOYSA-N 315.285 2.993 5 40 DFBB O=[N+]([O-])/C(=C/Nc1ccccc1F)S(=O)(=O)c1ccccc1 5665723 CULAYEIDALKEFZ-UVTDQMKNSA-N 322.317 2.787 5 40 DFBB O=[N+]([O-])c1ccc([C@H]2ON=C(c3ccccc3)[C@H]2[N+](=O)[O-])cc1 4016987 HLCKDFGBHDBICY-HUUCEWRRSA-N 313.269 2.716 5 40 DFBB O=[N+]([O-])c1cccc(-c2nn3c(-c4cccnc4)nnc3s2)c1 5348065 KVULBTWIURHHJY-UHFFFAOYSA-N 324.325 2.823 5 40 DFBB COc1ccc(NC(=O)CNc2ccccc2F)c([N+](=O)[O-])c1 6510285 PNQRVLQNAQLGIW-UHFFFAOYSA-N 319.292 2.793 5 40 DFBB COCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 75352174 GJVYLWHHYGWNQB-UHFFFAOYSA-N 300.314 2.774 5 40 DFBB O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1F 226863071 NEQRKEGVQDCJIH-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB O=[N+]([O-])c1ccc(C2=NN[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 226758855 PRYHMDUYUTYJGZ-AWEZNQCLSA-N 312.285 2.942 5 40 DFBB O=C(C[C@@H](C(=O)O)[C@H](c1ccccc1)[N+](=O)[O-])c1ccccc1 1687172 OXISQRBRNJKOGQ-ZBFHGGJFSA-N 313.309 2.978 5 40 DFBB CCOC(=O)CC(=O)c1ccc(-c2ccccc2[N+](=O)[O-])o1 8700383 YMJYOKMFLTYSBM-UHFFFAOYSA-N 303.270 2.991 5 40 DFBB Cc1cc(C)c(OCC(=O)N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 9725475 CRCOPJLAOMOIMZ-NSHDSACASA-N 306.362 2.849 5 40 DFBB Cc1c(CNc2cc(C(N)=O)c(F)cc2F)cccc1[N+](=O)[O-] 72301936 FOIBPFKJHXQLKH-UHFFFAOYSA-N 321.283 2.892 5 40 DFBB O=C(Nc1ccc(-n2ccnc2)cc1)c1ccc(O)c([N+](=O)[O-])c1 97237049 JTNRSXCQWZKWKF-UHFFFAOYSA-N 324.296 2.738 5 40 DFBB Cc1ccn2cc(C(=O)N(C)Cc3cccc([N+](=O)[O-])c3)nc2c1 25254504 GMKAKLIXQBXWQN-UHFFFAOYSA-N 324.340 2.823 5 40 DFBB C[C@H]1CCCC[C@@H]1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 12739511 VOBDOXZUMVOMEG-WFASDCNBSA-N 320.393 2.885 5 40 DFBB COc1ccc(C(C)(C)C)cc1NC(=O)c1n[nH]cc1[N+](=O)[O-] 6386926 TUUJSKPNRULOES-UHFFFAOYSA-N 318.333 2.876 5 40 DFBB COc1cc(-c2nc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)ccc1O 85384270 HWSCWQGORWJHIL-UHFFFAOYSA-N 312.285 2.761 5 40 DFBB CCOc1ncccc1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 12778273 KAKIFHAIQMWKLU-UHFFFAOYSA-N 301.302 2.949 5 40 DFBB Cc1cccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)c1 4331233 YXSYJGIFPZLDIG-UHFFFAOYSA-N 310.317 2.931 5 40 DFBB Cc1cccc(CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 14345599 PWZLAUSHXRDYDM-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB CC(C)(C)c1cc(NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])n(C(C)(C)C)n1 66664556 LWGXPFVKYUFDGF-ZJUUUORDSA-N 308.382 2.539 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCO[C@@]2(CCSC2)C1 96481076 JLDKKQAJHWEJPT-FZMZJTMJSA-N 309.391 2.765 5 40 DFBB C[C@@H]1C[C@@H](C)n2nccc2N1C(=O)Cc1cccc([N+](=O)[O-])c1 96425043 OTLFVIICEKNDCQ-VXGBXAGGSA-N 314.345 2.720 5 40 DFBB CC1(C)O[C@@]2(C)CC[C@H]1[C@@H]1[C@@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 103872648 WKHNLBMOCOAPPQ-XPXSQLCNSA-N 316.357 2.765 5 40 DFBB CNc1c(C(=O)Nc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 4014435 XDISXDPUSLVJPR-UHFFFAOYSA-N 316.273 2.797 5 40 DFBB COc1ccc2c(c1)CN(c1nc3ccccn3c1[N+](=O)[O-])CC2 66387783 LXDMUOHSOCFTIO-UHFFFAOYSA-N 324.340 2.814 5 40 DFBB CCOC(=O)c1cc(C(=O)N2CCCCCC2)cc([N+](=O)[O-])c1 8181470 GTCBEMCBSDLGCX-UHFFFAOYSA-N 320.345 2.788 5 40 DFBB O=C(Nc1ccncc1[N+](=O)[O-])N1CCc2ccccc2CC1 96500684 XXWREUJOZCZZJB-UHFFFAOYSA-N 312.329 2.623 5 40 DFBB O=c1c2ccsc2ccn1C[C@H](O)c1cccc([N+](=O)[O-])c1 97052812 SNAZCTSNMJQGCB-ZDUSSCGKSA-N 316.338 2.705 5 40 DFBB CC[C@@H](Nc1c([N+](=O)[O-])ncn1C)c1nc2ccccc2[nH]1 75138139 MWWCCAKRMRGHGA-SECBINFHSA-N 300.322 2.768 5 40 DFBB CC(C)Oc1ccc(CCNc2c([N+](=O)[O-])ncn2C)cc1 29588588 YRPUOHDASXRATE-UHFFFAOYSA-N 304.350 2.770 5 40 DFBB O=[N+]([O-])c1ccc(CCNc2ccc(-n3cncn3)cc2)cc1 97113993 GGFUZWUAXGPGLJ-UHFFFAOYSA-N 309.329 2.830 5 40 DFBB CCOC(=O)c1cc(N2C[C@@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] 75107083 USPLORKZFCQIFM-LLVKDONJSA-N 322.361 2.775 5 40 DFBB C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(C(=O)NC2CC2)CC1 75644338 UCVNCLIGSVKBMS-LBPRGKRZSA-N 317.389 2.646 5 40 DFBB COc1cc(N2C[C@@H]3CN4CCCC[C@@H]4[C@@H]3C2)ccc1[N+](=O)[O-] 78303387 DAZGMCGHBZIPNQ-NWANDNLSSA-N 317.389 2.524 5 40 DFBB O=[N+]([O-])c1ccn(C[C@@H](O)c2ccc(C(F)(F)F)cc2)n1 195545779 YOLJBSSJXLSZSK-SNVBAGLBSA-N 301.224 2.544 5 40 DFBB CCC[C@@](C)(O)CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] 76019199 WWKOZVQFLOIHFD-CQSZACIVSA-N 312.391 2.598 5 40 DFBB C[C@H]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 4902677 NFUCVLXXSGLYSO-JTQLQIEISA-N 311.769 2.919 5 40 DFBB COc1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 5332508 DJSIXGAOKWQZCL-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB COc1ccc(C(C)=O)cc1COc1cccnc1[N+](=O)[O-] 7044902 QZAZAPSHNVXFJU-UHFFFAOYSA-N 302.286 2.780 5 40 DFBB CCS[C@H]1CCC[C@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96450524 QJRKUDCDUGJPTC-YPMHNXCESA-N 309.391 2.581 5 40 DFBB COC(=O)c1ccc(CNc2ncc(C)cc2[N+](=O)[O-])cc1 525703828 LBPXLLPVNLMSGG-UHFFFAOYSA-N 301.302 2.697 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])ccc1N(C)Cc1cnc(C)s1 52447420 UAQHUUUBWWCJSD-UHFFFAOYSA-N 321.358 2.783 5 40 DFBB O=C(NC1CCCC1)c1cccn2c(=O)c3ccccc3nc12 425554 VPALUNASUJCWJY-UHFFFAOYSA-N 307.353 2.520 5 40 DFBB C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 7218018 MLLMMWODBIALOK-JTQLQIEISA-N 324.333 2.773 5 40 DFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccs1 3321492 CKJSRWBYTAEJQI-UHFFFAOYSA-N 321.310 2.880 5 40 DFBB O=C(NCCCOc1ccccc1)c1ccc([N+](=O)[O-])s1 14015866 BHDVXAZMPGHANS-UHFFFAOYSA-N 306.343 2.855 5 40 DFBB CCS(=O)(=O)C[C@H](C)N(C)c1ccc([N+](=O)[O-])cc1Cl 69869815 BROZVHMHXYLPAG-VIFPVBQESA-N 320.798 2.508 5 40 DFBB O=[N+]([O-])c1ccc(N(C[C@@H]2CCCO2)C[C@H]2CCCO2)c(F)c1 84351182 MBLDFBMYTQUXQP-OKILXGFUSA-N 324.352 2.898 5 40 DFBB O=C(NCc1cc(F)ccc1F)Nc1ccncc1[N+](=O)[O-] 96500692 XFZABCXPLCJUQG-UHFFFAOYSA-N 308.244 2.590 5 40 DFBB O=[N+]([O-])c1ccc(N(Cc2ccco2)C[C@@H]2CCCO2)nc1 95421584 GDUWMZMRTVUPRH-AWEZNQCLSA-N 303.318 2.768 5 40 DFBB O=C(Oc1c([N+](=O)[O-])cccc1[N+](=O)[O-])C1[C@@H]2CCCC[C@@H]12 100639938 YEIHKLUYLWIVOO-RKDXNWHRSA-N 306.274 2.845 5 40 DFBB C[C@@H]1CCCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 9155203 QVHKMOAFCFEQRO-GFCCVEGCSA-N 314.345 2.653 5 40 DFBB O=C(CN1CCC[C@H]1c1ccc[nH]1)Nc1ccc([N+](=O)[O-])cc1 84338993 GOAZXEODGITZLL-HNNXBMFYSA-N 314.345 2.699 5 40 DFBB Cc1nc(C)c(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)s1 75107493 ZOZMQVHWBDIWQO-UHFFFAOYSA-N 317.330 2.797 5 40 DFBB CCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 224671652 XIMGKNOCQXSEOH-UHFFFAOYSA-N 306.343 2.810 5 40 DFBB O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 90450616 PLGBIBWHXBHNKT-AOOOYVTPSA-N 308.721 2.928 5 40 DFBB COc1ccccc1/C=C1\N=C(c2cccc([N+](=O)[O-])c2)OC1=O 190808 AHZBNZADRNEMTB-UVTDQMKNSA-N 324.292 2.948 5 40 DFBB C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 160141737 HSWVJZHEPUKRDR-NSHDSACASA-N 317.370 2.959 5 40 DFBB Cc1cccnc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 31215583 XFIPVCHQYDJKIZ-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB CS[C@@H]1CCC[C@H]1N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] 107146029 OWZLWCLNRNUOOF-ZIAGYGMSSA-N 323.418 2.749 5 40 DFBB O=C(NC1CCCC1)c1cn[nH]c1-c1ccc([N+](=O)[O-])cc1 72329366 YGWRIELMZODLCJ-UHFFFAOYSA-N 300.318 2.657 5 40 DFBB COc1ccccc1CCCNC(=O)c1cccc([N+](=O)[O-])c1 217865000 ZXFYDIYGKTZHBM-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB CN(C)CCCNc1ccc2ncn3c4ccccc4c(=O)c1c23 5723879 KWLWSGBEPRFXEU-UHFFFAOYSA-N 320.396 2.802 5 40 DFBB in-vivo Cc1cc(CNc2ncc([N+](=O)[O-])cc2Br)on1 81941406 RVXHZYGKPVLDNP-UHFFFAOYSA-N 313.111 2.661 5 40 DFBB Cc1ccccc1NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1 3506598 GJMZGANSLDMOOZ-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB CCCc1nc(CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)no1 6204944 ARTFCAZHKYPIBG-UHFFFAOYSA-N 324.724 2.514 5 40 DFBB Cc1csc(Cc2nc(O)c3cc([N+](=O)[O-])ccc3n2)n1 53856451 BFWVQIBWSMVKCN-UHFFFAOYSA-N 302.315 2.599 5 40 DFBB CCCCC(=O)NC(=S)Nc1ccc(OC)c([N+](=O)[O-])c1 9064280 GOQOLBWIOZZQPK-UHFFFAOYSA-N 311.363 2.607 5 40 DFBB C[C@@H](Nc1cncc(-n2cccn2)n1)c1cccc([N+](=O)[O-])c1 58150412 BBGHEZKHGGPDNY-LLVKDONJSA-N 310.317 2.744 5 40 DFBB COc1ccc(C(=O)Nc2ccc(C)cc2O)cc1[N+](=O)[O-] 9479147 QBEPQRDUHMGEQI-UHFFFAOYSA-N 302.286 2.870 5 40 DFBB COC[C@H](O)c1cccc(Nc2ccc([N+](=O)[O-])c(C)n2)c1 95414944 WHCCGDKISDMBFB-AWEZNQCLSA-N 303.318 2.722 5 40 DFBB Nc1c(F)cc(Br)c([N+](=O)[O-])c1Br 1857787627 NFNXGASHINNWGX-UHFFFAOYSA-N 313.908 2.841 5 40 DFBB O=c1[nH]n2c(=O)c3c4c(sc3nc2c2ccccc12)CCCC4 5324071 JESIUSBCNXTESC-UHFFFAOYSA-N 323.377 2.630 5 40 DFBB COc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(O)cc1 41676913 YDRJXFHQPKXTAZ-UHFFFAOYSA-N 316.313 2.581 5 40 DFBB CCOc1ccccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 56137743 SFIFLSNAMFNOTG-UHFFFAOYSA-N 314.341 2.852 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)OCc1cn2ccccc2n1 58451421 ASKIBTKNIIGWEX-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB O=C(OCC(=O)c1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])o1 3433132 XEPDAAFGGKXBCO-UHFFFAOYSA-N 314.253 2.709 5 40 DFBB COC[C@@H](C)C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 95943183 NATDLOJNVVGVAL-SECBINFHSA-N 303.318 2.672 5 40 DFBB Cc1ccc(F)cc1NC(=O)CCn1cc([N+](=O)[O-])c(C)n1 95994612 BWBYHGOGVHCPII-UHFFFAOYSA-N 306.297 2.576 5 40 DFBB CNC(=O)COc1cccc(Oc2ccc(F)cc2[N+](=O)[O-])c1 301947668 HREMPDHLWUYOKC-UHFFFAOYSA-N 320.276 2.651 5 40 DFBB O=[N+]([O-])c1cccc(CN[C@H](Cn2cncn2)c2ccccc2)c1 77404702 DNILUYIBLIGTBC-QGZVFWFLSA-N 323.356 2.717 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccccc1 12556082 QHZHSNCRDOIZNC-UHFFFAOYSA-N 314.345 2.506 5 40 DFBB Cc1c(NC(=O)Cc2ccccc2[N+](=O)[O-])cccc1C(=O)O 320270363 LHKMIPFMBIKFLP-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB Cc1cc(S(C)(=O)=O)ccc1NCc1cccc([N+](=O)[O-])c1 96427537 CADSWSZEASUYDO-UHFFFAOYSA-N 320.370 2.919 5 40 DFBB Cc1nc(C)c(CCNC(=O)c2ccc(C)c([N+](=O)[O-])c2)s1 4392428 ABMLDUBKQXLFFZ-UHFFFAOYSA-N 319.386 2.949 5 40 DFBB COc1cccc(CC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1 3416311 DQZPNUOGXBSQDJ-UHFFFAOYSA-N 304.277 2.924 5 40 DFBB COC(=O)[C@@H](C)c1c(C)nn(Cc2cccc([N+](=O)[O-])c2)c1C 89520839 QUGURHVLGXBCHH-JTQLQIEISA-N 317.345 2.733 5 40 DFBB C[C@@H](CCO)Sc1ncc([N+](=O)[O-])cc1Br 86482082 MYZGGDCFXARQHC-LURJTMIESA-N 307.169 2.615 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](CCC(N)=O)C1 195553336 QSEVNJDWCBMFIJ-KBPBESRZSA-N 319.405 2.942 5 40 DFBB Cc1ccc(C2=CCN(c3ncc([N+](=O)[O-])c(N)n3)CC2)cc1 65407450 SUSMAYOOMGYYTC-UHFFFAOYSA-N 311.345 2.569 5 40 DFBB O=C(N=c1[nH]c2ccccc2[nH]1)c1ccc(Cl)c([N+](=O)[O-])c1 9704900 FSAASJBPSOZVNW-UHFFFAOYSA-N 316.704 2.799 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@H](Oc2ccccc2[N+](=O)[O-])C1 67800667 MMTLDQWOGUSHKN-NSHDSACASA-N 308.334 2.983 5 40 DFBB O=C(Cc1ccc2c(c1)OCCO2)Nc1cccc([N+](=O)[O-])c1 19009076 VTLSVAUBWTYYAK-UHFFFAOYSA-N 314.297 2.547 5 40 DFBB COc1ccc(F)cc1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 69972072 MUEDHAUQLKYWGY-UHFFFAOYSA-N 318.260 2.564 5 40 DFBB C[C@H](C(=O)N[C@@H]1CCCc2ccccc21)n1cc([N+](=O)[O-])cn1 2747983 KLADXPKSQWKQFK-IAQYHMDHSA-N 314.345 2.546 5 40 DFBB Cc1cc(C(=O)Nc2ccc(C(=O)O)c(O)c2)ccc1[N+](=O)[O-] 20140932 ZMDZGLCMKSQMJD-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB O=c1onc(-c2cccs2)n1Cc1ccc([N+](=O)[O-])cc1 58377438 FCWXDVLFOBLPCR-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB O=c1[nH]c2c(s1)[C@H]1c3cc([N+](=O)[O-])ccc3OC[C@H]1CS2 2487401 VDJBLTVFFSDNLR-QUBYGPBYSA-N 322.367 2.591 5 40 DFBB COc1ccccc1OC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 48863650 KXMZNJJDNVGXNE-UHFFFAOYSA-N 313.269 2.699 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1CCCCCC1 6314951 PRDFEBAMQOBUFT-UHFFFAOYSA-N 312.391 2.904 5 40 DFBB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5944023 FWMZYGAEPXRDNX-NXEZZACHSA-N 324.720 2.854 5 40 DFBB COc1ccc([N+](=O)[O-])cc1Cn1c(=O)oc2ccccc21 12371121 UMBNQQNZZGWRBF-UHFFFAOYSA-N 300.270 2.560 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1F 3383940 STFBIFDHZDWKQM-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1Nc1cnn(CCO)c1 57148881 JFVZXGCXYQDXIM-UHFFFAOYSA-N 316.239 2.546 5 40 DFBB CC(C)CCC(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 10238827 UMVWEAYVUVYYKY-NSHDSACASA-N 308.334 2.901 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCOc1ccccc1 3617029 BBYUYWUVMZYWMY-DHZHZOJOSA-N 312.325 2.803 5 40 DFBB O=C(Nc1ccc(CCO)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 1726728 LWYOICFINZQUIJ-UHFFFAOYSA-N 319.292 2.913 5 40 DFBB Cc1ccc(C(=O)O[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(=O)[nH]1 79057059 LJHJQTRXMLFYGS-NSHDSACASA-N 316.313 2.818 5 40 DFBB Cc1cc([N+](=O)[O-])cc(Br)c1N1CCOCC1 45957712 UNGKPNXSRGPOSU-UHFFFAOYSA-N 301.140 2.502 5 40 DFBB O=C(COC(=O)c1ccco1)Nc1ccc(Cl)cc1[N+](=O)[O-] 5080253 ZAZMWDXYMPZGTM-UHFFFAOYSA-N 324.676 2.637 5 40 DFBB Cn1cnc([N+](=O)[O-])c1COc1ccccc1Br 75092180 LVESJUJQRUTKMW-UHFFFAOYSA-N 312.123 2.670 5 40 DFBB C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])cc1 78556549 HANZSBWKEKJQSI-COLVAYQJSA-N 315.329 2.736 5 40 DFBB CCS[C@@H]1CCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 96450532 WHEOKYDBGOPOKL-UONOGXRCSA-N 308.403 2.928 5 40 DFBB CC(C)=C1[C@H]2C=C[C@@H]1[C@H]1C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@H]21 12363873 RWCBIWIPRCRLLY-OXUXUCFPSA-N 324.336 2.853 5 40 DFBB Cc1cccc(NS(=O)(=O)c2ccc(F)c([N+](=O)[O-])c2)c1 226863019 PBSHIOGMSVQXRM-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)N1CCCCCC1 4454558 VSPZRMOXYGHQOU-UHFFFAOYSA-N 316.313 2.717 5 40 DFBB CCOC(=O)/C=C(\C)NCCC[N+](C)(C)Cc1ccccc1 3982509 AXLHEBMBAUQCEM-UHFFFAOYSA-O 305.442 2.710 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)c2cccc(F)c2)c1 95962345 RFLAQKHIFSOKOL-OAHLLOKOSA-N 318.304 2.506 5 40 DFBB CC(C)(C)NC(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408533480 REQVDVZYVDIIPH-UHFFFAOYSA-N 300.318 2.580 5 40 DFBB O=c1c2c(O)cccc2oc2cc3c(c(O)c12)[C@@H]1C=CO[C@@H]1O3 14715646 CWYJYLXZMAUSNI-BWKAKNAASA-N 310.261 2.703 5 40 DFBB biogenic,in-vitro CCOC(=O)/C=C\c1ccc(Br)cc1[N+](=O)[O-] 95725478 XRTBTPDPXPXTDW-XQRVVYSFSA-N 300.108 2.934 5 40 DFBB C[C@@H]1CCCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 4309513 SWNKQWOPTIHFRL-SECBINFHSA-N 318.782 2.811 5 40 DFBB C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cn1)c1ccccc1 160141876 HSWVJZHEPUKRDR-LLVKDONJSA-N 317.370 2.959 5 40 DFBB C[C@H](NP1(=O)OCC(C)([N+](=O)[O-])CO1)c1ccccc1 1667926 WZPZDMQUVGZEIO-QPEFHUAHSA-N 300.251 2.528 5 40 DFBB CCC[C@@H](C)C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F 3303295 IWENQXVWERORSF-SECBINFHSA-N 312.297 2.652 5 40 DFBB CCNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 52931474 KRULOBGNMPKFQB-LLVKDONJSA-N 314.345 2.913 5 40 DFBB Cc1ccc(-n2cc3c(=O)c4ccccc4oc3nc2=O)cc1 1395780 VJVBRRMHJTWOCP-UHFFFAOYSA-N 304.305 2.801 5 40 DFBB COc1cc(C(=O)Nc2ncc(C)s2)c([N+](=O)[O-])cc1OC 6969152 OYGLBAFHQPBUFP-UHFFFAOYSA-N 323.330 2.629 5 40 DFBB CC(=O)Nc1cccc(COc2ncc(C)cc2[N+](=O)[O-])c1 96455740 LQXXIOARISZGIL-UHFFFAOYSA-N 301.302 2.836 5 40 DFBB Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1[N+](=O)[O-] 585665930 WNADRLNHGJPQEP-UHFFFAOYSA-N 312.373 2.717 5 40 DFBB CN(C)CCCNC(=O)c1cc2c(ccc3ccccc32)oc1=O 5319050 FKPIILIXOPKUTM-UHFFFAOYSA-N 324.380 2.628 5 40 DFBB O=[N+]([O-])c1cccc2c(S(=O)(=O)N3CCCCC3)cccc12 344602 LVXLOVSJWVUIDI-UHFFFAOYSA-N 320.370 2.923 5 40 DFBB Cc1cc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)ccc1F 105589386 QPLUUXGCYILWBE-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB O=C(CNc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1CCCC1 73753031 MNUMQYAZJYZFLO-UHFFFAOYSA-N 317.267 2.648 5 40 DFBB C[C@H]1C[C@H](C)n2nccc2N1C(=O)Cc1cccc([N+](=O)[O-])c1 96425042 OTLFVIICEKNDCQ-RYUDHWBXSA-N 314.345 2.720 5 40 DFBB O=C(O)/C(=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 4914022 ZZFKPNPIOBGWHW-WUXMJOGZSA-N 313.265 2.949 5 40 DFBB CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 7216257 IIUREMKZUDWYEP-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB Cc1ccc(NC(=O)c2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] 12758884 AMTPBPYFFQQNAT-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCCC3)n2)cc1 4306217 QJUKNHMGXPXHJO-UHFFFAOYSA-N 314.349 2.619 5 40 DFBB C[C@H](c1ccncc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 67715511 VJPXCBBVNIGFHB-CQSZACIVSA-N 312.373 2.873 5 40 DFBB C[C@H]1CCCC[C@H]1OCc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 69439977 YOHVVIWOMFPTTI-IINYFYTJSA-N 317.345 2.927 5 40 DFBB O=C1CCc2cc(Oc3nc4ccccn4c3[N+](=O)[O-])ccc2N1 73448531 SUURYINGCHKTNJ-UHFFFAOYSA-N 324.296 2.920 5 40 DFBB CCN(c1ccccc1)S(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 226863011 OSENRFIWSMNFKL-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC(OC[C@H]3CCCCO3)CC2)cn1 96455879 XMZZXUJULMWCEY-OAHLLOKOSA-N 321.377 2.544 5 40 DFBB CN(Cc1cccc2ccccc12)c1ncc([N+](=O)[O-])c(N)n1 83864213 BFQKLCUHSDBLQT-UHFFFAOYSA-N 309.329 2.757 5 40 DFBB O=[N+]([O-])c1ccnn1Cc1noc(-c2ccc(Cl)cc2)n1 47169486 KRFXYKZFSYXLQO-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB O=C1CS[C@@H](c2ccc([N+](=O)[O-])o2)N1Cc1ccccc1 3182218 MWCZOCCCZJKBJD-AWEZNQCLSA-N 304.327 2.962 5 40 DFBB COC(=O)c1ccoc1COC(=O)c1c(C)cccc1[N+](=O)[O-] 24106972 GVIDFTPLZYGISM-UHFFFAOYSA-N 319.269 2.640 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@H]2C[C@H]3[C@@H]2[C@H]2[C@H]4C[C@@H]4[C@@H]23)c([N+](=O)[O-])c1 104286460 WGFAANRNHZIUTQ-ZPKFDVKASA-N 316.313 2.920 5 40 DFBB CC(C)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12773882 LHDXFZAJEPAWER-VIFPVBQESA-N 305.290 2.905 5 40 DFBB C[C@]1(c2cccs2)NC(=S)N(c2ccc([N+](=O)[O-])cc2)N1 225343310 YRWKREQHVVFCSU-ZDUSSCGKSA-N 320.399 2.728 5 40 DFBB CCN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)cc1 224917132 LOUPAVGPWBQXMV-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB COc1cc([N+](=O)[O-])cc(Br)c1N1CCCC1 45886423 SZHVTZZNDLCVIY-UHFFFAOYSA-N 301.140 2.966 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC2(CC2)c2ccccc21 96417858 VLFRPHYUJQZSIU-UHFFFAOYSA-N 310.309 2.992 5 40 DFBB Cc1cc(C(=O)Nc2ccc(-n3nccn3)cc2)ccc1[N+](=O)[O-] 32926593 NAKGVEMNCJOGEX-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB COc1c2c(cc3c1[C@H](CC(=O)C(C)C)[N+](C)(C)CC3)OCO2 487510 SWUSFKUKGIDNBT-ZDUSSCGKSA-N 320.409 2.713 5 40 DFBB biogenic CC(C)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCCC1 24864773 CWPLBQIONYLGFQ-HNNXBMFYSA-N 320.393 2.837 5 40 DFBB CC1(C)O[C@@]2(C)CC[C@@H]1[C@@H]1[C@@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 103872645 WKHNLBMOCOAPPQ-RADQJTSESA-N 316.357 2.765 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C2=O)cc1[N+](=O)[O-] 13152180 FUMNLCOHMGSPJE-JLUCKKNBSA-N 312.325 2.605 5 40 DFBB O=[N+]([O-])c1ccc(Sc2ccc([N+](=O)[O-])c3nonc23)nc1 8997323 TTXBQJHIWLGKKF-UHFFFAOYSA-N 319.258 2.585 5 40 DFBB O=c1c2cc(F)c(F)cc2ncn1Cc1csc([N+](=O)[O-])c1 72285111 XYZPQCJKFKCWBZ-UHFFFAOYSA-N 323.280 2.693 5 40 DFBB Cc1ccc(OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc1 75077252 MFDDSSTUUZAATK-UHFFFAOYSA-N 312.285 2.927 5 40 DFBB Cc1ccc([C@@H](C)OC(=O)c2ccc(=O)n(C)c2)cc1[N+](=O)[O-] 84808259 GSSYROPWCZBMRG-LLVKDONJSA-N 316.313 2.520 5 40 DFBB CCc1cnc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)s1 96439523 NBDNKTJXFXSGIA-UHFFFAOYSA-N 320.374 2.613 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)c1cc2ccc(O)cc2oc1=O 4937851 LCWGARQQKUWRJK-UHFFFAOYSA-N 311.249 2.638 5 40 DFBB CS[C@H]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1 78940772 ZIVMPCYPHJDROD-AAEUAGOBSA-N 309.391 2.678 5 40 DFBB CCc1ccc(S(=O)(=O)Nc2ccc(N)c([N+](=O)[O-])c2)cc1 7357438 NZPXAZFXRZTBTR-UHFFFAOYSA-N 321.358 2.540 5 40 DFBB CCCC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 5077107 HDGWXNVSDJKUDU-UHFFFAOYSA-N 300.698 2.530 5 40 DFBB CCc1nnc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])s1 2736670 RORMJGRYZHQJJH-UHFFFAOYSA-N 312.738 2.914 5 40 DFBB O=C(C[C@H]1OC(=O)c2ccccc21)c1cc([N+](=O)[O-])ccc1O 16740873 JTNHXVBVDMACIT-OAHLLOKOSA-N 313.265 2.785 5 40 DFBB Cc1ccc(NC(=O)COC(=O)c2ccccc2)cc1[N+](=O)[O-] 3398858 CWANCLFDFUELGH-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB COc1ccc(C(=O)Nc2nnc(C3CC3)s2)cc1[N+](=O)[O-] 6174593 STJDSMBTMHGNAL-UHFFFAOYSA-N 320.330 2.585 5 40 DFBB Cn1ccnc1C(=O)c1ccc(NCC2CCC2)c([N+](=O)[O-])c1 58394296 IWTXLCGIQQYBGU-UHFFFAOYSA-N 314.345 2.771 5 40 DFBB O=[N+]([O-])c1cccnc1NC[C@@H](c1ccco1)N1CCCC1 15171877 WPGILECCDXZIPW-ZDUSSCGKSA-N 302.334 2.832 5 40 DFBB O=c1[nH]c(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)nc2ccccc12 95439139 HRLQCQJXHULOAZ-UHFFFAOYSA-N 320.308 2.903 5 40 DFBB Cc1cccc(C(=O)NCc2cn3cccc(C)c3n2)c1[N+](=O)[O-] 96405362 LKACJMHINRPLDD-UHFFFAOYSA-N 324.340 2.789 5 40 DFBB CCOC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 97095515 CGFWQYZZLXOARB-JTQLQIEISA-N 312.753 2.747 5 40 DFBB CC[C@H]1CCCCN1CCCNC(=O)c1cccc([N+](=O)[O-])c1 13670699 AKZZETJDPBWWOE-HNNXBMFYSA-N 319.405 2.979 5 40 DFBB COc1cc(OCC(=O)Nc2ccc(F)cc2)ccc1[N+](=O)[O-] 22259398 NNNUISXYHWJZJC-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB COc1cc([N+](=O)[O-])ccc1OCC(=O)c1cc(C)[nH]c1C 72067986 USUGZAWTQDFZIB-UHFFFAOYSA-N 304.302 2.810 5 40 DFBB CC(C)c1ccccc1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 89893489 OYZRCQHKQQKGLR-UHFFFAOYSA-N 315.329 2.519 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1noc2c1CCCC2 20258778 DIIUUZDFMBZNNX-UHFFFAOYSA-N 317.301 2.723 5 40 DFBB Cc1ccc(NC(=O)[C@@H](C)OC[C@@H]2CCCCO2)cc1[N+](=O)[O-] 58431468 DLWKREZGDRDRMF-OCCSQVGLSA-N 322.361 2.816 5 40 DFBB COc1ccccc1CN(C)C(=O)c1cccc([N+](=O)[O-])c1 18076215 HXSCYWUTYRNAKK-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB C[C@H]1CCC[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2745691 SXZJZZVFAKEFFX-UWVGGRQHSA-N 307.306 2.906 5 40 DFBB CC(=O)c1ccc(NCCCc2cn[nH]c2C)c([N+](=O)[O-])c1 24204749 DDNKRIVQAVIOFB-UHFFFAOYSA-N 302.334 2.874 5 40 DFBB C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1nnc2ccccn12 97111419 FJLZRCQBIIBZAF-JTQLQIEISA-N 315.308 2.627 5 40 DFBB C[C@@H]1CCCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 57389464 HCPDPAYZFIWNHZ-SNVBAGLBSA-N 311.769 2.919 5 40 DFBB CCN1CCC(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 58438759 NCNLYNBTNFNGRE-UHFFFAOYSA-N 305.378 2.941 5 40 DFBB COc1ccc([N+](=O)[O-])cc1COC(=O)c1cccc(C)c1O 11711813 LVCFQXRWRXKRHW-UHFFFAOYSA-N 317.297 2.974 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cnc2ccccc2n1 8724854 CRYTXSFHNWAZLU-UHFFFAOYSA-N 312.260 2.929 5 40 DFBB COc1ccccc1NC(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 9368328 ZSBUJHCUNMKWLQ-UHFFFAOYSA-N 315.329 2.922 5 40 DFBB Cc1cc(C)cc([C@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 69697007 BQDQNYDGHLXTJL-ZDUSSCGKSA-N 316.361 2.676 5 40 DFBB CCN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@H](C)c1cccnc1 97052602 FGFJDMWUMWODLH-LLVKDONJSA-N 315.329 2.919 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)Nc2ccccc2F)c1 216333825 DYVYADSBKJGYSO-UHFFFAOYSA-N 310.306 2.676 5 40 DFBB CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncc(C)s1 96415647 RSTGYUHSICTLCM-JTQLQIEISA-N 321.358 2.946 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CCn1cccn1 97380042 ZNIXUZYTYVTHCX-UHFFFAOYSA-N 317.349 2.572 5 40 DFBB Cc1ccccc1NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3383757 ZXYKUUHOCRQBHA-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(c1ccccc1[N+](=O)[O-])C2=O 6050320 RTTBEWDJDVWUSZ-MGPLVRAMSA-N 302.330 2.911 5 40 DFBB O=[N+]([O-])c1ccc(Nc2nc(Cl)nc(N3CCCC3)n2)cc1 5390834 XXFCCAFITUSSCF-UHFFFAOYSA-N 320.740 2.777 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)Nc2cnn(C(C)C)c2)c1 66386026 GJTUOQKZIYHEHG-UHFFFAOYSA-N 304.306 2.633 5 40 DFBB C[C@H](Nc1cccc(NC(=O)CO)c1)c1ccccc1[N+](=O)[O-] 95404410 ZEFYQYPVRQQMPE-NSHDSACASA-N 315.329 2.699 5 40 DFBB CC[C@@H](C)NC(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408532195 NVGUNLBJBIBRPT-SNVBAGLBSA-N 300.318 2.580 5 40 DFBB O=C(CCc1cccnc1)Nc1cc(Cl)cc([N+](=O)[O-])c1O 96502857 AQXACVFJVKVPRN-UHFFFAOYSA-N 321.720 2.920 5 40 DFBB O=C(/C=C/c1cccnc1)NCc1cc([N+](=O)[O-])ccc1Cl 79093614 XKHBADBKYGNUJI-ZZXKWVIFSA-N 317.732 2.973 5 40 DFBB CNC(=O)c1ccc(Sc2nccn2C2CC2)c([N+](=O)[O-])c1 53555590 NWHHHXTZUNAEIN-UHFFFAOYSA-N 318.358 2.637 5 40 DFBB Cc1ccsc1C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1 3318507 JKHJWWXSYGVNFV-UHFFFAOYSA-N 320.326 2.760 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](c1cccs1)C(C)C 58005039 IAIWUAQKQGWGFC-CQSZACIVSA-N 322.390 2.675 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@@H]2C[C@H]3[C@H]4[C@H]5C[C@@H]5[C@@H]4[C@@H]32)c([N+](=O)[O-])c1 104286447 WGFAANRNHZIUTQ-RZJDBIAYSA-N 316.313 2.920 5 40 DFBB CC[C@H](Oc1ccc([N+](=O)[O-])c(C)c1)C(=O)Nc1cc(C)on1 14186410 DOGSDIFOSQRDQE-ZDUSSCGKSA-N 319.317 2.996 5 40 DFBB CC(C)C[C@H](CN(C)C)NC(=O)Nc1ccccc1[N+](=O)[O-] 32934681 LZRCNEDYCXNUSQ-GFCCVEGCSA-N 308.382 2.693 5 40 DFBB CC(C)C[C@H](N)C(=O)n1c2ccccc2c(=O)c2cc(N)ccc21 98043691 UPWZCJOMTDSIHG-HNNXBMFYSA-N 323.396 2.751 5 40 DFBB O=[N+]([O-])c1cccnc1N1CC2(CCC2)[C@H]1C1CCOCC1 579949779 WIWTWHYYYZHBIK-CQSZACIVSA-N 303.362 2.775 5 40 DFBB Cc1cccc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)c1[N+](=O)[O-] 96402854 GMBRKCQFYIDPFC-GFCCVEGCSA-N 314.345 2.646 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(-n2cccn2)cc1 24711051 REAWDJFFISRMCL-UHFFFAOYSA-N 322.324 2.962 5 40 DFBB C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1cccs1 24766114 FYHAXNMCTZYXTR-JTQLQIEISA-N 306.343 2.913 5 40 DFBB C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1nnc2ccccn12 97111383 AVGHJEZOUSZEPG-LBPRGKRZSA-N 311.345 2.531 5 40 DFBB CN[C@H](C(=O)c1ccccc1)[C@@H](OC)c1cccc([N+](=O)[O-])c1 57256231 XRTRVAKJWCIIMD-WBVHZDCISA-N 314.341 2.753 5 40 DFBB Cc1nnc(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)s1 11577522 KQNSDBLEKMBEKI-UHFFFAOYSA-N 324.387 2.510 5 40 DFBB COC[N+](C)(C)CCC(O)(c1ccccc1)c1ccccc1 71260647 BVVTYJVHBRPQEA-UHFFFAOYSA-N 300.422 2.993 5 40 DFBB O=C(N[C@@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1O 96012351 RBPCODPSXQVBIZ-CQSZACIVSA-N 316.288 2.857 5 40 DFBB CO[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 96007647 AOBSDGIBYZVTMU-SSDOTTSWSA-N 306.240 2.977 5 40 DFBB O=[N+]([O-])c1c(N[C@@H](CCO)c2cccs2)nc2sccn12 77236118 CJDYNOVSNIOTSU-QMMMGPOBSA-N 324.387 2.901 5 40 DFBB O=[N+]([O-])c1cc(Br)cc(Cl)c1N1CCOCC1 45958945 RUACAHASLXFICF-UHFFFAOYSA-N 321.558 2.847 5 40 DFBB Cc1nn([C@H](C)C(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1[N+](=O)[O-] 102599075 DQKCGZGIMIXYSB-CYDRSHDDSA-N 320.393 2.602 5 40 DFBB Cc1ccc(C(=O)NCCCN2CCCCC2)cc1[N+](=O)[O-] 10276890 YYKPEABXRNJFLM-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB Cc1cc(C(=O)/N=c2\cc[nH]n2[C@H](C)C2CC2)ccc1[N+](=O)[O-] 105724866 KJWRHBQKXAWDJE-AFMLGWFNSA-N 314.345 2.745 5 40 DFBB COc1cc(/C=C2/C(=O)Nc3ccccc32)c([N+](=O)[O-])cc1O 9155805 GAPGTSHHDWYCBN-IZZDOVSWSA-N 312.281 2.802 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)Cc1cccc(F)c1 93928956 GFGSBCGZEAPNJP-UHFFFAOYSA-N 324.333 2.984 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC1=CCCCC1 224153879 ICNHJNPCPWPTKE-UHFFFAOYSA-N 310.375 2.682 5 40 DFBB CC(=O)Nc1nc(CN2CCc3ccc([N+](=O)[O-])cc32)cs1 195561277 BXKPVCRZMBYKOG-UHFFFAOYSA-N 318.358 2.572 5 40 DFBB CC1CCC(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])CC1 57854100 ZIZTVYMEOXTPFC-UHFFFAOYSA-N 310.325 2.808 5 40 DFBB CCOC(=O)[C@@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1 25405626 UOCCKWDRWRCLSS-ZDUSSCGKSA-N 302.286 2.673 5 40 DFBB Cc1cc(C)cc(OS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 16092908 HABKBJVAOSUKHX-UHFFFAOYSA-N 307.327 2.979 5 40 DFBB CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 55651235 POENSOYLZMYPHR-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB Cc1cc(C)cc(OCCN(C)C(=O)c2cc([N+](=O)[O-])c[nH]2)c1 12795323 SYVXBYROFXALJC-UHFFFAOYSA-N 317.345 2.691 5 40 DFBB O=C(O)c1cn(C2CC2)c2cc(Cl)c([N+](=O)[O-])cc2c1=O 39631241 SSZUMRRPCBEXRX-UHFFFAOYSA-N 308.677 2.596 5 40 DFBB O=C(O[C@@H]1C[C@H]2CCC[C@@H]21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5409715 OPZSYSWUWGXACD-OXHMUOHRSA-N 306.274 2.848 5 40 DFBB CCCC(=O)NC(=S)Nc1nc2ccc([N+](=O)[O-])cc2s1 17066416 ZVLFUVLTEKPBEH-UHFFFAOYSA-N 324.387 2.818 5 40 DFBB O=C(O)c1ccc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 5589121 XIODMFRUWABCSR-UHFFFAOYSA-N 317.257 2.813 5 40 DFBB CCOc1cc(C=O)cc([N+](=O)[O-])c1OCc1cccnc1 8702344 ZJNTUFWKLJBSNV-UHFFFAOYSA-N 302.286 2.780 5 40 DFBB C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 6007947 ORQAQFGKAGHHCD-UKRRQHHQSA-N 316.357 2.685 5 40 DFBB C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCCCC1 6052054 UUMXVNDXDGKHPI-NSHDSACASA-N 320.345 2.589 5 40 DFBB Cc1cc(C(=O)COC(=O)c2ccccc2[N+](=O)[O-])c(C)n1C 5032253 SJMQJCCFYKDXJK-UHFFFAOYSA-N 316.313 2.590 5 40 DFBB O=[N+]([O-])c1ccc(-c2nn3c(-c4ccncc4)nnc3s2)cc1 4772660 SDPFNGJICYDCQL-UHFFFAOYSA-N 324.325 2.823 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3cccc(Cl)c3)CC2)cn1 5688861 BZAZCYZYRPQYTH-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)Nc2nncn2-c2ccccc2)c1 95988440 NNNLSDPYLOOSJI-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB Cc1ccc(NC(=O)c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 15410251 ULWPMVRMCLWFQX-UHFFFAOYSA-N 314.297 2.927 5 40 DFBB CCC[n+]1nc(Nc2ccccc2[N+](=O)[O-])c2ccccc2n1 16954069 OYLRTZFYBZAFLG-UHFFFAOYSA-N 310.337 2.979 5 40 DFBB CCOc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 364500 UZFBYQMVVPSVIZ-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(C2CCCC2)CC1 13322853 FJWWDYWGKWKUPP-UHFFFAOYSA-N 318.377 2.687 5 40 DFBB O=C(C[C@H]1CCCO1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 84425354 GFILZGIUARPELM-GFCCVEGCSA-N 301.302 2.651 5 40 DFBB O=[N+]([O-])c1ccc(NCc2nnc3ccccn23)c(Cl)c1 20669190 RUKNUDXCAPQNMX-UHFFFAOYSA-N 303.709 2.903 5 40 DFBB Cc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)o1 20922678 WEYIERTVLSYMDE-UHFFFAOYSA-N 317.345 2.834 5 40 DFBB Cc1cnc(N[C@@H]2CCC[C@H](C(=O)NC3CC3)C2)c([N+](=O)[O-])c1 78664407 VQKJHADQOBCNCX-WCQYABFASA-N 318.377 2.548 5 40 DFBB O=c1nc2c3ccc(F)cc3nc(S)n2nc1-c1ccccc1 69982237 TUINLUSGSVXKGW-UHFFFAOYSA-N 324.340 2.733 5 40 DFBB Nc1nc(COc2cc(F)ccc2[N+](=O)[O-])nc2ccccc12 8747071 VJQODTUMJMHFSN-UHFFFAOYSA-N 314.276 2.838 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccccc1F 9390316 HZUCBXXOJGFVPZ-UHFFFAOYSA-N 304.277 2.924 5 40 DFBB CCS[C@H]1CCC[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 96450534 WHEOKYDBGOPOKL-KBPBESRZSA-N 308.403 2.928 5 40 DFBB C[N+]1(C[C@@H](O)COC23CC4CC(CC(C4)C2)C3)CCCCC1 16975538 TXIYFHSCTIFQAI-GSBYPIHSSA-N 308.486 2.963 5 40 DFBB CC(=O)Oc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 265929 SUHBPMHOMRVBBK-UHFFFAOYSA-N 318.260 2.912 5 40 DFBB C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 7218020 MLLMMWODBIALOK-SNVBAGLBSA-N 324.333 2.773 5 40 DFBB CCc1nc(NC(=O)COc2ccccc2[N+](=O)[O-])sc1C 47424437 RMMQPVWCIAFPNW-UHFFFAOYSA-N 321.358 2.940 5 40 DFBB COC(=O)c1ccc(CNc2cc(C)c([N+](=O)[O-])cn2)cc1 74724828 JKENLKYAHCMHRF-UHFFFAOYSA-N 301.302 2.697 5 40 DFBB Cc1ccc(CNc2cc(C(=O)N(C)C)ccn2)cc1[N+](=O)[O-] 97102119 QHDOYELERBEDKY-UHFFFAOYSA-N 314.345 2.612 5 40 DFBB C[C@H]1CCCC[C@]12NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C2=O 2619917 CLLNGRROACEWTM-ZBEGNZNMSA-N 317.345 2.596 5 40 DFBB Cc1c(CN[C@@H](C)c2nnc3ccccn23)cccc1[N+](=O)[O-] 97111406 IGTQFEYTCXVNQQ-LBPRGKRZSA-N 311.345 2.797 5 40 DFBB Cc1cccc(C(=O)Nc2ccc(-n3cccn3)nc2)c1[N+](=O)[O-] 12527270 TUGXPSHYDKSBIX-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB O=[N+]([O-])c1ccc(N2CCO[C@H](c3ccc(F)cc3)C2)nc1 29528173 APKVWZGRBCTVFG-AWEZNQCLSA-N 303.293 2.707 5 40 DFBB CCn1cc(CN(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cn1 95945501 RQAIUFZXSKDDGZ-UHFFFAOYSA-N 322.752 2.737 5 40 DFBB C[C@H]1CCc2ccccc2N1C(=O)[C@H](C)n1cc([N+](=O)[O-])cn1 180504292 HHZOWXONHLHTEY-RYUDHWBXSA-N 314.345 2.720 5 40 DFBB CCN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(F)c1 48367508 JEJXIDJPVQUKHQ-UHFFFAOYSA-N 317.320 2.859 5 40 DFBB Cc1cc(C(=O)NCC(C)(C)N2CCCCC2)ccc1[N+](=O)[O-] 17792895 QFDNXWOZURPGHU-UHFFFAOYSA-N 319.405 2.898 5 40 DFBB CC(C)c1ccc(-c2nn3nnc4ccccc4c3nc2=O)cc1 72312833 CDXSSIJUVXGDCR-UHFFFAOYSA-N 317.352 2.823 5 40 DFBB C/C=C/C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 8293023 HCMYNPGYEXMISC-NWALNABHSA-N 303.274 2.825 5 40 DFBB Cc1c(C(=O)Nc2cccnc2N(C)C)cccc1[N+](=O)[O-] 49727857 YRMASULSRXHXMO-UHFFFAOYSA-N 300.318 2.617 5 40 DFBB CC(C)OCCCNC(=O)c1cc([N+](=O)[O-])ccc1Cl 6345493 LHSYCVLJOFOKOJ-UHFFFAOYSA-N 300.742 2.793 5 40 DFBB CCN(CC)CCC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1 3093078 HPRQGRIUUURMDP-CYBMUJFWSA-N 307.394 2.835 5 40 DFBB C[C@@H](CNc1ncccc1[N+](=O)[O-])N1CCc2ccccc2C1 26729811 IFDMTJDHKSTYAB-ZDUSSCGKSA-N 312.373 2.849 5 40 DFBB Cc1c(NC(=O)c2ccc([S@@](C)=O)cc2)cccc1[N+](=O)[O-] 14287376 GNZXUJHKTCKIDE-QFIPXVFZSA-N 318.354 2.893 5 40 DFBB COc1cccc(CNc2cc(OC)c([N+](=O)[O-])cc2F)n1 95982711 RKIYYRQPCDWWIT-UHFFFAOYSA-N 307.281 2.758 5 40 DFBB Nc1nc(NCCc2cccc3ccccc23)ncc1[N+](=O)[O-] 89873230 XQYSGSCELLCXBO-UHFFFAOYSA-N 309.329 2.775 5 40 DFBB C[C@@H](C[C@@H]1CCCO1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095525 GDLVQLHVNTVSNR-ONGXEEELSA-N 312.753 2.936 5 40 DFBB COc1ccc([C@@H](O)[C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 96485323 CINCMBUGBGAPPG-BZNIZROVSA-N 317.345 2.841 5 40 DFBB O=[N+]([O-])c1ccc(-c2nnc(-c3ccc([N+](=O)[O-])o3)o2)cc1 3152406 YYEXHCXZRCCOJZ-UHFFFAOYSA-N 302.202 2.813 5 40 DFBB O=[N+]([O-])c1ccc(NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 100008468 FJFUNEIRCJRYPI-UHFFFAOYSA-N 319.233 2.850 5 40 DFBB Cc1cc(N2C(=O)CS[C@H]2c2ccc([N+](=O)[O-])cc2)no1 18199882 JSUHNVQZLZFYFK-ZDUSSCGKSA-N 305.315 2.670 5 40 DFBB COC(=O)c1cnc(/C=C/c2ccc([N+](=O)[O-])c(O)c2)s1 69977129 WFBWBVHTKJPETD-HWKANZROSA-N 306.299 2.714 5 40 DFBB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 6828721 RJVVQUURVYDMTH-NXEZZACHSA-N 324.720 2.854 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCc2ccccc21 10960206 FLIQAKSSDPEVNJ-AWEZNQCLSA-N 312.325 2.777 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CNC1CCC(C)CC1 6077873 NEQMIFXTLZRYPD-UHFFFAOYSA-N 321.377 2.710 5 40 DFBB O=[N+]([O-])c1cnccc1NCc1nc(-c2ccc(F)cc2)n[nH]1 69744291 IHGHEMNRSIZXOV-UHFFFAOYSA-N 314.280 2.526 5 40 DFBB C[C@@H](Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)c1ccc(F)c(F)c1 97238314 WZRBJKCDLPPFMI-VIFPVBQESA-N 322.267 2.554 5 40 DFBB CC[C@H](c1ccncc1)N(C)C(=O)c1cccc([N+](=O)[O-])c1O 89947963 MDFCHSGJJOPNRI-CYBMUJFWSA-N 315.329 2.919 5 40 DFBB COc1cc(-c2nc(-c3ccccc3[N+](=O)[O-])n[nH]2)ccc1O 85384259 YMAWLXQBZSQNRG-UHFFFAOYSA-N 312.285 2.761 5 40 DFBB O=C(Cc1c(F)cccc1F)Nc1ccc(O)c([N+](=O)[O-])c1 166140449 OYVFBSRQZNWBCX-UHFFFAOYSA-N 308.240 2.760 5 40 DFBB COC(=O)[C@H](CC1CCCCC1)Nc1ncccc1[N+](=O)[O-] 20389716 WLPJQKWBQLOJER-LBPRGKRZSA-N 307.350 2.914 5 40 DFBB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-] 102430634 GCXCZOHOPBMYLM-FRRDWIJNSA-N 306.362 2.915 5 40 DFBB Cn1ccnc1CC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 105793579 URHZCWFDJPKXKN-UHFFFAOYSA-N 318.352 2.927 5 40 DFBB COc1ccc(OC)c(C(=O)NCc2ccc([N+](=O)[O-])cc2)c1 55797508 URAKFTGUKCVAGE-UHFFFAOYSA-N 316.313 2.542 5 40 DFBB CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)CCC2 71794475 XOZABNVQVYXSSG-UHFFFAOYSA-N 318.358 2.834 5 40 DFBB CCN(C(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-])c1ccccc1 7045011 BWAIWDWOLNSINT-GFCCVEGCSA-N 315.329 2.810 5 40 DFBB NC(=O)c1ccc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 69536758 WOJBSSBOBANSSE-UHFFFAOYSA-N 322.324 2.606 5 40 DFBB CCc1ccc(OCCNC(=O)c2ccccc2[N+](=O)[O-])cc1 408718664 RDHKKKIQUUVKQQ-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB N[C@@H](c1ccc(F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 95533261 MKCVYQSZFKNRBW-ZDUSSCGKSA-N 313.292 2.567 5 40 DFBB CS[C@@H](CO)[C@H](C)Nc1ccc2ncccc2c1[N+](=O)[O-] 96417310 HTRRIWDAJOAPLP-ZANVPECISA-N 307.375 2.667 5 40 DFBB Cc1sc(C(=O)N[C@@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] 95445494 GACLRBMRUHDOOF-KWQFWETISA-N 324.358 2.800 5 40 DFBB Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccn(C)c(=O)c1 75141219 YKYQZEDSSBFMBT-UHFFFAOYSA-N 321.720 2.508 5 40 DFBB CCOc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 13671069 JHCXWGAXWFBGMK-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB O=C1Nc2ccc([N+](=O)[O-])cc2/C1=C\c1ccc2c(c1)OCCO2 40068672 ORLOQKFIPFYHDZ-NTUHNPAUSA-N 324.292 2.859 5 40 DFBB C[C@@H]1CCCC[C@@]12NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C2=O 2619916 CLLNGRROACEWTM-BDJLRTHQSA-N 317.345 2.596 5 40 DFBB CCOc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1 6315815 NAUCUPOSNZKVLJ-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1cc2ccccc2o1 97111324 HDELWMTWONWOOS-NSHDSACASA-N 300.318 2.888 5 40 DFBB COCc1nc(C(=O)OCc2ccc([N+](=O)[O-])cc2)cs1 58278328 XFNVVTSDKRJVPN-UHFFFAOYSA-N 308.315 2.555 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1[N+](=O)[O-] 3959022 GOGGERNLVIRZNY-UHFFFAOYSA-N 317.257 2.521 5 40 DFBB O=C(COc1ccccc1)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4628501 UNEVBPWTDKQDMH-UHFFFAOYSA-N 317.257 2.521 5 40 DFBB O=[N+]([O-])c1ccc(-c2cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c2)cc1 66139505 FHTDWPRNGLZIRR-UHFFFAOYSA-N 305.202 2.784 5 40 DFBB Cc1c(NC(=O)c2ccc(-n3ccnc3)nc2)cccc1[N+](=O)[O-] 24549464 PYLSOWCKNKKOHU-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB Cc1c(C(=O)Nc2cccc([S@@](C)=O)c2)cccc1[N+](=O)[O-] 71893545 VCLITHKLZDPBCV-QFIPXVFZSA-N 318.354 2.893 5 40 DFBB C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 32804220 YYKFWMOGIQNPKB-GFCCVEGCSA-N 320.370 2.775 5 40 DFBB Cn1ncnc1Sc1ccc([N+](=O)[O-])cc1Br 225574463 HZJRTSIAGDVXEO-UHFFFAOYSA-N 315.152 2.637 5 40 DFBB Cc1ccc(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 32804254 JGANCRSHRGFKAM-UHFFFAOYSA-N 320.370 2.523 5 40 DFBB Cc1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] 7402319 YOQRJVMTSVBOEM-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB Cc1cc(NCCc2nccn2C)c2cc([N+](=O)[O-])ccc2n1 96008430 UFWZDGOYJWPQST-UHFFFAOYSA-N 311.345 2.840 5 40 DFBB COc1ccc(OC)c(NC(=O)c2ccc([N+](=O)[O-])s2)c1 9750098 DRFZVJCPZOMHRL-UHFFFAOYSA-N 308.315 2.926 5 40 DFBB CCCCN(C(=O)Cn1nc(C)c([N+](=O)[O-])c1C)[C@H](C)CC 7786337 RAFJPKYXQNGJMM-LLVKDONJSA-N 310.398 2.835 5 40 DFBB Cc1ncc([N+](=O)[O-])n1Cc1nnc(-c2cccc(Cl)c2)o1 69629011 AOEJODCZZBZELC-UHFFFAOYSA-N 319.708 2.851 5 40 DFBB C[C@H](NC(=O)[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 72986938 BTYTXEODBNQNGG-XHDPSFHLSA-N 300.314 2.506 5 40 DFBB O=C(NCc1nc2ccccc2[nH]1)Nc1ccccc1[N+](=O)[O-] 32797159 YWQSEGUCNXYXRO-UHFFFAOYSA-N 311.301 2.793 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1cccc(F)c1 43785684 CZUPEIUZZLGXAN-UHFFFAOYSA-N 324.333 2.521 5 40 DFBB O=C(NCCNC1CCCCCC1)c1ccccc1[N+](=O)[O-] 195542975 JFKAMSWKQIVMKK-UHFFFAOYSA-N 305.378 2.637 5 40 DFBB CNC(=O)c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1C 97113996 AYCSHOJAHLTHGJ-UHFFFAOYSA-N 313.357 2.917 5 40 DFBB O=C(O)c1cn(Cc2cccc(Cl)c2Cl)nc1[N+](=O)[O-] 408716147 JJWUSLDMPUYTRZ-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB O=C(NCCCn1cnc2ccccc21)c1ccc([N+](=O)[O-])cc1 8136131 DOTXYJULZYYHTA-UHFFFAOYSA-N 324.340 2.765 5 40 DFBB O=[N+]([O-])c1cccc(Cl)c1-c1noc(C2CCNCC2)n1 199783237 KUJGBKWRYHTJQP-UHFFFAOYSA-N 308.725 2.765 5 40 DFBB O=[N+]([O-])c1c(Br)cc(Br)c2[nH]ncc12 95215785 QVQPGALMQJANNL-UHFFFAOYSA-N 320.928 2.996 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]2CC[C@H]1C2 104863420 XTLHJSZKNPFOPV-SLEUVZQESA-N 303.362 2.559 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccc[nH]1 71818740 JYUBDDBURFEZEE-OAHLLOKOSA-N 315.329 2.665 5 40 DFBB O=C(Nn1cnc2ccccc21)c1ccc(Cl)cc1[N+](=O)[O-] 12551556 NOOFTNDEPAIESN-UHFFFAOYSA-N 316.704 2.982 5 40 DFBB Cc1cc(NC(=O)[C@H]2CCO[C@@H]2C)c2cc([N+](=O)[O-])ccc2n1 97142437 QBAOMWNSAOIUPX-PWSUYJOCSA-N 315.329 2.815 5 40 DFBB CC(=O)c1ccc(N2CCC[C@H](N3CCCC3)C2)c([N+](=O)[O-])c1 48343301 ORSWSRVJLMPWBP-HNNXBMFYSA-N 317.389 2.862 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nc[nH]n2)cc1 75136991 VONOTMQDIHCYDS-UHFFFAOYSA-N 323.312 2.561 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCCC[C@H]2C)c([N+](=O)[O-])c1 26508768 PFTQFKIEVODVEB-SECBINFHSA-N 323.305 2.668 5 40 DFBB O=C(NCCC1=CCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 5251527 ZWJQDRNHIZVRKJ-UHFFFAOYSA-N 317.345 2.540 5 40 DFBB O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NC1CCCCCC1 31733497 UUQAIFMEUVSIHJ-UHFFFAOYSA-N 316.361 2.784 5 40 DFBB COc1ccc([C@H](C[N+](=O)[O-])C2C(=O)CC(C)(C)CC2=O)cc1 100835213 CBWQGVITGZFHSI-ZDUSSCGKSA-N 319.357 2.630 5 40 DFBB C[C@H]1CCCC[C@@]12NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C2=O 2619915 CLLNGRROACEWTM-MEDUHNTESA-N 317.345 2.596 5 40 DFBB C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 6007599 ORQAQFGKAGHHCD-ZFWWWQNUSA-N 316.357 2.685 5 40 DFBB O=C(Nc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 3073295 KIESCJBWOXGQJC-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1Cl)Nc1ccc(O)cc1 28083542 XZYXJDIYZSRTED-UHFFFAOYSA-N 322.704 2.971 5 40 DFBB COc1ccc(CN2CCCN(C(C)(C)C)CC2)cc1[N+](=O)[O-] 64009776 YVPQIGDBEGZOBL-UHFFFAOYSA-N 321.421 2.910 5 40 DFBB O=c1c2c(=O)n3c(nc2oc2ccc4ccccc4c12)SCC3 530693 MBMVYDWWBGWSTA-UHFFFAOYSA-N 322.345 2.762 5 40 DFBB Cc1ccc(C)c(N2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 20405597 NFFRAGZFPYNZGL-UHFFFAOYSA-N 312.373 2.933 5 40 DFBB O=c1[nH]c(O)nc(/C=C/c2cccc3ccccc23)c1[N+](=O)[O-] 4817623 LKJXKHFLDVGUOQ-CMDGGOBGSA-N 309.281 2.707 5 40 DFBB O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 4966370 BBEWIHFXBBIVCA-UHFFFAOYSA-N 301.254 2.681 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCc1ccccn1 97145789 CVAAZSVWSAMPSI-UHFFFAOYSA-N 314.345 2.971 5 40 DFBB CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C1CCOCC1 72307196 VEMRMXKBDUPANS-AWEZNQCLSA-N 310.325 2.669 5 40 DFBB COc1ccc([C@@H](CO)N(C)Cc2ccccc2[N+](=O)[O-])cc1 71904390 NCENIHRMBYYRPJ-QGZVFWFLSA-N 316.357 2.769 5 40 DFBB CC(C)c1ccc2nc(Cc3ccc([N+](=O)[O-])cn3)[nH]c(=O)c2c1 97235803 OFVFYYABDXIFHN-UHFFFAOYSA-N 324.340 2.941 5 40 DFBB Cc1nn(-c2ccccc2)c2c1c(=O)c1ccccc1c(=O)n2C 1587435 ITBFJVRENZEEHO-UHFFFAOYSA-N 317.348 2.546 5 40 DFBB CCOc1ccc(NC(=O)c2noc(C)c2C)c([N+](=O)[O-])c1 13641128 OJXDPOOLNLIIFU-UHFFFAOYSA-N 305.290 2.851 5 40 DFBB O=c1c(C(F)(F)F)cccn1Cc1c(F)cccc1[N+](=O)[O-] 69773183 CTLDNSUQEJLHKD-UHFFFAOYSA-N 316.210 2.963 5 40 DFBB Cc1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 7738072 LFLIAWPWTKLQPY-ZETCQYMHSA-N 324.387 2.874 5 40 DFBB O=[N+]([O-])c1ccc(NCC2(O)CCOCC2)c(C(F)(F)F)c1 72293773 QPTQMTGVXULLFZ-UHFFFAOYSA-N 320.267 2.567 5 40 DFBB O=C(c1ccc(Cl)s1)N1CCc2ncc([N+](=O)[O-])cc2C1 95992867 SWEPYNDPKGRACG-UHFFFAOYSA-N 323.761 2.903 5 40 DFBB Cc1n[nH]c(Sc2ccc(C(=O)OC(C)C)cc2[N+](=O)[O-])n1 70462357 DHHLSQCCLCWTPJ-UHFFFAOYSA-N 322.346 2.738 5 40 DFBB Cc1nn(C)c(NCCOc2ccc3c(c2)CCC3)c1[N+](=O)[O-] 54837699 OYYWVXKLDKVWEE-UHFFFAOYSA-N 316.361 2.616 5 40 DFBB COc1cccc(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2)c1 21333306 HCOTYDJWDPCWLB-UHFFFAOYSA-N 314.341 2.805 5 40 DFBB Cc1cc(NC[C@H]2CCOC2)nc(-c2cccc([N+](=O)[O-])c2)n1 58208892 VDMAJCVKKIGMRM-GFCCVEGCSA-N 314.345 2.809 5 40 DFBB COC(=O)c1cc(C(=O)N(C)[C@@H](C)C(C)(C)C)cc([N+](=O)[O-])c1 12943282 BDGBCBUNJZYQLL-JTQLQIEISA-N 322.361 2.888 5 40 DFBB O=C(CCc1cccs1)NCCNc1ccccc1[N+](=O)[O-] 8146324 KPSCVHVJSUIZDY-UHFFFAOYSA-N 319.386 2.817 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc([S@](C)=O)cc1 72298068 MKQGHQFJRAEXOM-JOCHJYFZSA-N 318.354 2.893 5 40 DFBB CC(C)(NC(=O)CC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 79630663 VMFPFRZTZJMQCF-AWEZNQCLSA-N 306.362 2.905 5 40 DFBB O=[N+]([O-])c1cccc(OCCOc2ccccc2[N+](=O)[O-])c1 40116327 HELKCIJFSYXKIF-UHFFFAOYSA-N 304.258 2.961 5 40 DFBB O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCCCO3)nc1 66818828 FTPSFNUEKQGKLR-UHFFFAOYSA-N 301.302 2.763 5 40 DFBB O=C(NCCCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1 9387450 LTJPVJMWZVGFQS-UHFFFAOYSA-N 314.341 2.932 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@H](C)NC(=O)c1cncc(C)c1 95403477 XQQNIBBOGHNFGE-NSHDSACASA-N 315.329 2.798 5 40 DFBB Cc1c(NC(=O)N2CCCc3n[nH]cc32)cccc1[N+](=O)[O-] 585140998 NQOBEFIGCSLMLZ-UHFFFAOYSA-N 301.306 2.611 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]3C2=O)C42CC2)c([N+](=O)[O-])c1 100171913 JBXTZRPOFLDERS-LWWSYDQCSA-N 324.336 2.605 5 40 DFBB COC(=O)c1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 14015319 NYGAGEVDCKJNKS-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB Cc1cnc(N(C)Cc2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])c1 96453900 GFUZNOXRXBOCJU-QFIPXVFZSA-N 319.386 2.672 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@@H](C)NC(=O)c1ccncc1F 95400420 OKFIXGFHTFXUTC-SECBINFHSA-N 319.292 2.629 5 40 DFBB Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(Cl)s1 40499053 MSCQLQIOOYZBDJ-UHFFFAOYSA-N 311.750 2.943 5 40 DFBB CC[C@@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCO1 40526293 MWTVWJOPUYUWCX-SNVBAGLBSA-N 313.741 2.891 5 40 DFBB COc1ccccc1O[C@H](C)CNc1ccc([N+](=O)[O-])nc1 78504463 HTUFJXZJQRPWOE-LLVKDONJSA-N 303.318 2.878 5 40 DFBB Cc1cc(C(=O)OCc2cn3ccccc3n2)ccc1[N+](=O)[O-] 5357996 SGMVQKQQUMEQMS-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB Cc1cnn(CCC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 68008332 FWJRWHFELHLHIW-UHFFFAOYSA-N 308.725 2.782 5 40 DFBB COC(=O)c1ccc([N+](=O)[O-])c(NCc2nc(C)c(C)o2)c1 97238128 XYJAVSOHAVIQOL-UHFFFAOYSA-N 305.290 2.598 5 40 DFBB O=[N+]([O-])c1cc(Br)cnc1-n1cnc(Cl)c1 1889015952 MRQYUAJLUVEZDV-UHFFFAOYSA-N 303.503 2.591 5 40 DFBB COc1ccc([N+](=O)[O-])cc1OCC(=O)N(C)C1CCCCC1 6290818 FVEVVGNRUKTBOD-UHFFFAOYSA-N 322.361 2.773 5 40 DFBB COc1ccc(C(=O)[C@@H](C)Oc2cccnc2[N+](=O)[O-])cc1 5971299 YQIPBYAVHRPPHY-SNVBAGLBSA-N 302.286 2.649 5 40 DFBB Cc1nnc2n1N1C(=CS[C@H]1c1ccc([N+](=O)[O-])cc1)S2 12409896 JUKAMCFWPMHTMQ-NSHDSACASA-N 319.371 2.783 5 40 DFBB Cc1cnc(N[C@@H]2CCC[C@@H](C(=O)NC3CC3)C2)c([N+](=O)[O-])c1 78664417 VQKJHADQOBCNCX-DGCLKSJQSA-N 318.377 2.548 5 40 DFBB CS[C@@H]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1 78940775 ZIVMPCYPHJDROD-DGCLKSJQSA-N 309.391 2.678 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@H](c1ccccc1)c1ccccn1 102875261 IHEZFHVOKOLKKX-CQSZACIVSA-N 309.329 2.925 5 40 DFBB CC(=O)c1cc([N+](=O)[O-])ccc1N1C(=O)C(=O)c2ccccc21 408580646 DLOKYMXMIYRGST-UHFFFAOYSA-N 310.265 2.658 5 40 DFBB COc1ccccc1N1CCn2c(nc3cc([N+](=O)[O-])ccc32)C1 13689687 QOKBBBUIFAFELS-UHFFFAOYSA-N 324.340 2.973 5 40 DFBB CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])c2ccc(F)cc21 72535820 IIYWRKDNUAFRBC-UHFFFAOYSA-N 315.304 2.831 5 40 DFBB O=C(OCc1ccc(Oc2cccnc2)cc1)[C@H]1C[C@@H]1[N+](=O)[O-] 95350489 LTPIEVMVIQGVNX-GJZGRUSLSA-N 314.297 2.582 5 40 DFBB COc1cc(F)c([N+](=O)[O-])c(NCc2nnc(C(C)C)n2C)c1 95997047 OAKDSOKOEGRPEC-UHFFFAOYSA-N 323.328 2.607 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)COCC(F)(F)F 225560777 KBFBAOWELUUZMB-SECBINFHSA-N 320.267 2.600 5 40 DFBB Cc1sc(C(=O)N[C@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] 95445495 GACLRBMRUHDOOF-KCJUWKMLSA-N 324.358 2.800 5 40 DFBB C[N+]12CCCC[C@@H]1[C@H](CN1C(=O)c3ccccc3C1=O)CCC2 1063797 UMWVQFMDELFMHV-FYNSKXJZSA-N 313.421 2.692 5 40 DFBB biogenic,in-vitro Cc1cc(NC(=O)NC[C@@H]2CCC[C@@H](O)C2)ccc1[N+](=O)[O-] 97163049 GPYIVWYKEJSLCJ-DGCLKSJQSA-N 307.350 2.576 5 40 DFBB C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 65575246 RNFBYAKXZOPPRK-QMMMGPOBSA-N 320.326 2.876 5 40 DFBB Cc1ccc(OCc2nnc(-c3ccco3)o2)c([N+](=O)[O-])n1 7229420 ZTIUFNKYVOARNQ-UHFFFAOYSA-N 302.246 2.520 5 40 DFBB C[C@H]1C[C@H](C)n2nccc2N1C(=O)c1ccc(F)cc1[N+](=O)[O-] 97227647 OGKXDPCBZLZPLI-UWVGGRQHSA-N 318.308 2.930 5 40 DFBB COc1ccc(F)c(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 88211499 BIZWGBRADZZINL-UHFFFAOYSA-N 304.277 2.924 5 40 DFBB Nc1ccc(C(=O)N2CC[C@@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] 33028342 XRPYWDCKSHXQCN-WCQYABFASA-N 303.362 2.829 5 40 DFBB C[n+]1c2ccccc2nc2ccc(NCCc3cnc[nH]3)cc21 4147285 VSPNFEFQPWLNTK-UHFFFAOYSA-O 304.377 2.590 5 40 DFBB CCN(C[C@H]1CCOC1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 58901691 URXCWPXPLDEHHP-LLVKDONJSA-N 317.345 2.575 5 40 DFBB COC(=O)c1cc(C(=O)N(C)[C@H](C)C(C)(C)C)cc([N+](=O)[O-])c1 12943288 BDGBCBUNJZYQLL-SNVBAGLBSA-N 322.361 2.888 5 40 DFBB Cc1csc(-c2cccc(OC(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])c2)n1 65491530 SZIYJNCCPQLVIR-NEPJUHHUSA-N 304.327 2.689 5 40 DFBB O=[N+]([O-])c1ccc([C@H](O)CNc2ncnc3sccc23)cc1 8147911 ZNKYVZZBNITIKH-GFCCVEGCSA-N 316.342 2.745 5 40 DFBB COc1ccnc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 96501748 QVMJIEBRLUJPJA-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB C[C@@H](C(=O)N[C@@H]1CCCc2ccccc21)n1cc([N+](=O)[O-])cn1 2747982 KLADXPKSQWKQFK-XHDPSFHLSA-N 314.345 2.546 5 40 DFBB COc1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])o2)cc1OC 12695048 ZGNYUZWGAIUWGR-UHFFFAOYSA-N 306.274 2.766 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2ccccc21 12746114 JHEGYBWFXYOGNJ-INIZCTEOSA-N 312.325 2.777 5 40 DFBB CC1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CC1 32478001 LQNVTZVVTOAIMH-UHFFFAOYSA-N 314.345 2.653 5 40 DFBB COc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 1284509 NAAAPCOXBMPOIR-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB Cn1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1 24474347 CBZAPXCERKUESI-UHFFFAOYSA-N 302.315 2.795 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)NCCc2ccsc2)c1 146956030 WAQFGRINERMASN-UHFFFAOYSA-N 306.343 2.637 5 40 DFBB O=C(Cc1ccccc1)Nc1nnc(-c2cccc([N+](=O)[O-])c2)o1 20496163 CMGAEDKLUFQXIR-UHFFFAOYSA-N 324.296 2.826 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](c1cccs1)C(C)C 58005040 IAIWUAQKQGWGFC-AWEZNQCLSA-N 322.390 2.675 5 40 DFBB Cc1ccnc(N[C@@H]2CCN(c3ncccc3F)C2)c1[N+](=O)[O-] 89701876 JYIIADCCXXOWPK-LLVKDONJSA-N 317.324 2.523 5 40 DFBB CN(c1ccccc1)S(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 7308541 DKVSBYHVEIIBHX-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N[C@@H](C)c1ccccc1 22085965 VEKOICOQIMLTRN-RYUDHWBXSA-N 315.329 2.635 5 40 DFBB S=C(Nc1ccc2nc3ccccc3nc2c1)N1CCOCC1 408975176 IXCSECGWWFUZMG-UHFFFAOYSA-N 324.409 2.812 5 40 DFBB CC(C)(C)OC(=O)N[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1 67801130 ZZXHVDOVHFUPKJ-CYBMUJFWSA-N 321.377 2.694 5 40 DFBB Cc1ccc(CN2CCS[C@H]3COCC[C@@H]32)cc1[N+](=O)[O-] 91855923 VZKORYQDEILDLM-ZFWWWQNUSA-N 308.403 2.610 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)c2cccc(F)c2)c1 95962344 RFLAQKHIFSOKOL-HNNXBMFYSA-N 318.304 2.506 5 40 DFBB Cc1ccccc1[C@H]1CCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 95393547 QQLWFGJWBVHLAB-CYBMUJFWSA-N 314.345 2.912 5 40 DFBB CCc1cccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 1728615 JLVZJKIXDNEIEY-UHFFFAOYSA-N 307.327 2.925 5 40 DFBB O=C(Nc1ccccc1[N+](=O)[O-])N1CCN(C2CCCC2)CC1 45032552 VBJQBGUNGGTJLH-UHFFFAOYSA-N 318.377 2.687 5 40 DFBB Cc1nonc1O[C@H](C)CNc1ccc(Cl)cc1[N+](=O)[O-] 4695995 AHYNAWVBDOVMFE-SSDOTTSWSA-N 312.713 2.819 5 40 DFBB C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 23994266 AVTXFAAHUCOQKI-SNVBAGLBSA-N 324.333 2.773 5 40 DFBB CC(=O)Oc1cc(OC(C)=O)c2c(=O)c3ccccc3oc2c1 30822693 NHFXKFAWXLGQPE-UHFFFAOYSA-N 312.277 2.797 5 40 DFBB Cc1c(C(N)=O)c2ccccc2n1C(=O)c1ccc([N+](=O)[O-])cc1 216960727 BYHWCPBUXSJYBQ-UHFFFAOYSA-N 323.308 2.645 5 40 DFBB CN(C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)c1ccsc1 12348379 LEVGDXPDDIJJQT-CQSZACIVSA-N 319.386 2.689 5 40 DFBB CN(C)c1ccc(-c2nc(-c3ccncc3)no2)cc1[N+](=O)[O-] 8587168 PZMHXQGSGKRDTM-UHFFFAOYSA-N 311.301 2.773 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)C[C@H](C)C1 6416792 IDHCWKFTMSJFPY-RYUDHWBXSA-N 321.377 2.520 5 40 DFBB CCc1cc(N2CCCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 96011361 SAYHICGNADEYJR-UHFFFAOYSA-N 300.318 2.756 5 40 DFBB CSC[C@@H](C)C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 68103363 VMQZKTKRHGXWAI-SNVBAGLBSA-N 320.374 2.718 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)cc1OC 35307865 FBTKGJLLKRSPFP-UHFFFAOYSA-N 318.285 2.570 5 40 DFBB COC(=O)Cc1cc(OCc2ccccc2)ccc1[N+](=O)[O-] 43220678 HRWGHLSKSOYUJA-UHFFFAOYSA-N 301.298 2.889 5 40 DFBB in-vitro CC[N+](C)(C)CCOC(=O)[C@](O)(c1ccccc1)C1CCCC1 5955193 ZKEUIGZJPBJVCK-IBGZPJMESA-N 320.453 2.704 5 40 DFBB C[C@H]1C[C@@H](C)CN(CCCNC(=O)c2ccc([N+](=O)[O-])cc2)C1 10542863 SVZXRZOSLHTCIN-OKILXGFUSA-N 319.405 2.693 5 40 DFBB CCCNC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 3319487 CDLXIDGDLMOLOL-UHFFFAOYSA-N 311.388 2.823 5 40 DFBB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1 96486105 YHGALCOLMFRSIS-AWEZNQCLSA-N 314.345 2.912 5 40 DFBB Cc1nnc2n1N1C(=CS[C@@H]1c1ccc([N+](=O)[O-])cc1)S2 12409897 JUKAMCFWPMHTMQ-LLVKDONJSA-N 319.371 2.783 5 40 DFBB COc1cc([C@@H]2NC[C@@H](c3ccc([N+](=O)[O-])cc3)O2)ccc1O 19643004 MGHHNWNXFHDEBT-JKSUJKDBSA-N 316.313 2.669 5 40 DFBB Cc1nccn1C[C@@H]1CCCN1c1cccc(F)c1[N+](=O)[O-] 225596857 WDZMLJGCCNAULR-LBPRGKRZSA-N 304.325 2.908 5 40 DFBB CCN(C1CC1)S(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 30359767 QMRQFYVWVYIYAT-UHFFFAOYSA-N 318.782 2.730 5 40 DFBB O=C1C[C@@H](c2ccccc2)CN1C(=O)c1ccc([N+](=O)[O-])cc1 264397 AERCIWRBCUTEFD-CQSZACIVSA-N 310.309 2.751 5 40 DFBB CCOC(=O)c1noc(C)c1COc1ccc([N+](=O)[O-])cc1 12396701 HFIYXEKCQFCNSI-UHFFFAOYSA-N 306.274 2.647 5 40 DFBB COc1ccc(NC(C)=O)cc1Nc1ncccc1[N+](=O)[O-] 7186510 ILRRQZGYAMDPEO-UHFFFAOYSA-N 302.290 2.700 5 40 DFBB NC(=O)c1ccc(COc2cc(F)ccc2F)c([N+](=O)[O-])c1 75582969 VOHPCAWEGMOIIO-UHFFFAOYSA-N 308.240 2.551 5 40 DFBB C[C@@H](OC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 7975347 MUAKDWXFRICQNM-LLVKDONJSA-N 314.297 2.779 5 40 DFBB Cc1ccc(C(=O)NCCSc2ccccn2)cc1[N+](=O)[O-] 408874311 BCGBMGWHQHJIJQ-UHFFFAOYSA-N 317.370 2.820 5 40 DFBB CC(=O)c1ccc(N[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1 69349191 QJMPOOGCWWZFKV-OAHLLOKOSA-N 314.341 2.813 5 40 DFBB CNC(=O)c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 8423869 VFJAVLJCHNHOLW-UHFFFAOYSA-N 313.313 2.515 5 40 DFBB CS[C@H]1CCC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 95468180 HMQNTEJUOOTWKS-UWVGGRQHSA-N 309.391 2.581 5 40 DFBB Cc1ccc(C(=O)OCc2ccc(Cl)c([N+](=O)[O-])c2)c(=O)[nH]1 95401131 MJDLEDKMWRVDFC-UHFFFAOYSA-N 322.704 2.602 5 40 DFBB COC(=O)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 5754069 WXHIYRHSMYGDME-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 5568342 IFNWATDGEYDLRY-UHFFFAOYSA-N 318.782 2.813 5 40 DFBB O=C(NC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1)C1CC1 30525013 YQUOHVWZZUFCOK-UHFFFAOYSA-N 323.780 2.743 5 40 DFBB COc1cc(F)ccc1NC(=O)COc1ccccc1[N+](=O)[O-] 25309577 TXBLOKWVFVUZSD-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N(C)S(=O)(=O)c1ccccc1 224672781 VAZGXNPEGQKWIO-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB Cc1ncc([N+](=O)[O-])n1Cc1ccn(-c2c(F)cccc2F)n1 95433590 UXGYZZAHNCNPBT-UHFFFAOYSA-N 319.271 2.612 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OCC(F)(F)F 31702018 YJTFBKSMEGVSAL-MRVPVSSYSA-N 306.240 2.809 5 40 DFBB O=C1NCCCC[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 49980360 SAHMFXVPZPXFPF-JTQLQIEISA-N 317.267 2.694 5 40 DFBB Cc1nn(C)c(Cc2n[nH]c3ccc([N+](=O)[O-])cc23)c1Cl 4395573 CFJWSELJKAWDBZ-UHFFFAOYSA-N 305.725 2.757 5 40 DFBB O=c1c2ccsc2ccn1C[C@@H](O)c1cccc([N+](=O)[O-])c1 97052808 SNAZCTSNMJQGCB-CYBMUJFWSA-N 316.338 2.705 5 40 DFBB CCNc1ccc(Cl)cc1NC(=O)c1c([N+](=O)[O-])cnn1C 95995420 UUUXFKQLKWUJTD-UHFFFAOYSA-N 323.740 2.666 5 40 DFBB COc1cc(C(=O)Nc2cnc3ccccc3n2)ccc1[N+](=O)[O-] 79547184 MXNYKOTXDZFKFS-UHFFFAOYSA-N 324.296 2.799 5 40 DFBB O=Cc1ccc(Sc2ncccc2C(=O)O)c([N+](=O)[O-])c1 16386050 UWXGLUNEQPAEAR-UHFFFAOYSA-N 304.283 2.652 5 40 DFBB Cc1cc(OC(=O)c2ccc3ccccc3c2)c([N+](=O)[O-])c(=O)[nH]1 13878776 HHIPKVYUCADGNS-UHFFFAOYSA-N 324.292 2.964 5 40 DFBB Nc1nc(SCc2cc(=O)oc3ccc4ccccc4c23)n[nH]1 3345931 DZMRDZQOCCHICS-UHFFFAOYSA-N 324.365 2.939 5 40 DFBB CCC(CC)NC(=O)CN(CC)Cc1ccccc1[N+](=O)[O-] 40087770 SPKKPQCANSEVLZ-UHFFFAOYSA-N 307.394 2.722 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC(OC[C@@H]3CCCCO3)CC2)cn1 96455878 XMZZXUJULMWCEY-HNNXBMFYSA-N 321.377 2.544 5 40 DFBB O=C(O)/C=C\C(=O)Nc1ccc2c(c1)oc(=O)c1ccccc12 17324526 HHGLRTMNBJCNJN-FPLPWBNLSA-N 309.277 2.526 5 40 DFBB in-vitro Cc1c(CO)cc([N+](=O)[O-])c(N2CCC[C@H](C)CC2)c1[N+](=O)[O-] 63282808 NTQRUIKGNHKGMW-JTQLQIEISA-N 323.349 2.930 5 40 DFBB COc1cccc(NC(=O)CNc2cccc([N+](=O)[O-])c2)c1 8211207 DXAIEPLTYHIDRW-UHFFFAOYSA-N 301.302 2.654 5 40 DFBB N[C@H](Cc1ccccc1)c1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 95534833 PELAPVHVRSZGGE-CQSZACIVSA-N 309.329 2.622 5 40 DFBB CC[C@@](Cl)(C(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)CC 96518429 GVGFNFFJPUZRCT-LBPRGKRZSA-N 319.766 2.557 5 40 DFBB CC[C@H](C)C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 24132038 KVYNXLHNKHIVNX-VIFPVBQESA-N 305.290 2.734 5 40 DFBB O=[N+]([O-])c1cccnc1N(C[C@@H](O)c1ccc(F)cc1)C1CC1 75109722 QSFDXOQJQMOFBT-OAHLLOKOSA-N 317.320 2.831 5 40 DFBB Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)Nc1cccc(F)c1 2795342 YOGSIPJDVDJXDS-SECBINFHSA-N 306.297 2.514 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1F 119955582 IGVFXRWBGFGEQB-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB O=[N+]([O-])c1c(F)cccc1NCc1nncn1-c1ccccc1 91430040 BZZNOTDWCDKVGL-UHFFFAOYSA-N 313.292 2.927 5 40 DFBB COc1ccc(NC(=O)Cc2ccc(F)cc2)cc1[N+](=O)[O-] 75283162 FUXVWEMCBXVQNS-UHFFFAOYSA-N 304.277 2.924 5 40 DFBB CCOC(=O)Cc1csc(Nc2cccc([N+](=O)[O-])c2)n1 223448874 ZIEPJOSRWKBPEZ-UHFFFAOYSA-N 307.331 2.901 5 40 DFBB COc1cccc(C(N)=O)c1OCc1cccc([N+](=O)[O-])c1C 54176536 VALHUTXLLUCGQV-UHFFFAOYSA-N 316.313 2.590 5 40 DFBB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2739976 ODYLVNNFONTPPI-UWVGGRQHSA-N 324.720 2.854 5 40 DFBB O=[N+]([O-])c1ccc(-c2nc(CCN3CCCCCC3)n[nH]2)cc1 62719505 JJRWHEGJJMGOEE-UHFFFAOYSA-N 315.377 2.798 5 40 DFBB CCOc1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 3991802 XCMIDOFYXWXBFO-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ncc([N+](=O)[O-])s1 4535474 PXCPARRRVHBMBK-ZZXKWVIFSA-N 320.286 2.611 5 40 DFBB O=[N+]([O-])c1ccc(N2CC[C@@H](CCO)C2)cc1C(F)(F)F 89769712 SSZZOJJUVHDNQT-VIFPVBQESA-N 304.268 2.822 5 40 DFBB C[C@@H](C(=O)N1c2ccccc2CC[C@H]1C)n1cc([N+](=O)[O-])cn1 180504275 HHZOWXONHLHTEY-NEPJUHHUSA-N 314.345 2.720 5 40 DFBB Cc1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])s1 7192424 KJITZIUXXUXJFC-UHFFFAOYSA-N 324.387 2.794 5 40 DFBB C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](c2ccccc2)O1 58282705 SUBDXADFZYXTFU-FZMZJTMJSA-N 316.313 2.790 5 40 DFBB C[C@H](Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)c1ccc(F)c(F)c1 97238315 WZRBJKCDLPPFMI-SECBINFHSA-N 322.267 2.554 5 40 DFBB O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1F 5514781 ZQHRVDSJYLSUDF-UHFFFAOYSA-N 318.260 2.757 5 40 DFBB CCc1nnc(SCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])o1 20034123 RIXKZRZXUGSXAD-UHFFFAOYSA-N 322.346 2.579 5 40 DFBB Cc1nc(-c2ccc(NC[C@H]3CCCO3)c([N+](=O)[O-])c2)no1 9669032 SIBFYOKHOTWURN-LLVKDONJSA-N 304.306 2.544 5 40 DFBB CC(C)O[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C 95944403 KATSGQSXKOUDBX-UONOGXRCSA-N 306.362 2.917 5 40 DFBB O=[N+]([O-])c1cc(-c2noc(C3CCNCC3)n2)ccc1Cl 199783639 DLDFTJZYMANANW-UHFFFAOYSA-N 308.725 2.765 5 40 DFBB Cc1cc(OC(=O)CCC2CCCCC2)c([N+](=O)[O-])c(=O)[nH]1 4248332 GAAKSIKAPXGRPH-UHFFFAOYSA-N 308.334 2.857 5 40 DFBB CC(=O)c1ccc(N[C@@H]2CCN3CCCC[C@H]23)c([N+](=O)[O-])c1 47272569 IYLJZXLNWPPNOL-HUUCEWRRSA-N 303.362 2.836 5 40 DFBB C[C@@H](C1CC1)N(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 58356240 MYGRWWXBLNUVAW-JTQLQIEISA-N 302.334 2.875 5 40 DFBB Cc1ccc2nsnc2c1NC(=O)c1ccc([N+](=O)[O-])o1 4487023 YHYZFPQZVPTZDN-UHFFFAOYSA-N 304.287 2.753 5 40 DFBB Cc1ccc(-c2csc(N3CCN(C)CC3)n2)cc1[N+](=O)[O-] 7889398 GZMWIMJSADPKBD-UHFFFAOYSA-N 318.402 2.779 5 40 DFBB CCN1CC[C@@H](N(C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C 72305953 DKWVYOHXMYMCEH-GXTWGEPZSA-N 320.393 2.931 5 40 DFBB CC[C@H]1COCCN1C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 96455214 HFQRNGPTQPNQRV-JSGCOSHPSA-N 321.377 2.785 5 40 DFBB CC(C)(O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095536 DWFLQGTYPCMUBV-GFCCVEGCSA-N 312.753 2.624 5 40 DFBB O=[N+]([O-])c1ccn(C[C@H](O)c2ccc(C(F)(F)F)cc2)n1 195545780 YOLJBSSJXLSZSK-JTQLQIEISA-N 301.224 2.544 5 40 DFBB CC1CCC(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 15723681 YEAIHSZXLHPDMM-UHFFFAOYSA-N 320.345 2.675 5 40 DFBB Cc1cccc(NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])c1 3502540 QRDMQUJTUWJGFB-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB O=[N+]([O-])c1c(N2CCc3sccc3C2)nc2ccccn12 58406883 AOUPUWUPXROLOK-UHFFFAOYSA-N 300.343 2.867 5 40 DFBB Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2n1CN1CCCCC1 5337943 GDXDOCSSAWSFNA-UHFFFAOYSA-N 319.321 2.605 5 40 DFBB C[C@H]1CCC[C@@H](C)N1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 6007650 PKJOQFCLAGSZLV-HZSPNIEDSA-N 308.378 2.597 5 40 DFBB CCN(c1cccc(F)c1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 55663177 PSOMDJAZDRDKFN-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB CC(C)CN(CC(C)C)C[C@@H](O)COc1ccc([N+](=O)[O-])cc1 2205601 VVUMJBSALUOGNP-MRXNPFEDSA-N 324.421 2.949 5 40 DFBB Cc1[nH]nc(C(=O)N2CC[C@H](C)C[C@H]2c2ccco2)c1[N+](=O)[O-] 75388521 ITHFAMVPANDFBE-ONGXEEELSA-N 318.333 2.833 5 40 DFBB Cc1ccc(C2=NN[C@H]3CC(C)(C)CC(=O)[C@@H]23)cc1[N+](=O)[O-] 228922846 ZEORXFZIUKHHGJ-FZMZJTMJSA-N 301.346 2.584 5 40 DFBB CS[C@H]1CC[C@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1 96443519 NVQPWSXWWAWYOC-RYUDHWBXSA-N 323.418 2.749 5 40 DFBB COc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1OC 14764330 VXTZMXABRBBPJM-UHFFFAOYSA-N 302.282 2.678 5 40 DFBB biogenic,in-vitro Cc1cc(OCC(=O)n2cnc3ccccc32)ccc1[N+](=O)[O-] 36333 GFCXYUGMIFILKA-UHFFFAOYSA-N 311.297 2.972 5 40 DFBB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1 76089458 UBDWHRPPAKTWTH-MCIONIFRSA-N 319.361 2.920 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(Nc2ccccc2)n1 6350892 YPMVOHBDNAVBDX-VIFPVBQESA-N 302.338 2.921 5 40 DFBB Cc1ccc(N(C(=O)[C@H]2C[C@H]2[N+](=O)[O-])C2CCCCC2)nc1 71888171 BREOTGBDRONABH-UONOGXRCSA-N 303.362 2.721 5 40 DFBB COc1ccccc1CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1 18076762 RZMZRRVEFDATTJ-UHFFFAOYSA-N 316.313 2.581 5 40 DFBB CCc1nc(CC(=O)Nc2ccc(F)cc2[N+](=O)[O-])cs1 78551807 PSVMNMHMIJWXLN-UHFFFAOYSA-N 309.322 2.934 5 40 DFBB C[C@@H](NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 30753848 BOANWHWVAYRMDQ-GFCCVEGCSA-N 320.370 2.775 5 40 DFBB O=C1C(O)=C[C@]2(c3cccc([N+](=O)[O-])c3)Nc3ccccc3N12 13961556 VJXADKDYIADNKQ-INIZCTEOSA-N 309.281 2.662 5 40 DFBB CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccsc1 12348393 SJOBYGKPSFNQQC-CQSZACIVSA-N 319.386 2.689 5 40 DFBB CC[C@H](C)NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2o1 32777303 SGKYUFAFOQOLEN-QMMMGPOBSA-N 309.347 2.743 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(F)c1 3383495 XZUAQWFNLILKFH-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB C[C@H]1CCCN(C(=O)CNc2ccc(Cl)c([N+](=O)[O-])c2)C1 57364155 AGQZBLFFKJWHOP-JTQLQIEISA-N 311.769 2.919 5 40 DFBB COCCCn1ccc(Nc2ncc([N+](=O)[O-])cc2Cl)n1 78334467 JQORHSDWIJGXPS-UHFFFAOYSA-N 311.729 2.620 5 40 DFBB CNc1ccc(C(=O)NCc2ccccc2OC)cc1[N+](=O)[O-] 4895629 KCEILPCEVLOLCH-UHFFFAOYSA-N 315.329 2.575 5 40 DFBB C[N+]1(C[C@H](O)COC23CC4CC(CC(C4)C2)C3)CCCCC1 16975542 TXIYFHSCTIFQAI-NNGLDNROSA-N 308.486 2.963 5 40 DFBB C[C@H]1CC[C@@H](C)N1[C@@H]1CCCN(c2ncccc2[N+](=O)[O-])C1 40554226 UZHQMAOTUMUBRB-HZSPNIEDSA-N 304.394 2.831 5 40 DFBB CCOC(=O)/C=C/c1cc(Br)sc1[N+](=O)[O-] 480981 ARGKUAGXYFSKCF-ONEGZZNKSA-N 306.137 2.995 5 40 DFBB COc1ccc(C)cc1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 1628067 NNSIULUQAQMGLD-UHFFFAOYSA-N 307.327 2.745 5 40 DFBB Nc1ccc(NC(=S)NCCc2ccccc2)cc1[N+](=O)[O-] 6333755 MRMLTDDIRRHLMK-UHFFFAOYSA-N 316.386 2.706 5 40 DFBB CCC1(CO)CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 97095997 RZCJIPYOTQMBMV-UHFFFAOYSA-N 321.377 2.920 5 40 DFBB C[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 223985038 KTWVFEJINCLVJY-GFCCVEGCSA-N 320.370 2.677 5 40 DFBB O=c1ccn(Cc2ncc(-c3cccc(F)c3)o2)cc1[N+](=O)[O-] 96468061 SDYAQLYAQKWDMT-UHFFFAOYSA-N 315.260 2.599 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCCN1CCCCC1 10276837 YTICMQZKMCFXFE-JXMROGBWSA-N 317.389 2.600 5 40 DFBB CCCCC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 48309871 KCGBHGXVPBUEGV-UHFFFAOYSA-N 305.378 2.870 5 40 DFBB Cc1ccn(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c(=O)c1 89737720 ZBGYHSGYBHIFPE-UHFFFAOYSA-N 311.297 2.768 5 40 DFBB O=C([C@H]1CCOC1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 76017940 UGEMDIJZYYLQCA-LBPRGKRZSA-N 304.346 2.907 5 40 DFBB COC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 360768 JPLAKTDANWXSLP-UHFFFAOYSA-N 300.270 2.634 5 40 DFBB CO[C@@]1(C)C[C@H](N(C)c2nc3ccccn3c2[N+](=O)[O-])C1(C)C 76093045 XZTMPNXCENHCTB-ZBEGNZNMSA-N 318.377 2.882 5 40 DFBB CC(=O)N1N=C(c2ccccc2)O[C@@H]1c1ccc([N+](=O)[O-])s1 2497585 UUSQVTZBPLYRHV-CQSZACIVSA-N 317.326 2.895 5 40 DFBB CC(C)OCc1ccccc1CNc1c([N+](=O)[O-])ncn1C 32779313 DUGUAYOGZGAKJI-UHFFFAOYSA-N 304.350 2.865 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)Nc2ccc(F)cc2)c1 22511089 IDXPDEXSHQBBHQ-UHFFFAOYSA-N 310.306 2.676 5 40 DFBB CC(=O)c1ccccc1OCCOc1ccc(C)nc1[N+](=O)[O-] 9378871 PYAAVLGJKSHOCW-UHFFFAOYSA-N 316.313 2.959 5 40 DFBB COc1ccccc1CCCNC(=O)c1ccc([N+](=O)[O-])cc1 217861416 NPCVENOPOZERCH-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB COc1ccc(N[C@H]2OC(=O)c3ccccc32)c([N+](=O)[O-])c1 40476876 ABVRVOKQXIQHBU-AWEZNQCLSA-N 300.270 2.885 5 40 DFBB CCN(Cc1ccc2c(c1)OCCO2)c1ncccc1[N+](=O)[O-] 25072656 LAVTVKQTKRDPGE-UHFFFAOYSA-N 315.329 2.788 5 40 DFBB O=C(c1ccsc1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188573095 RWPJZMSHNJMLQV-UHFFFAOYSA-N 304.327 2.560 5 40 DFBB CC(C)Nc1nc(Cl)nc(Nc2cccc([N+](=O)[O-])c2)n1 199801079 VHQHQAGSAXPUMI-UHFFFAOYSA-N 308.729 2.997 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 5749627 VTAPUJBSGAMKHF-OZVVPTBGSA-N 318.716 2.560 5 40 DFBB C[C@H](CC(=O)c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 79103274 XLINZNRHWBMESR-GFCCVEGCSA-N 312.325 2.986 5 40 DFBB CCOC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4708894 NOQXJHDXJUGTFH-UHFFFAOYSA-N 313.741 2.527 5 40 DFBB CCOC[C@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 72283359 ZACRBCVTGQARRF-AWEZNQCLSA-N 321.377 2.553 5 40 DFBB COc1cc(Cl)ccc1CNc1c([N+](=O)[O-])c(C)nn1C 69872585 GEGDKIBMMSAAGM-UHFFFAOYSA-N 310.741 2.911 5 40 DFBB Cc1cc(C(=O)NCCc2ccccc2O)ccc1[N+](=O)[O-] 47290232 YTSUIVMHINOJDY-UHFFFAOYSA-N 300.314 2.581 5 40 DFBB O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1ccc(F)c(F)c1 95453277 WKGIKPCCZVWDOO-UHFFFAOYSA-N 300.648 2.736 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@H]2Cn2cncn2)c(Cl)c1 95351531 ZKVACMIANOOHNE-NSHDSACASA-N 307.741 2.509 5 40 DFBB CC1(C)C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)O1 187029740 UWGWPILSHXXYRP-UONOGXRCSA-N 308.378 2.564 5 40 DFBB Cc1cc([N+](=O)[O-])nn1C[C@H](C)C(=O)Nc1cc(F)ccc1F 2788364 KVPBJCHRNLHGGU-QMMMGPOBSA-N 324.287 2.653 5 40 DFBB O=[N+]([O-])c1ccc2ncccc2c1I 1296683 ALSKPMNAGFSBIO-UHFFFAOYSA-N 300.055 2.748 5 40 DFBB Cc1c(F)cc(C(=O)Nn2cnc3ccccc32)cc1[N+](=O)[O-] 65520242 APRYGYFDUQBFGC-UHFFFAOYSA-N 314.276 2.776 5 40 DFBB Cc1ccc(C)c(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2O)c1 6623253 ZZAMFTUMTXWSFY-UHFFFAOYSA-N 322.342 2.718 5 40 DFBB O=[N+]([O-])c1cccc(OS(=O)(=O)c2ccc(F)cc2F)c1 16091754 GXHIZRALHQLGRP-UHFFFAOYSA-N 315.253 2.641 5 40 DFBB O=[N+]([O-])c1ccc(Br)cc1[C@H](O)C(F)(F)F 1857793252 YAPTXGJGVFZMQJ-ZETCQYMHSA-N 300.030 2.953 5 40 DFBB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(c1cccc([N+](=O)[O-])c1)C2=O 3111311 YHWAXZOCGIWBAZ-BLLLJJGKSA-N 302.330 2.911 5 40 DFBB CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1nc(C)n[nH]1 75092628 HEYCSWCANWGHTB-LLVKDONJSA-N 323.740 2.556 5 40 DFBB Cc1ccccc1[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16087328 FNIFVHNHAVXMNF-LBPRGKRZSA-N 320.370 2.943 5 40 DFBB O=[N+]([O-])c1ccc(NCc2cccc(Cn3ccnc3)c2)nc1 30587552 IYRBNLXHRRAQPU-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2C[C@H](C)C[C@@H](C)C2)n1 13759513 JFXKQUVPZMIDHL-MXWKQRLJSA-N 322.413 2.660 5 40 DFBB COc1ccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cn1 15616881 XMBOSIHDQAXFMD-UHFFFAOYSA-N 319.342 2.973 5 40 DFBB O=[N+]([O-])c1cn(Cc2nc(-c3ccccc3Cl)no2)cn1 25586542 CTFOWOVQNVNSJJ-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB CCOC(=O)c1cc([N+](=O)[O-])c(N(CC)CC)c([N+](=O)[O-])c1 26508823 AEFDAUXETYTHQS-UHFFFAOYSA-N 311.294 2.526 5 40 DFBB C[C@H](c1nc(Cc2ccc(F)cc2)no1)n1cc([N+](=O)[O-])cn1 97048018 MQGBCULGVLICMW-SECBINFHSA-N 317.280 2.514 5 40 DFBB Cc1cc(C(=O)N2CC(=O)Nc3ccccc32)ccc1[N+](=O)[O-] 36329789 UGBGFFRBMLLRGE-UHFFFAOYSA-N 311.297 2.502 5 40 DFBB Cc1ccccc1C(=O)N1CCN=Cc2cc([N+](=O)[O-])ccc21 73642274 TVHFDZGHDYXLMM-UHFFFAOYSA-N 309.325 2.983 5 40 DFBB CC(C)(C)OC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cn2)CC1 40434883 JVQMZHDBFJVUEO-UHFFFAOYSA-N 323.349 2.768 5 40 DFBB CCO[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C12CCC2 96423440 ATBCIQKYYXHTSK-GJZGRUSLSA-N 318.373 2.601 5 40 DFBB COc1cc(CNc2ncccc2[N+](=O)[O-])cc(OC)c1OC 19875012 GXSBRVZAILMPNP-UHFFFAOYSA-N 319.317 2.628 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)c1cc(=O)c2ccccc2o1 3892318 DHAZHOAXURSYDA-UHFFFAOYSA-N 310.265 2.954 5 40 DFBB Cc1nc([N+](=O)[O-])c(SCc2ccc(O)c([N+](=O)[O-])c2)[nH]1 2236897 KXYCTXGJIAIUDC-UHFFFAOYSA-N 310.291 2.532 5 40 DFBB C[C@H](c1ccc(-n2cncn2)cc1)N(C)c1ccc([N+](=O)[O-])cn1 13012930 BHHNFSLMUFKZPZ-GFCCVEGCSA-N 324.344 2.768 5 40 DFBB O=[N+]([O-])c1ccc(NCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 5589309 NNFUUSKYDGXPSU-UHFFFAOYSA-N 317.257 2.844 5 40 DFBB O=C(Nc1n[nH]c(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 9335780 YZTCMZHMFRSQLU-UHFFFAOYSA-N 309.285 2.632 5 40 DFBB CCn1ccnc1SCC(=O)Nc1cc([N+](=O)[O-])ccc1F 8709966 RXYTUTGDLARINS-UHFFFAOYSA-N 324.337 2.681 5 40 DFBB Cc1nc(N[C@@H](CC(N)=O)C2CCCCC2)ccc1[N+](=O)[O-] 95975500 YHZPSCYQBGXFEV-LBPRGKRZSA-N 306.366 2.534 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1[N+](=O)[O-] 253673 PMIDROXZNFCCLL-NEPJUHHUSA-N 304.302 2.509 5 40 DFBB Cc1nn([C@@H](C)C(=O)N(C)c2ccccc2)c(C)c1[N+](=O)[O-] 3352117 RULFBJYBXWCLLR-LBPRGKRZSA-N 302.334 2.632 5 40 DFBB NC(=O)c1ccc(CN2CCCc3ccccc32)c([N+](=O)[O-])c1 9157503 ZMCZIQRWWNNDST-UHFFFAOYSA-N 311.341 2.647 5 40 DFBB O=C(Nc1ccncc1[N+](=O)[O-])c1ccccc1OC(F)F 67168602 JMAYXVXQZKYOEB-UHFFFAOYSA-N 309.228 2.844 5 40 DFBB O=C(Cc1ccc(Cl)nc1)N1CCc2cc([N+](=O)[O-])ccc21 71894027 DFCZNXCAEWKETC-UHFFFAOYSA-N 317.732 2.775 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)Cc1ccccc1 69622055 WUKCUMVNVAMZCJ-UHFFFAOYSA-N 321.354 2.718 5 40 DFBB O=C(NC1(Cc2ccccc2)CCCC1)c1n[nH]cc1[N+](=O)[O-] 195561620 QJJVSTSLDUUKSQ-UHFFFAOYSA-N 314.345 2.603 5 40 DFBB CC1=C[C@@H]2C[C@H]1[C@@H]1C(=O)N(c3ccc(C)c([N+](=O)[O-])c3)C(=O)[C@@H]21 5684551 VOARIUUNMNTZEJ-DWZYQQQCSA-N 312.325 2.605 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCN([C@@H]3C[C@@H]4CC[C@@H]3C4)CC2)cc1 100802997 PGHIRDZUMYBGEF-JFIYKMOQSA-N 315.417 2.901 5 40 DFBB Cc1csc(-c2cccc(OC(=O)[C@H]3C[C@@H]3[N+](=O)[O-])c2)n1 65491533 SZIYJNCCPQLVIR-RYUDHWBXSA-N 304.327 2.689 5 40 DFBB CN(Cc1c(Cl)nc2sccn12)c1ccc([N+](=O)[O-])cn1 80548055 QYLGLGZMFTXBEE-UHFFFAOYSA-N 323.765 2.989 5 40 DFBB O=C(NCCCOc1ccccc1F)c1ccc([N+](=O)[O-])s1 8777924 XJFPMPJQYUFSON-UHFFFAOYSA-N 324.333 2.994 5 40 DFBB Cc1nn(C)c(NC[C@H](C)c2nc3ccccc3o2)c1[N+](=O)[O-] 96446572 FXIKEMFOOLLGEQ-VIFPVBQESA-N 315.333 2.994 5 40 DFBB O=[N+]([O-])c1cc(Br)cc(OC(F)(F)F)c1O 169800505 QTWVHINETJXMEZ-UHFFFAOYSA-N 302.002 2.962 5 40 DFBB Cc1c(NC(=O)c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] 5921611 KHFHRJHMUDCRSA-UHFFFAOYSA-N 300.270 2.884 5 40 DFBB Cn1cc(/C=C/c2ccncn2)c(-c2ccc([N+](=O)[O-])cc2)n1 157319258 XHTMXABOVOWSJL-GORDUTHDSA-N 307.313 2.956 5 40 DFBB O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CCCCCC2)c([N+](=O)[O-])c1 100029190 RGMJJLJGWUZISJ-UHFFFAOYSA-N 310.266 2.792 5 40 DFBB O=C(NC[C@H]1OCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 3656654 YZQIOABOYQEETF-MRXNPFEDSA-N 312.325 2.639 5 40 DFBB COCCCN1C(=O)S/C(=C/c2ccccc2[N+](=O)[O-])C1=O 409255001 XKVVOQJUKUOPHC-FMIVXFBMSA-N 322.342 2.668 5 40 DFBB Cc1nccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)n1 97047019 JQSVMSCKNUQCOC-UHFFFAOYSA-N 307.693 2.704 5 40 DFBB C[N@+]12CCCC[C@H]1[C@@H](CN1C(=O)c3ccccc3C1=O)CCC2 248088509 UMWVQFMDELFMHV-DAESXHAQSA-N 313.421 2.692 5 40 DFBB biogenic,in-vitro CC(C)(O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 97095535 DWFLQGTYPCMUBV-LBPRGKRZSA-N 312.753 2.624 5 40 DFBB CCOC(=O)c1ccnc(NCc2cccs2)c1[N+](=O)[O-] 96413670 GDJNPOHMCYZAIU-UHFFFAOYSA-N 307.331 2.840 5 40 DFBB O=C(NCCCN1CCCCCC1)c1cccc([N+](=O)[O-])c1 13649498 MFTKZUHXDMNFHI-UHFFFAOYSA-N 305.378 2.591 5 40 DFBB CC(C)[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1nccn1C 32933000 KETKELGKEIMMMJ-CYBMUJFWSA-N 317.349 2.847 5 40 DFBB COc1cc(OCC(=O)Nc2cccc(C)c2)ccc1[N+](=O)[O-] 22259285 QSEBKWGPMOYLRE-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB O=C(OCc1cc2ccccc2[nH]c1=O)c1cccc([N+](=O)[O-])c1 5142410 RODDLKOFQBTBNY-UHFFFAOYSA-N 324.292 2.793 5 40 DFBB C[C@@H]1CCC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1C 5109418 GCXCZOHOPBMYLM-UPJWGTAASA-N 306.362 2.915 5 40 DFBB O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC2(CCC2)C1 97014439 DRNRYAVVXHBBPX-UHFFFAOYSA-N 303.362 2.723 5 40 DFBB Cc1ccc(C(=O)NCCSC(F)(F)F)cc1[N+](=O)[O-] 40118576 VBHJKBGHOAUHSY-UHFFFAOYSA-N 308.281 2.886 5 40 DFBB CCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 14012824 PGDPDEOKCNSZDV-UHFFFAOYSA-N 313.313 2.597 5 40 DFBB Cc1cccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)c1O 292023 WZXUZUZKWHQTHB-UHFFFAOYSA-N 315.281 2.649 5 40 DFBB CCCn1c(CC)nc([N+](=O)[O-])c1S(=O)(=O)c1ccccc1 481353 OOPQTTHZIVMBFO-UHFFFAOYSA-N 323.374 2.597 5 40 DFBB COc1ccccc1OCC(=O)Nc1cc([N+](=O)[O-])ccc1C 559824 DNPHHXDGQPTQDB-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB COc1ccccc1CC(=O)N(C)Cc1cccc([N+](=O)[O-])c1 24947199 ILCQGJOLYWTVKK-UHFFFAOYSA-N 314.341 2.805 5 40 DFBB CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1cccc([N+](=O)[O-])c1)OC2=O 100261002 HFAXFXXFEHQVNB-HZPDHXFCSA-N 318.329 2.655 5 40 DFBB C[C@@H]1C[C@@H](C)n2nccc2N1C(=O)c1ccc(F)cc1[N+](=O)[O-] 97227648 OGKXDPCBZLZPLI-NXEZZACHSA-N 318.308 2.930 5 40 DFBB O=[N+]([O-])c1ccccc1N1CCN[C@@H](c2ccc(F)cc2)C1 35572395 BQKXNYJJHVVFJC-CQSZACIVSA-N 301.321 2.885 5 40 DFBB O=[N+]([O-])c1cccc(-c2n[nH]cc2I)c1 82565101 WZLLHCUKWVJWQE-UHFFFAOYSA-N 315.070 2.590 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@]1(O)CCCC(C)(C)C1 252493970 NHTDSYFCCWCYKV-KRWDZBQOSA-N 320.389 2.964 5 40 DFBB Cn1/c(=N\C(=O)c2cccc([N+](=O)[O-])c2)sc2ccccc21 12512396 NKJHDCOASSDOPW-FOCLMDBBSA-N 313.338 2.889 5 40 DFBB O=C1COc2cc([N+](=O)[O-])ccc2N1Cc1ccc(F)cc1 13534474 HJWRVVVUWJJUDK-UHFFFAOYSA-N 302.261 2.660 5 40 DFBB O=c1[nH]nc2c3cc([N+](=O)[O-])c(Cl)cc3n(C3CC3)cc1-2 100032727 BCRTWCUYNBJLGO-UHFFFAOYSA-N 304.693 2.726 5 40 DFBB COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2)cc1 9482112 DFKUHNYXXNOUCM-UHFFFAOYSA-N 311.297 2.744 5 40 DFBB COc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1C 179643424 IQUHCFLWXCXJBK-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB CCC1(CC)CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 189134792 ROIQBMGSYCFAJS-UHFFFAOYSA-N 308.382 2.761 5 40 DFBB COC(=O)COc1c(Br)cc(Cl)cc1[N+](=O)[O-] 37250540 HHZICMNPDJFIFE-UHFFFAOYSA-N 324.514 2.563 5 40 DFBB CCOc1cccc(NC[C@@](C)(O)CSC)c1[N+](=O)[O-] 96011587 MDQGKNJRWCTNMY-CYBMUJFWSA-N 300.380 2.519 5 40 DFBB CSCCN(C)c1ncc(Br)cc1[N+](=O)[O-] 96474599 ZIZNBQFLOIZHOA-UHFFFAOYSA-N 306.185 2.552 5 40 DFBB COc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] 14258206 JXXXRABKIXFRBY-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=C(Cc1ccc(F)cc1F)Nc1ccc(O)c([N+](=O)[O-])c1 166180024 YJQGVHCESTXJMF-UHFFFAOYSA-N 308.240 2.760 5 40 DFBB COC(=O)c1cc(-n2nc(C)c([N+](=O)[O-])c2C)ccc1Cl 4771057 CMVDDODZMQLRIU-UHFFFAOYSA-N 309.709 2.837 5 40 DFBB CNC(=O)CSc1nc2ccccc2c2nc3ccccc3n12 4246533 CPBRKLFURDMWSO-UHFFFAOYSA-N 322.393 2.874 5 40 DFBB COc1cc(C(=O)O)c(NC(=O)c2ccccc2)cc1[N+](=O)[O-] 68606591 WNIONNIJAPFSJY-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1nc(NC(=O)Cc2cc(F)ccc2F)ccc1[N+](=O)[O-] 89536976 LSCRDEHJQIAJNM-UHFFFAOYSA-N 307.256 2.758 5 40 DFBB CCCCN1C(=O)/C(=C/c2csc([N+](=O)[O-])c2)N=C1S 48639476 KZJPXLCJLNEZLE-UITAMQMPSA-N 311.388 2.925 5 40 DFBB Nc1nc(NC2CCCCC2)nc(N2CCCCC2)c1[N+](=O)[O-] 5031698 PTPGADAAHJLYIQ-UHFFFAOYSA-N 320.397 2.702 5 40 DFBB C[C@@H](CCc1ccccc1)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 5689687 UFWMFKRSERMRSB-LBPRGKRZSA-N 313.357 2.928 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)C1SCSCS1 4392052 ZJXLSIJDVMLEQJ-UHFFFAOYSA-N 302.402 2.988 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H](CC4)[C@H]3C2=O)cc1[N+](=O)[O-] 4697739 FUMNLCOHMGSPJE-HGSJOUDDSA-N 312.325 2.605 5 40 DFBB O=c1oc(-c2ccc(F)cc2)nn1Cc1ccc([N+](=O)[O-])cc1 8727347 MIHQGLKXFIZZKQ-UHFFFAOYSA-N 315.260 2.599 5 40 DFBB Cc1ccc(C(=O)N2CCC[C@]2(C)CCCO)cc1[N+](=O)[O-] 95456612 SQCGWDOXRCNAFD-MRXNPFEDSA-N 306.362 2.670 5 40 DFBB Cc1ccc(C(=O)N(C(C)C)C2CCOCC2)cc1[N+](=O)[O-] 78183065 KTMLLALPSCEJIL-UHFFFAOYSA-N 306.362 2.933 5 40 DFBB Nc1cc2c3cc(N)c(N)cc3c3cc(N)c(N)cc3c2cc1N 1570009217 FXVCQLLAIUUIHJ-UHFFFAOYSA-N 318.384 2.639 5 40 DFBB C[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)NCc1ccccc1 5869675 FXYXOLPAMLVZNP-LBPRGKRZSA-N 300.314 2.679 5 40 DFBB O=[N+]([O-])c1cc(Cl)c(N2CCCC2)cc1N1CCOCC1 10231820 OBEDLGLNKBKSAZ-UHFFFAOYSA-N 311.769 2.685 5 40 DFBB CC(C)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12773887 LHDXFZAJEPAWER-SECBINFHSA-N 305.290 2.905 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCO[C@]2(CCSC2)C1 96481072 JLDKKQAJHWEJPT-SMDDNHRTSA-N 309.391 2.765 5 40 DFBB O=[N+]([O-])c1ccc(Cl)cc1OCCOC[C@H]1CCCO1 76065304 YEGSKYAZRAYHAL-LLVKDONJSA-N 301.726 2.823 5 40 DFBB O=C(Nc1ccc(N2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 24922129 GVJDQEZPHXSUQI-UHFFFAOYSA-N 312.329 2.842 5 40 DFBB CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@H]1C[C@H]1[N+](=O)[O-] 44485655 NUZWTGPEDQCDGA-DLBZAZTESA-N 310.353 2.977 5 40 DFBB Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1[N+](=O)[O-] 5754129 YYXJKQARBSMRFV-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB CSC[C@H](CCO)Nc1ccc([N+](=O)[O-])c2cccnc12 77237010 CGHWAQJWRJWDML-JTQLQIEISA-N 307.375 2.669 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccccc1 485266 VEEXSUQAPJFZGQ-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB CC[C@H]1CCCCN1CCCNC(=O)c1ccc([N+](=O)[O-])cc1 10543016 PJGARXUKAVHRKO-HNNXBMFYSA-N 319.405 2.979 5 40 DFBB COc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2)cc1 6267890 ZZJVMUKIHXMJNN-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB Cc1c(NC(=O)Cc2cn3ccsc3n2)cccc1[N+](=O)[O-] 8281573 RRHAEFUIQTZGAV-UHFFFAOYSA-N 316.342 2.794 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N(Cc1ccco1)C1CC1 32760463 VGFIJULQTYQAIP-UHFFFAOYSA-N 322.342 2.541 5 40 DFBB CC(C)[C@@H](C)NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2o1 32777346 NOXHVMDZNSEDKJ-SECBINFHSA-N 323.374 2.989 5 40 DFBB CCCCC[C@H](C)NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 32808795 JXIONLKPNLMWSE-LBPRGKRZSA-N 314.407 2.983 5 40 DFBB O=C(NCc1ccc(-c2ccc(Cl)cc2)o1)[C@H]1C[C@@H]1[N+](=O)[O-] 32932524 XKRKXCPGEHMFKC-STQMWFEESA-N 320.732 2.881 5 40 DFBB CC(=O)c1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 251109 LJEJLLMAFNUNJG-UHFFFAOYSA-N 310.265 2.598 5 40 DFBB C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc2ccccc2c1 27318905 DXRQAVWCWNJZNF-LBPRGKRZSA-N 324.340 2.822 5 40 DFBB Cc1cc([N+](=O)[O-])nn1CCC(=O)Nc1cccc(Cl)c1 97114098 MVRVCMHPGNWONQ-UHFFFAOYSA-N 308.725 2.782 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1c1nccn1C 95456717 LHXHQZSYOMRXTC-CQSZACIVSA-N 314.345 2.614 5 40 DFBB O=[N+]([O-])c1cccc([C@@H](O)Cn2ccnc2-c2cccnc2)c1 95974672 IPUJQQLHMUMHPY-HNNXBMFYSA-N 310.313 2.587 5 40 DFBB Cc1cc(C)c(OCC(=O)Nc2ccccn2)c([N+](=O)[O-])c1 356511 ILLBOWKEPKMNTF-UHFFFAOYSA-N 301.302 2.624 5 40 DFBB CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC)cc1 4014339 LEYZLWVQBWTPGY-UHFFFAOYSA-N 301.302 2.897 5 40 DFBB Cc1cccc(C(C)C)c1NC(=O)Cn1cnc([N+](=O)[O-])c1 29210131 HUDVIVSAOAKKAT-UHFFFAOYSA-N 302.334 2.862 5 40 DFBB CC[C@@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 9449810 PZRPBRSXGIHHAO-LLVKDONJSA-N 323.280 2.826 5 40 DFBB CC(C)n1nccc1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1O 97114585 HRUTVDPEUQBKNH-UHFFFAOYSA-N 324.724 2.984 5 40 DFBB C[C@H](C[C@@H](O)c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 95412742 BAVFUGIFHPWPSB-MLGOLLRUSA-N 314.341 2.837 5 40 DFBB Cc1sc(C(=O)NC[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] 89536649 ACTPIHIMDSQFRP-GFCCVEGCSA-N 324.333 2.567 5 40 DFBB COc1cc(N[C@@H](C)C(=O)N2CCCC[C@@H]2C)ccc1[N+](=O)[O-] 96429379 SKXDHPKFSAAPPX-RYUDHWBXSA-N 321.377 2.805 5 40 DFBB Cc1ccc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)s1 96495794 VUOUGMZISDCKMS-UHFFFAOYSA-N 303.343 2.558 5 40 DFBB COc1cccc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c1 3017773 GAPCMVNKERAASQ-DHDCSXOGSA-N 324.292 2.948 5 40 DFBB CCOC(=O)N1CCC(Nc2cc(OC)ccc2[N+](=O)[O-])CC1 166539086 BIKOKGDUXJCSDH-UHFFFAOYSA-N 323.349 2.636 5 40 DFBB COC(=O)c1ccc(Cn2nc([N+](=O)[O-])c(Cl)c2C)cc1 502163 XPHOCKAZGMMACH-UHFFFAOYSA-N 309.709 2.588 5 40 DFBB O=C(c1ccccc1)c1cccc(NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])c1 58426268 ZKKOQZSFINPJQN-CABCVRRESA-N 310.309 2.521 5 40 DFBB COc1ccc(NC(=O)c2cccc3cn[nH]c23)cc1[N+](=O)[O-] 97083374 YDZUHWCVMRLRTA-UHFFFAOYSA-N 312.285 2.732 5 40 DFBB COc1ccnc(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)n1 97024677 KXQJMNUEDKHNLS-UHFFFAOYSA-N 308.725 2.683 5 40 DFBB CCOc1cccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c1 96425025 YLGZPTQFPWOSBX-UHFFFAOYSA-N 314.341 2.852 5 40 DFBB CCN(CC)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C1 78934561 PGKPVTLGBAHABR-CQSZACIVSA-N 319.405 2.707 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc(Cl)cc1 3247432 HUAZXUNGQVOFBH-UHFFFAOYSA-N 324.676 2.637 5 40 DFBB Cc1ccc(O[C@H](C(=O)N(C)C)c2ccccc2)c([N+](=O)[O-])n1 6976092 YMVFEPYUXLYQLS-AWEZNQCLSA-N 315.329 2.507 5 40 DFBB CCOc1ccc(C(=O)O[C@@H]2CCCCC2=O)cc1[N+](=O)[O-] 8262425 XRFPFILGJBMJDS-CQSZACIVSA-N 307.302 2.662 5 40 DFBB C[C@@H](OC[C@@H]1CCCCO1)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 71795771 WKERCXADUMPRTR-DOMZBBRYSA-N 322.361 2.532 5 40 DFBB Cc1n[nH]c(C)c1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 84019498 QGNFVVZGMCIMRY-UHFFFAOYSA-N 308.725 2.518 5 40 DFBB Cc1c([C@H](C)NCCNC(=O)C(C)(C)C)cccc1[N+](=O)[O-] 95423446 IJNOAYVDWBQHQT-LBPRGKRZSA-N 307.394 2.716 5 40 DFBB CCn1nc(C)cc1C(=O)OCCc1ccccc1[N+](=O)[O-] 89300378 VKWGUGFZLMRSBG-UHFFFAOYSA-N 303.318 2.519 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@H](C(=O)NC(C)C)C1 75140097 VOKBGCSVUFIDLX-STQMWFEESA-N 320.393 2.794 5 40 DFBB COc1cc(C(=O)N(C)Cc2cccn2C)cc([N+](=O)[O-])c1C 225632555 WYYPVIDQIFKCIC-UHFFFAOYSA-N 317.345 2.523 5 40 DFBB CC(C)[C@H]1OCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1F 96454449 DVPQQIRZGNWUBD-QMTHXVAHSA-N 310.325 2.525 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(F)cc1F 569396 XHGXAAMSYCKPOP-UHFFFAOYSA-N 308.240 2.891 5 40 DFBB O=C(Nc1nc[nH]n1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 23142113 ONKJFNFCGMFJBK-UHFFFAOYSA-N 324.300 2.709 5 40 DFBB CC(C)C(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1Cl 8558165 HCZDBDVDOLTWRY-UHFFFAOYSA-N 301.755 2.717 5 40 DFBB O=C(OC[C@H]1CCCO1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 29866315 JVPSNEBZXGPECW-GFCCVEGCSA-N 306.318 2.505 5 40 DFBB O=C(NC[C@@H]1C[C@H]1c1ccccc1)Nc1ccncc1[N+](=O)[O-] 97080944 IRBGYQGXIVZZPI-STQMWFEESA-N 312.329 2.915 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CCO)c1ccccc1 72294037 PCBLAFDREUQDRI-OAHLLOKOSA-N 315.329 2.840 5 40 DFBB CS[C@@H]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 96409405 WLSKDNDDTYXRHM-TZMCWYRMSA-N 308.403 2.928 5 40 DFBB CC(C)N1CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2C1 24716583 SWMREPNOMVYXJJ-UHFFFAOYSA-N 305.363 2.584 5 40 DFBB biogenic CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12)C(C1CC1)C1CC1 50682048 HCPFMROLYXYFHV-UHFFFAOYSA-N 314.345 2.732 5 40 DFBB O=C(CCn1cc([N+](=O)[O-])cn1)Oc1ccc(F)c(Cl)c1 76020288 GKSMNGQAKPZIGB-UHFFFAOYSA-N 313.672 2.580 5 40 DFBB CCO[C@H](C)c1noc(COc2ccc(C)cc2[N+](=O)[O-])n1 71914711 FHICPTXIIFYVRD-SNVBAGLBSA-N 307.306 2.963 5 40 DFBB O=C(c1cccs1)N1CCN=Cc2cc([N+](=O)[O-])ccc21 73642337 SHYJSWHZQPXNEC-UHFFFAOYSA-N 301.327 2.736 5 40 DFBB COC(=O)c1cc(NCc2c(C)n[nH]c2C)cc(C)c1[N+](=O)[O-] 89587388 PHSQNNWNUOYZOQ-UHFFFAOYSA-N 318.333 2.642 5 40 DFBB O=C1C[C@@H](Cc2ccccc2)C(=O)N1c1ccc([N+](=O)[O-])cc1 100806393 BVYKHIMTIVAVPN-CYBMUJFWSA-N 310.309 2.717 5 40 DFBB C[C@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)O1 40526302 CGRNDXBNBFNEDU-IUCAKERBSA-N 313.741 2.889 5 40 DFBB COC(=O)c1cc(OC)cc([N+](=O)[O-])c1OCc1ccccc1 43827870 DZZQDBQMZRBQIK-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB in-vitro Cc1noc(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 64337356 ZKFVPVSNQQHSBS-UHFFFAOYSA-N 316.239 2.960 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)Cn1ccnc1C(C)C 96001662 GYSDFBLEBPICAU-UHFFFAOYSA-N 302.334 2.862 5 40 DFBB COC(=O)c1cnc(N2CCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 225632105 DGVCYEVMJIVLSU-NSHDSACASA-N 317.301 2.711 5 40 DFBB O=[N+]([O-])c1ccc(OC[C@H](O)COc2ccccc2)c(F)c1 95439059 QJQNAIAKGBKXJD-GFCCVEGCSA-N 307.277 2.553 5 40 DFBB CC(=O)Nc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 3196179 JXJVZXIWMFLHFE-UHFFFAOYSA-N 313.313 2.734 5 40 DFBB Cc1c(NC(=O)CCCNC(=O)C(C)(C)C)cccc1[N+](=O)[O-] 25433548 AOHJWEWICGRFPR-UHFFFAOYSA-N 321.377 2.784 5 40 DFBB C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCc2ccccc21 12638020 WOIDRDRCNDFEIX-LBPRGKRZSA-N 311.341 2.985 5 40 DFBB O=Cc1ccc(Sc2ccc([N+](=O)[O-])cn2)c([N+](=O)[O-])c1 408602147 ATZWLQAMSRDIQC-UHFFFAOYSA-N 305.271 2.862 5 40 DFBB CC[C@H]1CC[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 95459188 OUHRAFJVCABUIK-ONGXEEELSA-N 307.306 2.906 5 40 DFBB Cc1cccc(C(=O)NCCN2CCCCCC2)c1[N+](=O)[O-] 40510057 PBYWSKVDPCTCEU-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccn1 12249815 BUQOJMOBCNVXQB-UHFFFAOYSA-N 314.326 2.841 5 40 DFBB O=C(O)CC12C[C@H]3C[C@H](C1)CC(n1cc([N+](=O)[O-])cn1)(C3)C2 100772604 QRYFBYMRTXTGHG-ASNHAOSHSA-N 305.334 2.562 5 40 DFBB O=[N+]([O-])c1ccccc1N1CCCN(c2nccs2)CC1 58440949 OHXDJPYRYKPUJW-UHFFFAOYSA-N 304.375 2.768 5 40 DFBB CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1nccs1 68451618 OUWKIDTXCKXAAI-UHFFFAOYSA-N 320.374 2.906 5 40 DFBB Cc1nn(CC(=O)N(C)[C@H](C)c2ccccc2)c(C)c1[N+](=O)[O-] 8542194 FBKJMOCACFAGBL-GFCCVEGCSA-N 316.361 2.628 5 40 DFBB O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N1CCC12CCC2 72307418 CTIFHCFDAOIHLA-UHFFFAOYSA-N 316.766 2.565 5 40 DFBB CSc1ccc(OCCn2ccc(=O)c([N+](=O)[O-])c2)cc1 95412976 VVMPFJIFLBKPGE-UHFFFAOYSA-N 306.343 2.557 5 40 DFBB CC(C)(C)OC(=O)N[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1 75606997 OOABVZHLYYFKSP-CYBMUJFWSA-N 321.377 2.694 5 40 DFBB Cc1cnccc1NS(=O)(=O)c1c(C)ccc([N+](=O)[O-])c1C 96433483 RALRUEBRXBFNDA-UHFFFAOYSA-N 321.358 2.716 5 40 DFBB CC(C)c1nnc(NC(=O)COc2ccccc2[N+](=O)[O-])s1 18158114 IRBVLLMADVJVLC-UHFFFAOYSA-N 322.346 2.587 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCCSC(F)(F)F 40539101 GRUHRJUZYMPTLK-UHFFFAOYSA-N 308.281 2.507 5 40 DFBB CC1CCC(N(C)c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 32837536 OJHNEQJDRNQHAJ-UHFFFAOYSA-N 316.361 2.846 5 40 DFBB CCC(C)(C)NC(=O)/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2 44872286 MXTPLINUAMVMCH-AATRIKPKSA-N 320.345 2.779 5 40 DFBB CN(Cc1ccc(F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 8751785 NZZANEXUIDWQOV-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB O=[N+]([O-])c1ccnn1Cc1nnc(-c2ccc(Cl)cc2)o1 89793880 LGEJHXWFVKXVMX-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB CC(C)(C)OC(=O)N[C@@H]1CCN(c2ccccc2[N+](=O)[O-])C1 67800456 ASGSCQCZBVODJB-LLVKDONJSA-N 307.350 2.698 5 40 DFBB Cc1ccc([C@H](N)c2n[nH]c(-c3cccc([N+](=O)[O-])c3)n2)cc1 95534084 FLDLDVPNTHWVSA-AWEZNQCLSA-N 309.329 2.736 5 40 DFBB O=Cc1cn(-c2ccc([N+](=O)[O-])cc2)cc2c(Cl)nnc1-2 256049990 CDZBKYSZZQRMPD-UHFFFAOYSA-N 302.677 2.746 5 40 DFBB O=C1N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 5774184 HJUNBNJOOYKTEE-UVTDQMKNSA-N 309.281 2.692 5 40 DFBB COC(=O)Nc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 52328562 JBPFURNHYWQXPT-UHFFFAOYSA-N 302.290 2.780 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 5324975 ILUFOIMYZCZBLO-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB O=[N+]([O-])c1cc(Cl)ccc1N1CCC(n2cncn2)CC1 78987935 CQAXXNDFXAMHCG-UHFFFAOYSA-N 307.741 2.681 5 40 DFBB CS[C@@H]1CC[C@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1 110646166 NVQPWSXWWAWYOC-NWDGAFQWSA-N 323.418 2.749 5 40 DFBB Cc1cccc(COc2cc(C(=O)O)c(O)c([N+](=O)[O-])c2)c1 216932448 VNPDUBZJIXEXPR-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB Cc1nc(N2CCCN(CC3CCC3)CC2)ccc1[N+](=O)[O-] 521395295 XFDFWTSWFUCRQR-UHFFFAOYSA-N 304.394 2.610 5 40 DFBB CC[C@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 521396433 XAPUTBGLUFIEMU-QMMMGPOBSA-N 315.167 2.815 5 40 DFBB Cc1ccc(CN2CCS[C@@H]3COCC[C@@H]32)cc1[N+](=O)[O-] 91855924 VZKORYQDEILDLM-DZGCQCFKSA-N 308.403 2.610 5 40 DFBB CN1C(=O)C(=O)c2cc3c(c4c2c1cc1ccccc14)OCO3 1632198 RZIGKFTVXWUUCX-UHFFFAOYSA-N 305.289 2.881 5 40 DFBB endogenous,in-man CCc1ccc(NC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)cc1[N+](=O)[O-] 110680963 OYHLJJVBEQLGMZ-MBNYWOFBSA-N 305.334 2.599 5 40 DFBB Cc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c([N+](=O)[O-])c1 13467737 UEXKHZZFXLMYOJ-QWRGUYRKSA-N 304.302 2.509 5 40 DFBB O=C(C1CCCCC1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 71911487 VCHZYNLDPJMSLT-ZDUSSCGKSA-N 318.377 2.583 5 40 DFBB O=[N+]([O-])c1cnn(Cc2cn3cc(Cl)cc(Cl)c3n2)c1 72291227 GUFYVADJPFDOGU-UHFFFAOYSA-N 312.116 2.794 5 40 DFBB O=[N+]([O-])c1ccc(/C=C2/CCc3cnc4scn[n+]4c32)cc1 35362143 STTRYXWNFBWLAE-XFFZJAGNSA-N 311.346 2.672 5 40 DFBB Cc1nn(C)c(N[C@H]2CCO[C@@H]2c2ccccc2)c1[N+](=O)[O-] 96447436 HNPISTYTXTYEAO-GXTWGEPZSA-N 302.334 2.579 5 40 DFBB Cc1sc(C(=O)N[C@H](C)C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] 95445497 GACLRBMRUHDOOF-LDYMZIIASA-N 324.358 2.800 5 40 DFBB CC(C)OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 5607228 JJGYOIJIBSIUDQ-UHFFFAOYSA-N 306.240 2.977 5 40 DFBB O=[N+]([O-])c1ccc(CS(=O)(=O)NCCC2=CCCCC2)cc1 32804240 UJLOSGGZPURMEH-UHFFFAOYSA-N 324.402 2.905 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1Br)C(F)(F)F 4040783 SOSOLXKUOMUSHB-UHFFFAOYSA-N 313.029 2.858 5 40 DFBB biogenic NC(=O)c1ccc(NCc2cccc(Cl)c2)c([N+](=O)[O-])c1 5687574 STNJKBRUSVQCDT-UHFFFAOYSA-N 305.721 2.959 5 40 DFBB CN(C)C1(CNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCCC1 47388253 WBUAZOPIIPINAI-CMDGGOBGSA-N 317.389 2.599 5 40 DFBB C[C@H]1CN(c2cccc(Br)c2[N+](=O)[O-])CCCO1 521394488 VXXJNAREXONZNW-VIFPVBQESA-N 315.167 2.973 5 40 DFBB CCOc1ncccc1C(=O)OCc1ccc([N+](=O)[O-])cc1 2658530 RCPBONUENYXCQN-UHFFFAOYSA-N 302.286 2.746 5 40 DFBB O=C(COC(=O)c1ccccc1F)Nc1cccc([N+](=O)[O-])c1 3394592 QWARKYNEPQXHSA-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)NCc1cccc(Cl)c1 8211587 XEMHQMDFBOBBEI-UHFFFAOYSA-N 319.748 2.977 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]2C1=O)C31CC1 3661533 XTOIUIXMPLPZLM-CUFDPUGPSA-N 324.336 2.605 5 40 DFBB CNc1ccc(CN2CCO[C@H](c3ccco3)C2)cc1[N+](=O)[O-] 93841461 DMLWIPQNOZRYDO-INIZCTEOSA-N 317.345 2.803 5 40 DFBB COc1ccc([C@@H](CO)N(C)Cc2csc([N+](=O)[O-])c2)cc1 71904360 XDPSWKSDAPNCKA-CQSZACIVSA-N 322.386 2.830 5 40 DFBB CC[S@](=O)[C@@H]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2C)C1 267409413 RKACEZLURLGEQM-SMSPXONGSA-N 311.407 2.790 5 40 DFBB O=[N+]([O-])c1ccc(NS(=O)(=O)Cc2ccccc2F)cc1 35587989 ZRPLRIRQCLLRLQ-UHFFFAOYSA-N 310.306 2.676 5 40 DFBB O=C(O)C[C@H](NC(=O)c1cccs1)c1cccc([N+](=O)[O-])c1 4581132 UTZPECYTFKUDQW-NSHDSACASA-N 320.326 2.602 5 40 DFBB CCCCC(=O)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 8902426 ZAKOPFLXMVEASS-UHFFFAOYSA-N 307.350 2.560 5 40 DFBB C[C@H]1Cc2ccccc2N1C(=O)COc1ccccc1[N+](=O)[O-] 5109410 FVUXZLFEACEBHL-LBPRGKRZSA-N 312.325 2.951 5 40 DFBB COc1ccc(C(=O)OCc2c(C)noc2C)cc1[N+](=O)[O-] 4846308 PRYZMQZPLWKPRO-UHFFFAOYSA-N 306.274 2.565 5 40 DFBB CCOc1cccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c1 20482279 PAPXTLHOXUZNHY-UHFFFAOYSA-N 314.341 2.852 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nccn1Cc1ccccn1 72281934 FJHGWSQCSYHEIB-UHFFFAOYSA-N 313.342 2.781 5 40 DFBB Cc1c(C(=O)N(C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)cccc1[N+](=O)[O-] 96418847 XKBMCULFPFPLRP-CFVMTHIKSA-N 318.373 2.789 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N(C)Cc1ccc([S@@](C)=O)cc1 96453904 NMKVZBVFDZYHFW-QFIPXVFZSA-N 319.386 2.672 5 40 DFBB C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@@H](O)Cc1ccccc1 96483232 LZFXIMYMYDEEBJ-GUYCJALGSA-N 300.358 2.677 5 40 DFBB COc1ccc(N[C@@H]2OC(=O)c3ccccc32)c([N+](=O)[O-])c1 40476878 ABVRVOKQXIQHBU-CQSZACIVSA-N 300.270 2.885 5 40 DFBB C[C@@H]1CCCC[C@H]1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 12739513 VOBDOXZUMVOMEG-IUODEOHRSA-N 320.393 2.885 5 40 DFBB O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)Cc1c-2cccc1[N+](=O)[O-] 100020434 GVGDVMGGDZKLNL-UHFFFAOYSA-N 301.214 2.982 5 40 DFBB Cc1cc(O)ccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5697830 SPADKCRIBIVTLJ-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB C[C@@H]1CCCCN1c1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 26508780 FLHJAAVNTLOAEJ-MRVPVSSYSA-N 309.278 2.580 5 40 DFBB CCOC(=O)C1=C(C)O[C@H]([N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 100783341 YTFFDIORXYPXAC-STQMWFEESA-N 311.721 2.894 5 40 DFBB Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 18832016 UNKFCDNHIXTSRA-UHFFFAOYSA-N 315.285 2.741 5 40 DFBB O=C(NCCCn1cnc2ccccc21)c1ccccc1[N+](=O)[O-] 12490052 ORDLBXBNXYDCRU-UHFFFAOYSA-N 324.340 2.765 5 40 DFBB CC(=O)Nc1cc(N(C)Cc2cccnc2)c(F)cc1[N+](=O)[O-] 12539056 ZDZOOLPPUVSVEE-UHFFFAOYSA-N 318.308 2.724 5 40 DFBB COc1cc(OCC(=O)Nc2ccc(C)cc2)ccc1[N+](=O)[O-] 22259289 HBGWRJXGHNQOTL-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB CCn1c(Cn2nc(C)c([N+](=O)[O-])c2C)nc2cc(F)ccc21 66256101 NMIRHMDRSPOKDD-UHFFFAOYSA-N 317.324 2.965 5 40 DFBB O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@@H]1c1ccco1 97080971 BEDOHSPCULMSLH-LLVKDONJSA-N 302.290 2.952 5 40 DFBB Cc1cc(C)cc([C@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)c1 97108016 HQVIXLRWAGDYMX-LBPRGKRZSA-N 314.345 2.564 5 40 DFBB C[N@+]12CCCC[C@@H]1[C@H](COC(=O)c1ccccc1O)CCC2 247695430 ZOEVRBRMARFYMK-ZSZQSSIHSA-O 304.410 2.958 5 40 DFBB biogenic,in-vitro O=C(COC(=O)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 267450 KUBXLUDLNSCQQP-UHFFFAOYSA-N 303.245 2.774 5 40 DFBB CC(=O)c1c(C)[nH]c(C(=O)NCc2ccccc2[N+](=O)[O-])c1C 46146879 JISKICMILUDXJQ-UHFFFAOYSA-N 315.329 2.672 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1ccccc1C 7952654 KTGJSJHSHPDZPT-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CCN(c2ccccc2O)CC1 9515336 RRMJNLGWWDGEGW-UHFFFAOYSA-N 317.320 2.766 5 40 DFBB CCc1ccc(OCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 223372975 VKKAOZKOJDOHKX-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB Cc1[nH]c(N)nc(=S)c1CCCOc1ccc([N+](=O)[O-])cc1 1748687 OTVNCYIUZXRITK-UHFFFAOYSA-N 320.374 2.950 5 40 DFBB C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3232956 UTXNEUJORJRSRZ-VXGBXAGGSA-N 320.345 2.541 5 40 DFBB Cc1ccccc1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 30868538 WNIJVJJIAIEZDA-UHFFFAOYSA-N 320.370 2.523 5 40 DFBB Cc1ccc(NC(=O)NC[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] 69369227 YXQQSMMFUDMKKK-OAHLLOKOSA-N 315.329 2.758 5 40 DFBB CC(C)c1nc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)cs1 71880003 WMKHAIJFBUBDAP-UHFFFAOYSA-N 321.358 2.810 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCO[C@H](c3cccc(F)c3)C2)o1 92975491 XAGFTGMDVWTAFW-AWEZNQCLSA-N 306.293 2.900 5 40 DFBB N[C@H](c1ccc(F)cc1)c1nc(-c2ccccc2[N+](=O)[O-])n[nH]1 95533256 PBPHUUGBZHVFIM-CYBMUJFWSA-N 313.292 2.567 5 40 DFBB O=C(CC1CCOCC1)N1CCCc2c1cccc2[N+](=O)[O-] 95973900 FWDRCPRFPLHLFZ-UHFFFAOYSA-N 304.346 2.691 5 40 DFBB NC1=NN(c2ccc([N+](=O)[O-])cc2)[C@H](c2ccc(F)cc2)C1 222548542 JTPZZJWNUHVCRW-AWEZNQCLSA-N 300.293 2.958 5 40 DFBB CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 25093505 SNUSMPYCSYOEEX-CHWSQXEVSA-N 308.382 2.512 5 40 DFBB O=[N+]([O-])c1ccc(N2CCO[C@@H](c3ccc(F)cc3)C2)nc1 29528175 APKVWZGRBCTVFG-CQSZACIVSA-N 303.293 2.707 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC2CCC(C)(C)CC2)c1 95997527 WNYQXZDYIGXFBB-UHFFFAOYSA-N 322.361 2.760 5 40 DFBB CC(C)N1C(=O)S/C(=C\Nc2cccc([N+](=O)[O-])c2)C1=O 36636171 CZAUELZQIJDWRO-XFFZJAGNSA-N 307.331 2.952 5 40 DFBB C[C@@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1cccs1 97236998 QNIUBBSMFJQFKT-VIFPVBQESA-N 306.343 2.895 5 40 DFBB CCS[C@H]1CCC[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 96450515 LTTSQBUCCBYJIJ-KGLIPLIRSA-N 308.403 2.928 5 40 DFBB O=[N+]([O-])c1cc2[nH]c(O)nc2c([N+](=O)[O-])c1NC1CCCCC1 4859512 INCPEABZYORWJK-UHFFFAOYSA-N 321.293 2.830 5 40 DFBB Cc1ccc(NC(=O)[C@H](C)Cn2cc([N+](=O)[O-])cn2)cc1F 6923957 NMBVSLJVYWNMNQ-SNVBAGLBSA-N 306.297 2.514 5 40 DFBB C[C@@H](CNc1ccc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 26729879 DHGDBKJWMWUBTC-ZDUSSCGKSA-N 312.373 2.849 5 40 DFBB C[C@@H](Oc1cccnc1[N+](=O)[O-])c1nc(-c2ccco2)no1 29739017 SYOMPMBGXOMVHC-MRVPVSSYSA-N 302.246 2.773 5 40 DFBB Cc1ccc(N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CCCCC2)nc1 71888170 BREOTGBDRONABH-ZIAGYGMSSA-N 303.362 2.721 5 40 DFBB COC(=O)c1ccc(OCC(F)(F)C(F)F)c([N+](=O)[O-])c1 71905472 HJECITKDYBZPBB-UHFFFAOYSA-N 311.187 2.661 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@H]1c1nc2ccccc2[nH]1 79097783 UUSNQFMBLPPZKX-LBPRGKRZSA-N 312.333 2.546 5 40 DFBB C[C@@H]1c2cc(F)ccc2CCN1CCn1cc([N+](=O)[O-])cn1 89941493 QDRQLTCEVXHFRH-LLVKDONJSA-N 304.325 2.550 5 40 DFBB C[C@@H]1CN(c2ncc(Br)cc2[N+](=O)[O-])CCS1 95966490 UWBUORBWDUYHTO-SSDOTTSWSA-N 318.196 2.694 5 40 DFBB O=C(Nc1nnc(C(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1 3016637 VCMCIZDYZMLCSH-UHFFFAOYSA-N 318.236 2.717 5 40 DFBB CCOc1ccc(-c2ccc(/C=C\C(N)=O)o2)c([N+](=O)[O-])c1 408717965 ZVOPFWKZXTVRDB-YVMONPNESA-N 302.286 2.752 5 40 DFBB COc1cccc(OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 40946469 QQOAQLYYIUOZSI-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB COc1ccc2nc(SCc3ncc([N+](=O)[O-])n3C)[nH]c2c1 97103002 DAHKNGMTLSTPII-UHFFFAOYSA-N 319.346 2.506 5 40 DFBB O=C(c1cccnc1)N1C(=O)c2cccc3c([N+](=O)[O-])ccc1c23 11691543 UUHLPBMLBLSJRU-UHFFFAOYSA-N 319.276 2.944 5 40 DFBB CC1(C)CC(=O)c2c(-c3cccc([N+](=O)[O-])c3)nc(=O)[nH]c2C1 28293997 LAIOTOMOSGDKMV-UHFFFAOYSA-N 313.313 2.500 5 40 DFBB COc1ccc(O)c(C(=O)OCc2cccc([N+](=O)[O-])c2)c1 25033276 AGSQTNWMVPMNSE-UHFFFAOYSA-N 303.270 2.666 5 40 DFBB O=[N+]([O-])c1c(NC[C@H](O)c2ccccc2F)nc2ccccn12 58244495 UJUICNGJFIMQPS-LBPRGKRZSA-N 316.292 2.527 5 40 DFBB COc1ccc(C(C)=O)cc1Cn1nc(C)c([N+](=O)[O-])c1C 3443892 VPRNGAUQXHONTD-UHFFFAOYSA-N 303.318 2.668 5 40 DFBB O=C(c1ccsc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 9364083 RWHARKZTYSSBKR-UHFFFAOYSA-N 317.370 2.619 5 40 DFBB O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1ccc([N+](=O)[O-])o1 9548678 ARFHRJBYERZTKF-UHFFFAOYSA-N 312.184 2.762 5 40 DFBB Cc1ccc([N+](=O)[O-])c(OCC(=O)NCc2ccccc2)c1 21614195 LAJDBOKLDXBJCB-UHFFFAOYSA-N 300.314 2.598 5 40 DFBB CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@H]1C[C@@H]1[N+](=O)[O-] 44485653 NUZWTGPEDQCDGA-IRXDYDNUSA-N 310.353 2.977 5 40 DFBB CCOC(=O)C1CCN(c2cc(C)c(F)cc2[N+](=O)[O-])CC1 63110909 VZDPIFQWHCRAMX-UHFFFAOYSA-N 310.325 2.822 5 40 DFBB CC[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc([N+](=O)[O-])c1 110665618 WJLBFADXPRTZLG-APIJFGDWSA-N 304.346 2.730 5 40 DFBB CCn1c(CNC(=O)c2ccc([N+](=O)[O-])cc2)nc2ccccc21 58305349 QNEUTQMRHGCLQV-UHFFFAOYSA-N 324.340 2.894 5 40 DFBB Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC(C2CC2)C2CC2)c1C 24475313 IDNADLPOFHLHIC-UHFFFAOYSA-N 324.402 2.679 5 40 DFBB Cc1ccc([C@@H](C)OC(=O)c2ccn(C)c(=O)c2)cc1[N+](=O)[O-] 79057072 YEVSDNOJSPAGSJ-LLVKDONJSA-N 316.313 2.520 5 40 DFBB Cc1cc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c([N+](=O)[O-])cc1C 100237431 TUQAATQHHZTGNV-LWWSYDQCSA-N 312.325 2.523 5 40 DFBB Cc1cn2c(CC(=O)Nc3cccc([N+](=O)[O-])c3)csc2n1 25050521 DZSHWKWQIHIFFQ-UHFFFAOYSA-N 316.342 2.794 5 40 DFBB CCNc1c([N+](=O)[O-])/c(=N\C(=O)c2ccccc2)sn1CC 104231926 IIHYMUICXXVKLZ-JQIJEIRASA-N 320.374 2.651 5 40 DFBB O=C(Nc1ccccc1)[C@H]1CCCN1c1ccc([N+](=O)[O-])cn1 12984365 IJPUWNDPOMHSEB-CQSZACIVSA-N 312.329 2.597 5 40 DFBB CCN(CC)c1nc(N)c([N+](=O)[O-])c(NC2CCCCC2)n1 4306009 JASHSHHNIYDUIT-UHFFFAOYSA-N 308.386 2.558 5 40 DFBB O=[N+]([O-])c1cnc(N2CCC[C@H]3CCC[C@@H]32)nc1NC1CC1 72302138 YNJYFUXYEHPFQG-PWSUYJOCSA-N 303.366 2.728 5 40 DFBB Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C(=O)O)c1 409378445 PGMIOMDUYPYJBQ-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB CCn1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 96483239 CVPREVGCPNQYMX-UHFFFAOYSA-N 314.345 2.616 5 40 DFBB O=[N+]([O-])c1cnn(C[C@@H](O)CSc2ccc(Cl)cc2)c1 76082240 AMQWWVACQLXLMZ-LLVKDONJSA-N 313.766 2.598 5 40 DFBB COc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 2779998 IXGWMTURAIRTMW-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB COc1ccc(OC)c(Nc2ccc3nonc3c2[N+](=O)[O-])c1 4537873 DIFMUUOHAMESNA-UHFFFAOYSA-N 316.273 2.892 5 40 DFBB Cc1c([N+](=O)[O-])cc(C(=O)Nc2nccs2)cc1[N+](=O)[O-] 4838573 QRCRDXIPJPMLSU-UHFFFAOYSA-N 308.275 2.520 5 40 DFBB O=C1Nc2ccccc2[C@]12CCN[C@H]2c1ccc([N+](=O)[O-])cc1 61719464 UCBLNISWHNMWHE-RDJZCZTQSA-N 309.325 2.519 5 40 DFBB Cn1c(Sc2ccc([N+](=O)[O-])cc2)nc2ccccc2c1=O 59474504 BOULXOVNBUXVOH-UHFFFAOYSA-N 313.338 2.993 5 40 DFBB CC(C)(C)OC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1795153 WGQLZABFSAOCJU-UHFFFAOYSA-N 314.319 2.937 5 40 DFBB CC(C)N(C)CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1 58130001 PPGUEWVGZTTWBR-UHFFFAOYSA-N 308.382 2.837 5 40 DFBB COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccccc1C 55546868 MDLRQPWLTMYDGD-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccs1 8562457 OGBLEHDOFXIJAO-SNVBAGLBSA-N 306.343 2.740 5 40 DFBB CCN(C[C@H]1CCOC1)C(=O)c1cc(F)cc(C)c1[N+](=O)[O-] 96466607 BWSCSMMSJZIFEA-LLVKDONJSA-N 310.325 2.541 5 40 DFBB COc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 3148182 PXGCNMLAPXMTBS-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB CCCCCc1ccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 48244933 ZJESXJMTGKBSRT-UHFFFAOYSA-N 317.349 2.558 5 40 DFBB COCCOc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1 14658510 FWLNNFFSCDCZGC-UHFFFAOYSA-N 316.313 2.872 5 40 DFBB COC(=O)c1cc(=O)n2c(nc3cccc4cccc2c43)s1 1576717 GPYVBMVHRXPIAF-UHFFFAOYSA-N 310.334 2.849 5 40 DFBB O=C(Nc1nccc(-c2ccco2)n1)c1cccc([N+](=O)[O-])c1 2791734 BZNJRWOATBBXQD-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB C[C@H](Nc1ncccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 22813256 LNYVPICEMANMSY-NSHDSACASA-N 310.317 2.744 5 40 DFBB O=C(OCc1nccs1)c1cc2cccc([N+](=O)[O-])c2[nH]1 56242474 RXDCGEOWJXKGHU-UHFFFAOYSA-N 303.299 2.890 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](CCC(N)=O)C1 97233698 QSEVNJDWCBMFIJ-UONOGXRCSA-N 319.405 2.942 5 40 DFBB Cc1sc(C(=O)N[C@@H](C)C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] 95445496 GACLRBMRUHDOOF-GZMMTYOYSA-N 324.358 2.800 5 40 DFBB CC(=O)c1ccccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 223990 BNHMEMWKGXIWGO-UHFFFAOYSA-N 310.265 2.598 5 40 DFBB Cc1ccc([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 13938137 CRFIRMGKNJFNDJ-LBPRGKRZSA-N 320.370 2.943 5 40 DFBB COc1ccc([C@H](CNc2ncccc2[N+](=O)[O-])N(C)C)cc1 21363912 UYIOCALDCVGACH-HNNXBMFYSA-N 316.361 2.713 5 40 DFBB CN(Cc1ccccc1F)S(=O)(=O)c1ccccc1[N+](=O)[O-] 36811987 YNKGNPDXINZWPX-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1NC[C@H]([C@H]1CCOC1)N1CCCC1 44976811 APHADQOHQAZUCW-BLLLJJGKSA-N 323.368 2.647 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccncc1Cl 95405194 UOPRRZHOTACNJF-UHFFFAOYSA-N 321.720 2.582 5 40 DFBB CC[C@@](Cl)(C(=O)c1cccc([N+](=O)[O-])c1)S(=O)(=O)CC 96518435 RAWGNMBWYJVWNC-LBPRGKRZSA-N 319.766 2.557 5 40 DFBB CCO[C@@H](C)C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 97378927 RCCXCMMQJZJONO-JTQLQIEISA-N 303.318 2.815 5 40 DFBB CN(C)Cc1ccccc1NC(=O)Cc1ccccc1[N+](=O)[O-] 24810085 YLPBPGVHZXQVAF-UHFFFAOYSA-N 313.357 2.838 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1C[C@@H]1CC1(Cl)Cl 28005524 FLJBDJKLBFBNRH-LURJTMIESA-N 303.101 2.697 5 40 DFBB Cc1ccc2nc(CNc3cccc([N+](=O)[O-])c3)cc(=O)n2c1 15288916 BJYXZEQPHGADOS-UHFFFAOYSA-N 310.313 2.523 5 40 DFBB CNC(=O)c1ccc(Sc2ccc(O)cc2)c([N+](=O)[O-])c1 69738681 YEVNZLQEXVHWLO-UHFFFAOYSA-N 304.327 2.811 5 40 DFBB O=C(O[C@H]1C[C@H]2CC[C@@H]1C2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1767595 WGQVYOZJPJVTHR-RWEMILLDSA-N 306.274 2.848 5 40 DFBB CCOC(=O)/C=C/c1ccc(/C=C/C(=O)OCC)c([N+](=O)[O-])c1 3845221 ZEZGLLAZELQSJI-OAMUUVBCSA-N 319.313 2.747 5 40 DFBB COc1ccccc1OCC(=O)OCc1ccccc1[N+](=O)[O-] 25113210 ZDKXOERTRMESEF-UHFFFAOYSA-N 317.297 2.726 5 40 DFBB O=C(COc1ccccc1Cl)Nc1ccc([N+](=O)[O-])cn1 7447815 AUWFYNUNGMTDHR-UHFFFAOYSA-N 307.693 2.661 5 40 DFBB O=C(Nc1cc2ncccc2c2cccnc12)N1CCOCC1 408978370 YZQFKZYPYNJPPT-UHFFFAOYSA-N 308.341 2.647 5 40 DFBB CS[C@H]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 96409406 WLSKDNDDTYXRHM-OCCSQVGLSA-N 308.403 2.928 5 40 DFBB Cc1sc(C(=O)Nn2cnc3ccccc32)cc1[N+](=O)[O-] 24448840 SPCCQDKESFGVOC-UHFFFAOYSA-N 302.315 2.698 5 40 DFBB Cc1cccc(OCCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 18147374 AJZBLAYDZHJCFL-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB CCOC(=O)/C=C/c1ccc(Br)c([N+](=O)[O-])c1 137357699 WTNMKSSCUKCGFQ-GQCTYLIASA-N 300.108 2.934 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@@H](C)C2)n1 13759510 JFXKQUVPZMIDHL-AXFHLTTASA-N 322.413 2.660 5 40 DFBB CCC[C@@H]1C[C@@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 75373719 JDQUKFHBYWOWNB-ABAIWWIYSA-N 314.345 2.699 5 40 DFBB CO[C@H](C)c1nsc(NCCNc2ccc([N+](=O)[O-])cc2)n1 252500337 SSNCJUUFEGYTOL-SECBINFHSA-N 323.378 2.678 5 40 DFBB O=C(NC[C@@H]1OCCc2ccccc21)c1cccc([N+](=O)[O-])c1 181786 BGJXJZKBQSXJQJ-INIZCTEOSA-N 312.325 2.639 5 40 DFBB CNc1nn(C(=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 5209337 MAFHFOVBMQWBLZ-UHFFFAOYSA-N 314.223 2.540 5 40 DFBB COc1ccc([C@H](CO)N(C)Cc2ccccc2[N+](=O)[O-])cc1 71904389 NCENIHRMBYYRPJ-KRWDZBQOSA-N 316.357 2.769 5 40 DFBB COC1(C)CN(c2ccc(Br)cc2[N+](=O)[O-])C1 95980896 UYLJXCDXQOAKCL-UHFFFAOYSA-N 301.140 2.582 5 40 DFBB CS[C@H]1CCCC[C@@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96417109 KRGAYQUBBLKZMX-AAEUAGOBSA-N 309.391 2.581 5 40 DFBB CC(C)O[C@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1(C)C 95944392 LPHHUWIWQRLEJS-GJZGRUSLSA-N 320.389 2.846 5 40 DFBB CC(C)(C)OC(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 40071624 OSBBJANOWKTXHN-UHFFFAOYSA-N 321.377 2.648 5 40 DFBB COc1ccccc1NC(=O)[C@H](C)n1nc(C)c([N+](=O)[O-])c1C 341130 ZRRFHYWAKSQKQV-NSHDSACASA-N 318.333 2.616 5 40 DFBB Cc1ccnc(NC(=O)COc2c(C)cc(C)cc2[N+](=O)[O-])c1 356514 ALPLAZYRLWZUDB-UHFFFAOYSA-N 315.329 2.933 5 40 DFBB CNC(=O)c1cccc(NCc2ccc(Cl)c([N+](=O)[O-])c2)n1 97105605 MESKYRMPKZQNLQ-UHFFFAOYSA-N 320.736 2.615 5 40 DFBB CN(C)[C@H](CNc1ccc([N+](=O)[O-])cn1)c1cccc(F)c1 25371209 NSEJIQXXVPEWBY-CQSZACIVSA-N 304.325 2.844 5 40 DFBB 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CCc1ccc(Oc2cc(CC)nc3ncnn23)c([N+](=O)[O-])c1 75139776 FXDWMXPZKRCGSK-UHFFFAOYSA-N 313.317 2.950 5 40 DFBB Cc1ccc(CNC(=O)CCOc2ccc([N+](=O)[O-])cc2)cc1 31491480 GMMPZKQVTYBEAB-UHFFFAOYSA-N 314.341 2.989 5 40 DFBB CCN(C[C@@H]1CCOC1)C(=O)c1cc(F)cc(C)c1[N+](=O)[O-] 96466605 BWSCSMMSJZIFEA-NSHDSACASA-N 310.325 2.541 5 40 DFBB O=[N+]([O-])c1cccc(CN2CCN(c3ccccc3O)CC2)c1 57833911 PHUZXPARWBLIRD-UHFFFAOYSA-N 313.357 2.623 5 40 DFBB O=[N+]([O-])c1ccc(CCN2CCC(Cn3cccn3)CC2)cc1 105887091 MDKSKGWVRMEXNK-UHFFFAOYSA-N 314.389 2.746 5 40 DFBB Cn1cc([N+](=O)[O-])c(C(=O)NC2CCC(C(C)(C)C)CC2)n1 2781263 QFAMAPYRVQGWAX-UHFFFAOYSA-N 308.382 2.663 5 40 DFBB C[C@H](c1ccccc1)N(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 3151079 KEFUUQKRELHEPX-GFCCVEGCSA-N 320.370 2.977 5 40 DFBB O=C(NCCCOc1ccccc1F)c1ccc([N+](=O)[O-])cc1 8777922 SXSXAPGWTUIOLR-UHFFFAOYSA-N 318.304 2.933 5 40 DFBB O=C(NC[C@H](O)c1ccccc1F)Nc1cccc([N+](=O)[O-])c1 27350916 FSAGMWNEKCGKIK-AWEZNQCLSA-N 319.292 2.589 5 40 DFBB CCOC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(CC)n[nH]1 70462424 ONUATEQSKHCWAP-UHFFFAOYSA-N 322.346 2.603 5 40 DFBB CCN1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 12398531 MHAAWYKYOKGZOV-UHFFFAOYSA-N 303.284 2.756 5 40 DFBB C[C@H]1CCCC[C@H]1Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 6250580 SIKWGBPEFHHJMJ-CMPLNLGQSA-N 312.391 2.989 5 40 DFBB O=C(NCCc1ccsc1)c1cc(F)c(F)cc1[N+](=O)[O-] 50037882 GVPWZKGWMNZSAF-UHFFFAOYSA-N 312.297 2.907 5 40 DFBB Cc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 3012556 ODGFZHWFCIVKIU-UHFFFAOYSA-N 322.298 2.644 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1COc2ccccc2O1 5009665 YJJGIJRGIQKMNJ-HNNXBMFYSA-N 314.297 2.682 5 40 DFBB O=C1CCCN1C[C@@H]1CCCCN1Cc1ccc([N+](=O)[O-])cc1 69894338 GRYWHHXYZXMTSS-INIZCTEOSA-N 317.389 2.572 5 40 DFBB COc1ccc(CN(CCO)c2ccccc2)cc1[N+](=O)[O-] 85822872 OBFHIMGEPVAFSS-UHFFFAOYSA-N 302.330 2.602 5 40 DFBB COc1ccc(N(C)C(=O)c2cccc([N+](=O)[O-])c2N)cc1F 89364970 LDTXQCVAJGAZHX-UHFFFAOYSA-N 319.292 2.601 5 40 DFBB CCc1nnc(SCc2nc3cc([N+](=O)[O-])ccc3o2)n1C 83092159 HZDDSUBVBDCYFE-UHFFFAOYSA-N 319.346 2.719 5 40 DFBB O=C(CC1=CCCCC1)N1CCc2ncc([N+](=O)[O-])cc2C1 95992870 FNJWYGVJVGTJFZ-UHFFFAOYSA-N 301.346 2.765 5 40 DFBB CCC(=O)OC(C[N+]1(C)CCCCC1)C[N+]1(C)CCCCC1 509853 DHZOKGYFTNEIEB-UHFFFAOYSA-N 312.498 2.569 5 40 DFBB Cc1n[nH]c(SCC(=O)N[C@H](C)c2ccccc2)c1[N+](=O)[O-] 6382097 KNEBWLGOFPXWFZ-SECBINFHSA-N 320.374 2.596 5 40 DFBB C[C@@H](COc1cccc(F)c1)NC(=O)c1ccccc1[N+](=O)[O-] 58179526 CPHHCINZNCHYAV-NSHDSACASA-N 318.304 2.931 5 40 DFBB O=C(/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2)NC1CCCC1 7951212 MSVDWVLOVQNAQG-AATRIKPKSA-N 318.329 2.533 5 40 DFBB CCc1ccc(NC(=O)N(C)Cc2cnccn2)cc1[N+](=O)[O-] 83825339 MICAZYJHBSBKIF-UHFFFAOYSA-N 315.333 2.611 5 40 DFBB O=[N+]([O-])c1nn(Cc2ccc(Cl)cn2)cc1Br 97046757 TVWFHTGOLJYMCQ-UHFFFAOYSA-N 317.530 2.651 5 40 DFBB Cc1cc(C(=O)Cn2cccc([N+](=O)[O-])c2=O)c(Cl)cc1F 89570423 BIQHODDRBRTXQO-UHFFFAOYSA-N 324.695 2.740 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccco2)cc1 15836416 UPKOAMSQQTYWOG-CYBMUJFWSA-N 322.342 2.714 5 40 DFBB Cc1ccc([N+](=O)[O-])c2c1NC(c1ccc([N+](=O)[O-])cc1)=NO2 6167738 UHDLZQOVKXUCML-UHFFFAOYSA-N 314.257 2.978 5 40 DFBB O=C(NCc1ccccc1-n1ccnc1)c1ccc([N+](=O)[O-])cc1 22523390 AJBMYFANTKPUJX-UHFFFAOYSA-N 322.324 2.711 5 40 DFBB COc1ccccc1O[C@@H](C)CNc1c([N+](=O)[O-])c(C)nn1C 78504448 VRPHOPMQVBSSEF-JTQLQIEISA-N 320.349 2.525 5 40 DFBB Cc1cccc(O[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)c1 225125066 NESNLGZSXSTNAV-HNNXBMFYSA-N 301.298 2.978 5 40 DFBB O=C(CCn1cnc([N+](=O)[O-])c1)N1CCCCc2ccccc21 40548625 JERICTJBESSARM-UHFFFAOYSA-N 314.345 2.551 5 40 DFBB Cc1ccc(NC(=O)CSc2[nH]nc(C)c2[N+](=O)[O-])cc1C 6382621 GCJCCYJERREWQE-UHFFFAOYSA-N 320.374 2.974 5 40 DFBB aggregator CNc1snc(C)c1C(=O)OCc1ccc([N+](=O)[O-])cc1 8192581 UUKXUMPTECBROW-UHFFFAOYSA-N 307.331 2.758 5 40 DFBB C[C@@H]1Cc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1 3563903 WZZTWXMWFOXLGH-GFCCVEGCSA-N 312.325 2.951 5 40 DFBB COc1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 4610875 FPXIWCCEJDJHQB-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CCCN(CCC)CCc1cccc([N+](=O)[O-])c1CC(=O)O 22005566 PBMNGLVZPSNABM-UHFFFAOYSA-N 308.378 2.886 5 40 DFBB in-vitro COc1cccc(CNCCNc2ccc([N+](=O)[O-])cc2)c1 7276239 HXBAGTCWSNGDKI-UHFFFAOYSA-N 301.346 2.805 5 40 DFBB Cc1ccc(OCc2cc(=O)n3ccsc3n2)c([N+](=O)[O-])c1 7462747 ORCYMIRPKTVMQS-UHFFFAOYSA-N 317.326 2.552 5 40 DFBB CO[C@H]1CCC[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145840 RANGKTILZDMNRL-FZMZJTMJSA-N 307.350 2.901 5 40 DFBB O=[N+]([O-])c1cccc(C2=NN=C(NCc3ccco3)SC2)c1 9582783 LFQCPZGJOBETKY-UHFFFAOYSA-N 316.342 2.785 5 40 DFBB CN(C(=O)CSc1ccccc1[N+](=O)[O-])c1ccccn1 97085543 IGGCGISOXWRHOA-UHFFFAOYSA-N 303.343 2.745 5 40 DFBB O=[N+]([O-])c1cnccc1Nc1cccc(N2CCC(O)CC2)c1 69736919 WNGBXESQLJCENJ-UHFFFAOYSA-N 314.345 2.695 5 40 DFBB COC(=O)c1cc(N[C@H](C)c2cnn(C)c2)cc(C)c1[N+](=O)[O-] 95416546 XVUOUGFRRQCVLG-SNVBAGLBSA-N 318.333 2.596 5 40 DFBB CC(C)(C)C(=O)NCCNc1ccc2cc([N+](=O)[O-])ccc2n1 95403349 WRRSOEXJCZIITK-UHFFFAOYSA-N 316.361 2.717 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cnccn1 95997560 CAIVRMKFXQQJEF-UHFFFAOYSA-N 312.207 2.656 5 40 DFBB O=[N+]([O-])c1c(F)cccc1N1CCC(OC2CCOCC2)CC1 96419446 SQMGYFRLLUNOIX-UHFFFAOYSA-N 324.352 2.898 5 40 DFBB CCN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H](C)c1cccnc1 96406934 CFUPUAQETSHOJI-LLVKDONJSA-N 315.329 2.919 5 40 DFBB C[C@H](CCc1cccn1C)NC(=O)Cc1ccccc1[N+](=O)[O-] 96425732 HZTZKMGTNGKIPZ-CYBMUJFWSA-N 315.373 2.613 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@@H]2OCCC[C@H]2C1 97095524 PUOZPFAOJNSRAO-FZMZJTMJSA-N 324.764 2.889 5 40 DFBB O=Cc1cc([N+](=O)[O-])ccc1Sc1ncccc1C(=O)O 16386047 GBURIIGHAGMHRP-UHFFFAOYSA-N 304.283 2.652 5 40 DFBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)N[C@@H](C)c1ccccc1 196108 APQKKRUCJQQRDX-VIFPVBQESA-N 322.752 2.631 5 40 DFBB Cc1cnc(N[C@H]2CCC[C@@H](C(=O)NC3CC3)C2)c([N+](=O)[O-])c1 78664419 VQKJHADQOBCNCX-YPMHNXCESA-N 318.377 2.548 5 40 DFBB C[C@H]1CN(c2ncc(Br)cc2[N+](=O)[O-])CCS1 95966491 UWBUORBWDUYHTO-ZETCQYMHSA-N 318.196 2.694 5 40 DFBB Cc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])ccc1[N+](=O)[O-] 75285874 LWFSKPMGYWVXDJ-UHFFFAOYSA-N 315.285 2.993 5 40 DFBB CCCOC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(C)n[nH]1 70462426 TUTBWXZODXNPEO-UHFFFAOYSA-N 322.346 2.739 5 40 DFBB O=[N+]([O-])c1cc(Br)ccc1[C@H](O)C(F)(F)F 584882440 HVMGADIRHFPMRO-ZETCQYMHSA-N 300.030 2.953 5 40 DFBB NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 7239034 BLHBEXKNCGIZEG-UHFFFAOYSA-N 305.721 2.959 5 40 DFBB C[C@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H](C)O1 40526301 CGRNDXBNBFNEDU-DTORHVGOSA-N 313.741 2.889 5 40 DFBB COc1ccccc1C[C@@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])o1 80995655 IVWSMQRRZVJUGB-LLVKDONJSA-N 318.329 2.900 5 40 DFBB C[C@@H](NCc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccncc1 95385690 FAKIPQKCIGTQAD-SNVBAGLBSA-N 301.302 2.569 5 40 DFBB C[C@H]1CC[C@H](CCC(=O)N(C)Cc2ccc([N+](=O)[O-])cc2)O1 95404147 MXKLNUBQQPESSA-SWLSCSKDSA-N 306.362 2.901 5 40 DFBB C[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccsc1 97235360 AWUSISZIKCUMLR-SECBINFHSA-N 305.359 2.772 5 40 DFBB C[C@@H](O)c1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 226273974 UVIUPXFJHJUNSM-LLVKDONJSA-N 300.314 2.829 5 40 DFBB C[N@+]12CCCC[C@@H]1[C@@H](COC(=O)c1ccccc1O)CCC2 247695427 ZOEVRBRMARFYMK-IDHHARJASA-O 304.410 2.958 5 40 DFBB biogenic,in-vitro C[C@@H]1CCc2cc(F)ccc2N1c1ncnc(N)c1[N+](=O)[O-] 3912662 XRUKMLGEDPRAHX-MRVPVSSYSA-N 303.297 2.579 5 40 DFBB O=C(NCc1ccc([N+](=O)[O-])cc1)NC1Cc2ccccc2C1 97140155 OUMZEKHXMMFKBL-UHFFFAOYSA-N 311.341 2.561 5 40 DFBB Cc1cc(NCCc2nc(-c3ccccc3)n[nH]2)ncc1[N+](=O)[O-] 95943703 BCKZPJMNHSSDJN-UHFFFAOYSA-N 324.344 2.738 5 40 DFBB Cc1ccccc1OS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 226862741 MKGIRPDOABCWJR-UHFFFAOYSA-N 311.290 2.810 5 40 DFBB Cc1ccc(Nc2nc(N3CCCC3)nc(N)c2[N+](=O)[O-])cc1 5065436 QLVSLSONFRMSII-UHFFFAOYSA-N 314.349 2.619 5 40 DFBB C[C@@H]1CCc2noc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 11915493 RXXAVBQKKQADPD-SECBINFHSA-N 301.302 2.960 5 40 DFBB COc1ccc(C)cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 335576 WBHPLIJNORZFFM-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1c(F)cccc1F 3382280 CIJLAUUDNOFLPU-UHFFFAOYSA-N 308.240 2.891 5 40 DFBB O=C(CSc1ncccn1)Nc1cc([N+](=O)[O-])ccc1Cl 3442767 SKMNNRGZEWSEKG-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB CC1CCN(CCCNc2nc3ccccn3c2[N+](=O)[O-])CC1 21674653 VIUFYIJDYPQSEV-UHFFFAOYSA-N 317.393 2.776 5 40 DFBB Cc1cccc(C(=O)N2CCN(CCC(C)C)CC2)c1[N+](=O)[O-] 32933135 ZBKMQCVPHHJKGW-UHFFFAOYSA-N 319.405 2.707 5 40 DFBB CCCOc1ccc(Oc2ncc([N+](=O)[O-])cc2C(N)=O)cc1 44974347 HDGJIADMZSPVQX-UHFFFAOYSA-N 317.301 2.670 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)[C@H](C)C1CC1 58163222 QVCZTOQBTYWAGU-GFCCVEGCSA-N 305.378 2.962 5 40 DFBB Cc1nccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1Cl 71899686 FMOMTKMVXKSYCR-UHFFFAOYSA-N 322.752 2.573 5 40 DFBB Cc1ccc(C(=O)O[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(=O)[nH]1 79057056 LJHJQTRXMLFYGS-LLVKDONJSA-N 316.313 2.818 5 40 DFBB CC[C@](C)(NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1nccs1 97080107 AEBRLVHTSSZLAO-AWEZNQCLSA-N 321.358 2.812 5 40 DFBB C[C@H](Nc1nc(Cl)nc(N)c1[N+](=O)[O-])[C@H]1C[C@H]2CC[C@H]1C2 110552206 FOHGDLUCLPXOLZ-XSPKLOCKSA-N 311.773 2.857 5 40 DFBB COc1cc(OCC(=O)NC(C(C)C)C(C)C)ccc1[N+](=O)[O-] 219821298 AHAHJQWVGUIBFN-UHFFFAOYSA-N 324.377 2.779 5 40 DFBB Cc1cc(C)nc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)n1 513865 WVURSSNDIPJMHL-UHFFFAOYSA-N 306.709 2.907 5 40 DFBB CC[C@@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1cccc([N+](=O)[O-])c1 110665630 WJLBFADXPRTZLG-LXTVHRRPSA-N 304.346 2.730 5 40 DFBB O=C1O/C(=C\c2ccc3c(c2)OCO3)c2ccc([N+](=O)[O-])cc21 480628 SQBHYSIFEWYREL-RZNTYIFUSA-N 311.249 2.992 5 40 DFBB O=C(NC1CCCCC1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 911352 FSNRHUUPJDOGDL-UHFFFAOYSA-N 316.313 2.764 5 40 DFBB O=[N+]([O-])c1cccc(-c2nc(CCN3CCCCCC3)n[nH]2)c1 62719502 CCHJMMJYIFQGPL-UHFFFAOYSA-N 315.377 2.798 5 40 DFBB CN(CC(=O)Nc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 6051346 BIAXDHQDXLCDHZ-UHFFFAOYSA-N 317.320 2.804 5 40 DFBB Cc1ccc(C2=N/C(=C\c3cccnc3)C(=O)O2)cc1[N+](=O)[O-] 4472043 NNHQTSOGKHXVBF-QPEQYQDCSA-N 309.281 2.643 5 40 DFBB O=[N+]([O-])c1ccc(/C=C/c2nnc(-c3ccccc3)c[n+]2[O-])cc1 4857879 FILNQLJVWNGVRD-DHZHZOJOSA-N 320.308 2.856 5 40 DFBB C[C@@H](Cc1cccs1)NC(=O)Nc1ccncc1[N+](=O)[O-] 97080903 YGGRLUHPZSBAFM-VIFPVBQESA-N 306.347 2.804 5 40 DFBB O=[N+]([O-])c1ccc(CCN(CCO)Cc2ccsc2)cc1 79350309 YJZHAGKVVRBLHB-UHFFFAOYSA-N 306.387 2.693 5 40 DFBB CON(C)C(=O)c1ccc([N+](=O)[O-])c(OCc2ccccc2)c1 40564556 JKNTVVNARGYEOW-UHFFFAOYSA-N 316.313 2.807 5 40 DFBB O=C1[C@H]2CCCC[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 90450617 PLGBIBWHXBHNKT-UWVGGRQHSA-N 308.721 2.928 5 40 DFBB Cc1c(C(=O)OCc2cn3ccccc3n2)cccc1[N+](=O)[O-] 5640348 OJSFXZKWDZILKQ-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB O=[N+]([O-])c1cc(Oc2ccc3c(c2)CCC3)cc(-n2cnnn2)c1 12375188 VQLBGTASUXUMKB-UHFFFAOYSA-N 323.312 2.852 5 40 DFBB Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)c1O 55616396 RWKYNUVXAAOTRF-UHFFFAOYSA-N 322.342 2.718 5 40 DFBB CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C1CCCCC1 65594177 HTDRLLMMOAXNRP-UHFFFAOYSA-N 322.409 2.979 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1[N+](=O)[O-] 5583775 QRGVKCQZDVSUHO-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB Cc1ccccc1N(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 224996425 AYDFCDODYZRWRE-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB CCCN(C)S(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl 96500059 QGIXGFZYUHFEAJ-UHFFFAOYSA-N 306.771 2.587 5 40 DFBB C[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 6007603 ORQAQFGKAGHHCD-DZGCQCFKSA-N 316.357 2.685 5 40 DFBB O=[N+]([O-])c1ccsc1Sc1nc(-c2ccncc2)n[nH]1 97033879 KZWRHQZCXGVRKW-UHFFFAOYSA-N 305.344 2.988 5 40 DFBB COc1cc(N2CCC[C@@H](n3cccn3)C2)c(F)cc1[N+](=O)[O-] 95982714 PZPOGGMQCKSLGT-LLVKDONJSA-N 320.324 2.781 5 40 DFBB COC(=O)c1cc(F)ccc1COc1ncc(C)cc1[N+](=O)[O-] 75092365 LSHICMTXTZGOGJ-UHFFFAOYSA-N 320.276 2.803 5 40 DFBB Cc1c(N(C)S(=O)(=O)c2ccccc2)cccc1[N+](=O)[O-] 224673132 GOMXNYIWYXAPTH-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB O=[N+]([O-])c1ccc(-c2noc(CSc3ncc[nH]3)n2)cc1 79006203 PEXJHEGMBJDREL-UHFFFAOYSA-N 303.303 2.660 5 40 DFBB Cc1ccc([N+](=O)[O-])c2c1NC(c1cccc([N+](=O)[O-])c1)=NO2 6167739 VKKAGPBHTVVPKU-UHFFFAOYSA-N 314.257 2.978 5 40 DFBB CC(C)CCNC(=O)CSc1nc2cc([N+](=O)[O-])ccc2o1 32777305 IINONBCHRVKVMW-UHFFFAOYSA-N 323.374 2.990 5 40 DFBB CCN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CCCCC1 1473295 ZDFNYMIILZNFRU-OAHLLOKOSA-N 322.405 2.989 5 40 DFBB O=C(O[C@@H]1[C@H]2CC[C@@H]2[C@H]2C[C@H]12)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 103904579 MRHJYWPULMAEJR-PDWCTOEPSA-N 318.285 2.704 5 40 DFBB CCc1ccc(Oc2nc3ccccn3c(=O)c2[N+](=O)[O-])cc1 13012068 UKNNJQKMGCQOIX-UHFFFAOYSA-N 311.297 2.957 5 40 DFBB O=C(CCNc1ccccc1[N+](=O)[O-])N(CC(F)F)C1CC1 69737197 VEIGBWMHFJJMHX-UHFFFAOYSA-N 313.304 2.653 5 40 DFBB O=C1OC(c2ccccc2)=N/C1=C/c1ccc(O)c([N+](=O)[O-])c1 33437944 LIIZZPYRCATKCW-XYOKQWHBSA-N 310.265 2.645 5 40 DFBB O=C(O)/C(=C\c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 1716381 QMXRAGWVFVHMHK-GHXNOFRVSA-N 313.265 2.949 5 40 DFBB O=C(Oc1ccc2ccc(=O)oc2c1)c1ccc([N+](=O)[O-])cc1 276421 JDOJWCJXXCQESF-UHFFFAOYSA-N 311.249 2.920 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CCO)c2cccs2)c1 95445779 CGQXYYLVCWNOBD-LBPRGKRZSA-N 320.370 2.818 5 40 DFBB CCOC(=O)c1cc([N+](=O)[O-])c(N2CCCCC2)c([N+](=O)[O-])c1 26508828 CSZGDRIIIGKYCZ-UHFFFAOYSA-N 323.305 2.670 5 40 DFBB Cc1nc([N+](=O)[O-])c(NCCc2cccc3cccnc23)n1C 57994783 RDEPWCNAWYKOES-UHFFFAOYSA-N 311.345 2.840 5 40 DFBB O=[N+]([O-])c1ccccc1CN1CCN([C@H]2C[C@@H]3CC[C@@H]2C3)CC1 100743413 HUYZTWXQPXNEDQ-RKVPGOIHSA-N 315.417 2.901 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CCC[C@H](c2ccncn2)C1 69592383 PEGQSFIWDKMFDN-NSHDSACASA-N 302.309 2.908 5 40 DFBB Cc1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c([N+](=O)[O-])c1 13467739 UEXKHZZFXLMYOJ-WDEREUQCSA-N 304.302 2.509 5 40 DFBB COc1c([N+](=O)[O-])cc(NC(=O)c2ccccc2)cc1[N+](=O)[O-] 20528631 VHKPQRHAMGBKPJ-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB CC[C@H](C)NC(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408532190 NVGUNLBJBIBRPT-JTQLQIEISA-N 300.318 2.580 5 40 DFBB CC(=O)[C@H](C(=O)OC(C)(C)C)c1c([N+](=O)[O-])ccc(F)c1F 44560071 FLAICFLHBGZSNN-JTQLQIEISA-N 315.272 2.887 5 40 DFBB CCSCC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1F 96433103 CUBMXHBQTAJZGJ-VIFPVBQESA-N 300.355 2.995 5 40 DFBB CN1C(=O)COc2ccc(NCc3cccc([N+](=O)[O-])c3)cc21 96433684 PNXVVYCFOGZMEI-UHFFFAOYSA-N 313.313 2.562 5 40 DFBB O=C(NCc1ccno1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 390834066 REDIKECNCVSIFB-UHFFFAOYSA-N 315.207 2.532 5 40 DFBB O=C(NC(=S)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 5581966 ISNKGMPVWYMBRJ-UHFFFAOYSA-N 301.327 2.722 5 40 DFBB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 6828722 RJVVQUURVYDMTH-UWVGGRQHSA-N 324.720 2.854 5 40 DFBB CC(=O)N[C@@H]1CC2c3ccccc3C1([N+](=O)[O-])c1ccccc12 1578989 NFIAYESAWHZVDM-ZCDVPAHGSA-N 308.337 2.561 5 40 DFBB CC1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 3888049 IWCCGUDKOSKNHO-UHFFFAOYSA-N 318.782 2.669 5 40 DFBB C[C@@H]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 4902676 NFUCVLXXSGLYSO-SNVBAGLBSA-N 311.769 2.919 5 40 DFBB COc1cc2c(cc1OC)CN(c1ccc([N+](=O)[O-])nc1)CC2 6911237 AQZBSOHGLIXRTH-UHFFFAOYSA-N 315.329 2.570 5 40 DFBB O=c1[nH]c(CSc2ccc([N+](=O)[O-])cn2)nc2ccccc12 7462810 QOZRQVOZPVDHMP-UHFFFAOYSA-N 314.326 2.519 5 40 DFBB CCOc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 19932743 VXJKIXXOAZMBHE-UHFFFAOYSA-N 300.314 2.924 5 40 DFBB CC(C)(C)OC(=O)N1CCC(Oc2ncccc2[N+](=O)[O-])CC1 40434997 RQENQEWXRLUZKP-UHFFFAOYSA-N 323.349 2.768 5 40 DFBB CCc1cnc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2O)s1 89289662 GMAQEGAPOBDFPN-UHFFFAOYSA-N 321.358 2.592 5 40 DFBB Cc1nn(CCC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] 97047651 ONCKSTIUKQWNGJ-UHFFFAOYSA-N 308.725 2.782 5 40 DFBB O=[N+]([O-])c1ccc(Cl)c(-c2noc(C3CCNCC3)n2)c1 199783152 AACSALJRVFRUQL-UHFFFAOYSA-N 308.725 2.765 5 40 DFBB CCn1ccs/c1=N\C(=O)c1ccc([N+](=O)[O-])cc1Cl 408559634 ALAQEULYPFXLOM-OWBHPGMISA-N 311.750 2.872 5 40 DFBB C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1cc2ccccc2o1 97111327 HDELWMTWONWOOS-LLVKDONJSA-N 300.318 2.888 5 40 DFBB COc1cc(CNc2cccc([N+](=O)[O-])c2)cc([N+](=O)[O-])c1O 408558811 WBNUHYOPCDOJQG-UHFFFAOYSA-N 319.273 2.829 5 40 DFBB Nc1ncnc(Oc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] 3912709 YZLJHVNNXDQEMG-UHFFFAOYSA-N 300.196 2.778 5 40 DFBB CCONC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 32848256 PQDOBBDWXSZXDR-NSHDSACASA-N 307.350 2.512 5 40 DFBB CN(c1ccc(F)cc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 89365232 NMGQMJYNRBVFOT-UHFFFAOYSA-N 324.333 2.700 5 40 DFBB O=C1c2cc([N+](=O)[O-])ccc2-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c21 8425705 XREBAXXUFXUZAY-UHFFFAOYSA-N 315.197 2.623 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2c(O)cccc21 72283859 XUKXZJHQXQOKDT-OAHLLOKOSA-N 312.325 2.647 5 40 DFBB Cn1cnnc1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)C1 31653462 JLOIJCQMAHINFX-JTQLQIEISA-N 321.768 2.761 5 40 DFBB O=[N+]([O-])c1ccc(CN2CCN([C@@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 1175544 PGHIRDZUMYBGEF-LZLYRXPVSA-N 315.417 2.901 5 40 DFBB O=C(CCOc1ccc([N+](=O)[O-])cc1)NCCc1ccsc1 44938904 RUDPGRBBOSAQQX-UHFFFAOYSA-N 320.370 2.784 5 40 DFBB O=C(C1CCCC1)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 29528839 WUZARHWQWOUWSS-UHFFFAOYSA-N 321.352 2.573 5 40 DFBB CCCCn1ncc(NC(=O)c2cc([N+](=O)[O-])ccc2N)c1C 225543760 UZMLTBXELPXYDZ-UHFFFAOYSA-N 317.349 2.734 5 40 DFBB CCS[C@@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 225541823 ZNDLUCAXAYJAGN-GXSJLCMTSA-N 309.391 2.581 5 40 DFBB CN(Cc1cccc(F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 6083221 CVLALHVSVFCTCI-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB Cc1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)cccc1[N+](=O)[O-] 38643 FXXSORVGKIPXPK-WDEREUQCSA-N 306.318 2.733 5 40 DFBB COC(=O)c1ccc(OC(=O)c2cccc([N+](=O)[O-])c2C)cc1 3284510 PRHWVVCORFWQFM-UHFFFAOYSA-N 315.281 2.909 5 40 DFBB COC(=O)CCCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3895919 HHWKTSZGAOEIRA-UHFFFAOYSA-N 311.294 2.648 5 40 DFBB Cc1ccc(OCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c([N+](=O)[O-])n1 21685802 KDJZMDIWLKLBRR-RAIGVLPGSA-N 321.377 2.618 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CCC[C@@H](c2ccncn2)C1 69592386 PEGQSFIWDKMFDN-LLVKDONJSA-N 302.309 2.908 5 40 DFBB O=C(O)c1cn(-c2ccc(F)cc2[N+](=O)[O-])nc1C(F)F 575441606 JUXAFCLHGFJPCA-UHFFFAOYSA-N 301.180 2.555 5 40 DFBB O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1ccc(O)cc1 1735618 BNBFTLPBXWVSKJ-RIYZIHGNSA-N 310.265 2.645 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1 571618 UUSXOZAQNSVYIM-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB O=C1OC(c2ccccc2)=N/C1=C/Nc1cccc([N+](=O)[O-])c1 5731534 FNZDRFHAYZRUFY-GXDHUFHOSA-N 309.281 2.852 5 40 DFBB Cc1ccc(C(=O)Nc2n[nH]c(-c3ccccc3)n2)cc1[N+](=O)[O-] 25154993 FKUGGMHJRYCQSX-UHFFFAOYSA-N 323.312 2.941 5 40 DFBB C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 30758837 TYCOPGATAGSQSZ-SNVBAGLBSA-N 324.333 2.773 5 40 DFBB Cc1sc(C(=O)OCc2ncc(Cl)n2C)cc1[N+](=O)[O-] 31009091 QGCFASBGNCXMSM-UHFFFAOYSA-N 315.738 2.709 5 40 DFBB Cc1noc(C)c1CC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 71799856 CTUMTXBFRUNWEZ-VIFPVBQESA-N 315.329 2.720 5 40 DFBB C[C@@H](O)CC(C)(C)CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] 87422595 ZXKLHJBFNXFXQV-SECBINFHSA-N 314.769 2.775 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCC[S@](=O)c1ccccc1 96408676 SCYHTPISZPECHH-OAQYLSRUSA-N 305.359 2.518 5 40 DFBB CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncc(C)s1 96415648 RSTGYUHSICTLCM-SNVBAGLBSA-N 321.358 2.946 5 40 DFBB CC(=O)c1cc([N+](=O)[O-])ccc1NCCCn1ccnc1C 225820963 QRRIENBVZRJCRS-UHFFFAOYSA-N 302.334 2.805 5 40 DFBB Cc1cc(C(=O)NC[C@@H](c2ccco2)N(C)C)ccc1[N+](=O)[O-] 6559683 AQELBIYNMLQADG-AWEZNQCLSA-N 317.345 2.529 5 40 DFBB Cn1ccnc1[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1ccccc1 17590198 DCODRBYIFKFBAW-HNNXBMFYSA-N 309.329 2.925 5 40 DFBB CCS[C@@H]1CCC[C@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] 96450596 JKYYWMZZQIEFTE-TZMCWYRMSA-N 308.403 2.928 5 40 DFBB O=[N+]([O-])c1ccccc1NNC(=S)N[C@@H]1C[C@H]2CC[C@H]1C2 102267009 KNGFFIONDDWFLT-JBLDHEPKSA-N 306.391 2.574 5 40 DFBB Cc1nn(C)c(N2CCC(c3ccc(O)cc3)CC2)c1[N+](=O)[O-] 78727459 GIDQZXDWIGIAKI-UHFFFAOYSA-N 316.361 2.726 5 40 DFBB CC(C)NC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 5687767 GFONZIAOROBTDF-UHFFFAOYSA-N 305.256 2.550 5 40 DFBB CC(C)N1C(=O)S/C(=C/c2cccc([N+](=O)[O-])c2O)C1=O 409018079 QPWAOHBTEJHGGT-UXBLZVDNSA-N 308.315 2.745 5 40 DFBB COc1cc([N+](=O)[O-])ccc1Sc1nc(C(F)(F)F)n[nH]1 78406582 GELKMLUORYOWGA-UHFFFAOYSA-N 320.252 2.892 5 40 DFBB COc1cccc(C(=O)N(C)c2cccc(C)n2)c1[N+](=O)[O-] 194380772 MQEWHPBMQYAQCT-UHFFFAOYSA-N 301.302 2.583 5 40 DFBB COc1ccccc1CCNC(=O)c1cc(F)ccc1[N+](=O)[O-] 58005580 RJIPYZGNLHQUEP-UHFFFAOYSA-N 318.304 2.715 5 40 DFBB O=C1[C@H]2Nc3ccccc3N=C2O[C@@H]1c1cccc([N+](=O)[O-])c1 104239964 ARUUAPLLTWATDF-UKRRQHHQSA-N 309.281 2.760 5 40 DFBB COc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1OC 6582934 ASDMHPWDQIWIKL-UHFFFAOYSA-N 316.313 2.542 5 40 DFBB Cc1occc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 71804223 PGWBLOLCMKOIPL-UHFFFAOYSA-N 312.285 2.934 5 40 DFBB Cc1noc(C2CC2)c1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 194662774 ZFLXJTHZHRYWSO-UHFFFAOYSA-N 323.330 2.569 5 40 DFBB Cc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ccc1[N+](=O)[O-] 91365839 DJXLXFWWETVERO-UHFFFAOYSA-N 321.377 2.960 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)NCCCc1ccccc1 5682701 DHCHTYYJYGTXDX-UHFFFAOYSA-N 320.370 2.506 5 40 DFBB CCOC1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 58406773 HZNIZGDHAWBOLY-UHFFFAOYSA-N 317.345 2.717 5 40 DFBB COc1c(C)cnc(CN(C)c2ncccc2[N+](=O)[O-])c1C 58544901 VXFAYMFNWPYEML-UHFFFAOYSA-N 302.334 2.647 5 40 DFBB C[C@@H]1CCC[C@](O)(CNc2nc3sccn3c2[N+](=O)[O-])C1 65566742 BUXXNDOIEOBXDL-NOZJJQNGSA-N 310.379 2.657 5 40 DFBB Cc1ccc2nc(COC(=O)c3ccc([N+](=O)[O-])s3)cn2c1 8424849 QZNBPHWMOPSIQJ-UHFFFAOYSA-N 317.326 2.969 5 40 DFBB CCN(CC(=O)NCCC(C)C)Cc1cccc([N+](=O)[O-])c1 40088661 ZECATLAFZGDBNC-UHFFFAOYSA-N 307.394 2.579 5 40 DFBB Cc1ccnc(N2CCN(c3cccs3)CC2)c1[N+](=O)[O-] 96466169 OOAGCSSWIXCQCX-UHFFFAOYSA-N 304.375 2.686 5 40 DFBB O=c1[nH]c2ccc3c(=O)n(C4CCCCC4)c(=O)c4ccc1c2c34 11691659 GJUOUHJLHQUPSN-UHFFFAOYSA-N 320.348 2.737 5 40 DFBB O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCCCC1 6382954 WJBADGVQJGAKDY-UHFFFAOYSA-N 320.374 2.576 5 40 DFBB CSc1ccc(C(=O)NCCc2ccco2)cc1[N+](=O)[O-] 14136387 LTVWXLPKLDOBSL-UHFFFAOYSA-N 306.343 2.882 5 40 DFBB CC(C)(C)OC(=O)N1CCC(Nc2ncccc2[N+](=O)[O-])CC1 40434934 UISHFIHXKWMDIY-UHFFFAOYSA-N 322.365 2.801 5 40 DFBB CCS[C@H]1CCC[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 96450513 LTTSQBUCCBYJIJ-KBPBESRZSA-N 308.403 2.928 5 40 DFBB O=C(O)CCCNc1c([N+](=O)[O-])cc([N+](=O)[O-])c2ccccc12 5003541 QOXMFBOCSDHEKJ-UHFFFAOYSA-N 319.273 2.933 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)c([N+](=O)[O-])c1 4071174 FOVLNHJABWPLMT-UHFFFAOYSA-N 323.286 2.825 5 40 DFBB CS[C@@H]1CCC[C@H]1N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 108360382 VIGZCXGIFZTHTL-QLFBSQMISA-N 310.419 2.844 5 40 DFBB COc1ccc(OC)c(CC(=O)Nc2cccc([N+](=O)[O-])c2)c1 20447875 GIBQDMVPKSECFY-UHFFFAOYSA-N 316.313 2.793 5 40 DFBB COc1cc(N2CCC[C@H](c3nc(C)no3)C2)ccc1[N+](=O)[O-] 91455072 IKAYXFQUNLYGSB-NSHDSACASA-N 318.333 2.679 5 40 DFBB C[C@H]1C[C@@H](C)n2nccc2N1C(=O)c1ccc(F)cc1[N+](=O)[O-] 97227645 OGKXDPCBZLZPLI-VHSXEESVSA-N 318.308 2.930 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1-2 95682052 PDEJYRZFAJILSQ-UHFFFAOYSA-N 301.214 2.982 5 40 DFBB CC(=O)Nc1cccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])o2)c1 30279710 IEEMIDDOYSKADE-SECBINFHSA-N 317.301 2.637 5 40 DFBB O=[N+]([O-])c1ccccc1NNC(=S)N[C@H]1C[C@H]2CC[C@H]1C2 102267015 KNGFFIONDDWFLT-NHCYSSNCSA-N 306.391 2.574 5 40 DFBB CCCc1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)no1 6891265 JPYADOCZZCILAB-UHFFFAOYSA-N 324.724 2.514 5 40 DFBB O=[N+]([O-])c1ccc(NCc2cccc(Cn3cccn3)c2)nc1 54837024 HZTGYCAUFLQLAY-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB Cc1c(Cl)cccc1NC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1 95994869 HPOALACZMMVCQW-VIFPVBQESA-N 308.725 2.953 5 40 DFBB Cn1cccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1 95449203 RYYHDZOYSKHWIX-UHFFFAOYSA-N 311.301 2.576 5 40 DFBB COc1ccc(C(=O)Nc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 2618108 XFPMNKHMVMUBKP-UHFFFAOYSA-N 316.269 2.584 5 40 DFBB COCc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 26547173 WORXDXNQBBHYGC-UHFFFAOYSA-N 322.342 2.542 5 40 DFBB COc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 31929684 VTHFGGZAWUHKHO-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB CCOC(=O)c1ccc(Sc2nc(CC)n[nH]2)c([N+](=O)[O-])c1 70462361 DJMNUSBMIZVOJL-UHFFFAOYSA-N 322.346 2.603 5 40 DFBB CNc1cc(N2CCN(C(C)C)CC2)c(Cl)cc1[N+](=O)[O-] 45221409 VSFXBBZSWKFTDI-UHFFFAOYSA-N 312.801 2.820 5 40 DFBB Cc1cc(C)n(CCOC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 42776930 ZEPCOQUOFVWDSJ-UHFFFAOYSA-N 303.318 2.574 5 40 DFBB CN(CCCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 17826760 OZYGWQWYAWPUSV-UHFFFAOYSA-N 313.357 2.851 5 40 DFBB C[C@@H]1CC(=O)Nc2ccc([N+](=O)[O-])cc2N1CC(F)(F)F 4004762 PMFBHLWFEFXFMM-SSDOTTSWSA-N 303.240 2.694 5 40 DFBB C[C@@H](c1cccc([N+](=O)[O-])c1)n1nnc(-c2cccc(F)c2)n1 48324728 KNVABKCMIARTSF-JTQLQIEISA-N 313.292 2.997 5 40 DFBB O=C(CCCNc1ccccc1[N+](=O)[O-])Nc1cccnc1 15096992 JETCOPKGZKJSGD-UHFFFAOYSA-N 300.318 2.821 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](CN2CCCC2)C1 89780843 RKGPRUMWPYYDNL-ZDUSSCGKSA-N 318.377 2.544 5 40 DFBB CCN1CCC[C@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C 89977238 KRVBHPWMIRIFCE-LBPRGKRZSA-N 306.366 2.509 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1csc(C)n1 79038642 WINVDYBMVJUJMY-UHFFFAOYSA-N 321.358 2.940 5 40 DFBB Cc1ccc(CC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2O)cn1 97114586 NIRFJKMFCDCANE-UHFFFAOYSA-N 321.720 2.838 5 40 DFBB O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 5569075 QMOJBGNDADRJJI-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB COc1cc(Nc2ccc([N+](=O)[O-])cn2)cc(OC)c1OC 23077414 PVBGLCJVJQICIH-UHFFFAOYSA-N 305.290 2.759 5 40 DFBB O=C1Nc2ccccc2/C1=C/c1cc([N+](=O)[O-])cc2c1OCOC2 96919800 FUYDWQBURXMYCG-AUWJEWJLSA-N 324.292 2.954 5 40 DFBB COC(=O)c1ccoc1COC(=O)c1ccc([N+](=O)[O-])c(C)c1 23446776 YSNXTYZWIRHGHP-UHFFFAOYSA-N 319.269 2.640 5 40 DFBB CC1(C)CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CCS1 83648221 SYVVGYXZVVVPRL-UHFFFAOYSA-N 309.391 2.632 5 40 DFBB Cc1cc(N[C@H]2CCCN(c3ncccn3)C2)ccc1[N+](=O)[O-] 52427060 ZAMLFWVPPBWFKN-AWEZNQCLSA-N 313.361 2.774 5 40 DFBB Cc1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1[N+](=O)[O-] 13166344 BZZSIZQSWJOPFU-UHFFFAOYSA-N 314.297 2.531 5 40 DFBB COC(=O)[C@H](CC(C)C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 32265664 UQPMCWKMIOEENR-NSHDSACASA-N 311.294 2.503 5 40 DFBB COc1c(-c2nc(SC)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1857794308 BHNCXCBYOXLHMR-UHFFFAOYSA-N 300.727 2.764 5 40 DFBB COc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1[N+](=O)[O-] 7052645 PUHCVEOCDZPNKF-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB Cc1ccnc(SCc2nc3cc([N+](=O)[O-])ccc3n2C)n1 9421285 YPQJDBHIAPUQEX-UHFFFAOYSA-N 315.358 2.872 5 40 DFBB CCc1ccc(NC(=O)NC[C@@H](C)C[C@H](C)O)cc1[N+](=O)[O-] 77677199 LNMQDWHKWGWECS-QWRGUYRKSA-N 309.366 2.686 5 40 DFBB Nn1c(Sc2ccc(Cl)cc2[N+](=O)[O-])nnc1C(F)F 216903882 MREKHQJCOTVYIP-UHFFFAOYSA-N 321.696 2.642 5 40 DFBB CN(C)CCN(Cc1cccnc1)c1ccccc1[N+](=O)[O-] 95429739 BVPWFNBWEIDFOK-UHFFFAOYSA-N 300.362 2.558 5 40 DFBB Cc1cc(C)n(CCOC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 42776883 KNOHEMKZYPGMQY-UHFFFAOYSA-N 303.318 2.574 5 40 DFBB CN(c1ccccc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 22523520 YXJCQUJEYHMABQ-UHFFFAOYSA-N 306.343 2.561 5 40 DFBB COc1cc([N+](=O)[O-])c(C(=O)NCc2ccco2)cc1SC 69373573 GDGQGUHDYCBXSR-UHFFFAOYSA-N 322.342 2.848 5 40 DFBB CN(C)C1(CNc2nc3sccn3c2[N+](=O)[O-])CCCCC1 8337162 XBMWHZXHPRYCAZ-UHFFFAOYSA-N 323.422 2.980 5 40 DFBB C[C@H](CCO)Sc1ncc([N+](=O)[O-])cc1Br 86482085 MYZGGDCFXARQHC-ZCFIWIBFSA-N 307.169 2.615 5 40 DFBB O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCSC1 96430629 QRMDRGIXJLGZCO-UHFFFAOYSA-N 306.265 2.760 5 40 DFBB O=[N+]([O-])c1cc(Br)ccc1[C@@H](O)C(F)(F)F 584882435 HVMGADIRHFPMRO-SSDOTTSWSA-N 300.030 2.953 5 40 DFBB O=[N+]([O-])c1ccc(NCc2ccccc2Cn2cccn2)nc1 14703399 HZGDKZGZTYVVHJ-UHFFFAOYSA-N 309.329 2.847 5 40 DFBB COc1ccc([C@@H](O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 550343 OKQAUKWXEQDHKU-MRXNPFEDSA-N 319.313 2.702 5 40 DFBB O=C(OCCOc1ccccc1F)c1cccc([N+](=O)[O-])c1 3270362 MTAWMWUTVQBYRF-UHFFFAOYSA-N 305.261 2.970 5 40 DFBB CCCn1cc(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2O)cn1 97081867 BBWCTFHIWDCNAB-UHFFFAOYSA-N 324.724 2.813 5 40 DFBB O=C1Nc2ccccc2[C@@]12CCN[C@H]2c1ccc([N+](=O)[O-])cc1 61719463 UCBLNISWHNMWHE-DOTOQJQBSA-N 309.325 2.519 5 40 DFBB CC(C)(C)OC(=O)Nc1cn(CC(F)(F)F)nc1[N+](=O)[O-] 1548918718 CXVOSVZXJNOINO-UHFFFAOYSA-N 310.232 2.701 5 40 DFBB O=C(NCCCOCc1ccccc1)c1cccc([N+](=O)[O-])c1 10103003 BSACSXMUUQIIDA-UHFFFAOYSA-N 314.341 2.932 5 40 DFBB CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccc(F)cc1 46644679 VXXWAJDHMKKNKM-NSHDSACASA-N 320.324 2.540 5 40 DFBB CC(C)=C1[C@H]2C=C[C@H]1[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21 105516931 AVKFLDKUMSOHKX-RRCSTGOVSA-N 324.336 2.853 5 40 DFBB CCc1ccc(-c2nn3cnc4ccccc4c3nc2=O)cc1 58047053 QUBVTCAFFKIWIM-UHFFFAOYSA-N 302.337 2.867 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1cocn1 96007651 BGMDPFUHLQXLLU-UHFFFAOYSA-N 301.180 2.854 5 40 DFBB O=C(O)[C@@H]1CS[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N1 5772186 CXEPVJPUZWVNTN-TVQRCGJNSA-N 320.326 2.643 5 40 DFBB CS[C@H]1CCC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 95468182 HMQNTEJUOOTWKS-ZJUUUORDSA-N 309.391 2.581 5 40 DFBB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1 96486106 YHGALCOLMFRSIS-CQSZACIVSA-N 314.345 2.912 5 40 DFBB O=C(Oc1c([N+](=O)[O-])cccc1[N+](=O)[O-])C1[C@H]2CCCC[C@@H]12 18140728 YEIHKLUYLWIVOO-USUYBEQLSA-N 306.274 2.845 5 40 DFBB Cc1sc(C(=O)Nc2cccc(NC(N)=O)c2)cc1[N+](=O)[O-] 24436765 KEKNFRMFWLUYAL-UHFFFAOYSA-N 320.330 2.708 5 40 DFBB Cc1ccc(NC(=O)c2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] 14207032 RDYZSYZIQPCOJN-QFIPXVFZSA-N 318.354 2.893 5 40 DFBB C[C@H](C(=O)OC(C)(C)C)N(C)CCOc1ccccc1[N+](=O)[O-] 72311438 OZIXBRMHVGGFSR-GFCCVEGCSA-N 324.377 2.636 5 40 DFBB O=[N+]([O-])c1ccc(NCC2(O)CCSCC2)c2ccncc12 75142934 NFOITFNJJFRJAD-UHFFFAOYSA-N 319.386 2.813 5 40 DFBB CC(C)(C)OC(=O)N1CCC[C@H](Oc2ccc([N+](=O)[O-])cn2)C1 40434893 IJLKUIAADAPLFZ-LBPRGKRZSA-N 323.349 2.768 5 40 DFBB COC(=O)c1ccc(C(=O)OC)c2nc3cc(C)c(C)cc3nc12 5664429 ACWPQTUTAJHMQR-UHFFFAOYSA-N 324.336 2.973 5 40 DFBB COc1ccccc1[C@H]1NC[C@H](c2ccc([N+](=O)[O-])cc2)O1 19805532 RUPFSSOHHXJTKI-CVEARBPZSA-N 300.314 2.963 5 40 DFBB CCCCOC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1795149 PEAHUXXTQSKTHW-UHFFFAOYSA-N 314.319 2.938 5 40 DFBB CCN(C(=O)c1csc([N+](=O)[O-])c1)c1ccc(OC)nc1 48332464 RUTGVPZWCQTQEA-UHFFFAOYSA-N 307.331 2.727 5 40 DFBB CC1(C)CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[S@@]1=O 96007808 REROSIYZOITWNN-HXUWFJFHSA-N 316.810 2.591 5 40 DFBB COc1ccccc1CNc1nc2sccn2c1[N+](=O)[O-] 8746577 BSRJWOVOYPVOSJ-UHFFFAOYSA-N 304.331 2.925 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1F)N1CCSc2ncccc21 76040904 NDHGPYIIPXLTKR-UHFFFAOYSA-N 319.317 2.881 5 40 DFBB Cc1nc2ccc(Cl)nn2c1C(=O)c1ccc([N+](=O)[O-])cc1 152991 KMINWQKIIKHZAF-UHFFFAOYSA-N 316.704 2.830 5 40 DFBB O=[N+]([O-])c1ccccc1OCCSc1nnc2ccccn12 53416574 MBRKSCIYQVXMIW-UHFFFAOYSA-N 316.342 2.809 5 40 DFBB O=[N+]([O-])c1ccc(-c2nn3c(-c4cccnc4)nnc3s2)cc1 5017060 SIDCTRHLUZDUSF-UHFFFAOYSA-N 324.325 2.823 5 40 DFBB Nn1c(Sc2ccc([N+](=O)[O-])cc2Cl)nnc1C(F)F 216903300 DEKUANSRRVIYLX-UHFFFAOYSA-N 321.696 2.642 5 40 DFBB COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(C2CC2)s1 22738594 XOTRGDHRIWEQLH-UHFFFAOYSA-N 320.330 2.585 5 40 DFBB CCc1nnc2sc3nc4cc(OC)ccc4cc3c(=N)n12 101409678 UFMVCPKUTOMVOZ-UHFFFAOYSA-N 311.370 2.543 5 40 DFBB O=C1OCCN1c1cccc(Nc2ccc([N+](=O)[O-])cn2)c1 46478944 CXUFCBWKKWABNK-UHFFFAOYSA-N 300.274 2.690 5 40 DFBB Cc1cccnc1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 69845588 BFSNTPRRVROTJJ-UHFFFAOYSA-N 305.721 2.882 5 40 DFBB COc1ncccc1N(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 95978712 IEZQMORHTWNIEP-UHFFFAOYSA-N 321.720 2.928 5 40 DFBB COc1cc([N+](=O)[O-])c(OC)cc1NC(=O)c1cccs1 13427300 WPKVKQIPPVQPKW-UHFFFAOYSA-N 308.315 2.926 5 40 DFBB Cc1cccn2cc(CCNC(=O)c3ccc([N+](=O)[O-])cc3)nc12 4248460 ULSLFRUEGMEXCA-UHFFFAOYSA-N 324.340 2.523 5 40 DFBB CCCc1nnc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)s1 258676 HWLUCEMNVOGDTD-UHFFFAOYSA-N 306.347 2.960 5 40 DFBB Cc1ccc(CNC(=S)Nc2ccc([N+](=O)[O-])cn2)cc1 6966009 AZBCLOURNAIIAE-UHFFFAOYSA-N 302.359 2.785 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)NC1CCCCC1 7380991 AZNXRULXFRVSHN-NSHDSACASA-N 321.377 2.853 5 40 DFBB C[C@H]1CCCC[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cn1 178753108 BIZJJGYGOFEJIK-JQWIXIFHSA-N 309.391 2.777 5 40 DFBB Cc1noc(C)c1COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 6588580 QPYAUYFDZCRGFN-VMPITWQZSA-N 302.286 2.956 5 40 DFBB O=C(COC(=O)c1cccs1)Nc1ccc(F)cc1[N+](=O)[O-] 6829210 JZSPWVFSQUILHY-UHFFFAOYSA-N 324.289 2.591 5 40 DFBB Cc1noc(C)c1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1O 97114583 BXZGTFBRFIGCOV-UHFFFAOYSA-N 311.681 2.811 5 40 DFBB NC(=O)c1cc2cc([N+](=O)[O-])ccc2o/c1=N\Cc1ccccc1 17130755 RUOPBMRBMAEHKT-ZPHPHTNESA-N 323.308 2.541 5 40 DFBB CC(C)C[C@H](N)C(=O)Nc1ccc2[nH]c3ccccc3c(=O)c2c1 4521638 SKTYNEUNWSKXMK-HNNXBMFYSA-N 323.396 2.993 5 40 DFBB O=C(Nc1ncc([N+](=O)[O-])s1)OCC(Cl)(Cl)Cl 4419257 BHNVEMYFKHCYTJ-UHFFFAOYSA-N 320.541 2.970 5 40 DFBB CCS(=O)(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 15443302 JDRRUTBBJKEUHO-UHFFFAOYSA-N 312.391 2.769 5 40 DFBB Cc1nc(-c2ccccc2)sc1Cn1cnc([N+](=O)[O-])n1 69512543 XJMFUNLIIXXMJE-UHFFFAOYSA-N 301.331 2.667 5 40 DFBB O=c1nc(Nc2cccc([N+](=O)[O-])c2)sc2ncccc12 1423146 HVVLGMTWBBHXQP-UHFFFAOYSA-N 300.299 2.703 5 40 DFBB CC(C)c1nccn1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 97053515 NQLIJQQKRVAQPZ-UHFFFAOYSA-N 314.345 2.504 5 40 DFBB CCO[C@H]1C[C@H](O)C12CCN(c1ccc(C)cc1[N+](=O)[O-])CC2 84800915 QGSYNLALEKHAHC-HOTGVXAUSA-N 320.389 2.660 5 40 DFBB CCOc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 357174 YLPXLCOHHYTLSB-UHFFFAOYSA-N 312.281 2.794 5 40 DFBB C[C@@H](NP1(=O)OCC(C)([N+](=O)[O-])CO1)c1ccccc1 1667927 WZPZDMQUVGZEIO-BLZGGWKYSA-N 300.251 2.528 5 40 DFBB COc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])o2)cc1F 24311760 FOXQOSKBKDBQQT-MRVPVSSYSA-N 308.265 2.827 5 40 DFBB CC(C)NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 3300767 AYVAKVGMYGZXKS-UHFFFAOYSA-N 311.388 2.821 5 40 DFBB CCN1CC[C@H](N(C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C 72305952 DKWVYOHXMYMCEH-JSGCOSHPSA-N 320.393 2.931 5 40 DFBB O=C(CN1CCCc2ccccc21)Nc1cccc([N+](=O)[O-])c1 6786101 FIKWGFJPFBMYCM-UHFFFAOYSA-N 311.341 2.986 5 40 DFBB CC(C)[C@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 8747220 NYCBHQUKBIYTEY-ZDUSSCGKSA-N 319.405 2.972 5 40 DFBB O=c1nc2c3cc(Cl)ccc3nc(O)n2nc1-c1ccccc1 71924192 RKESIFLIMOBORL-UHFFFAOYSA-N 324.727 2.664 5 40 DFBB CC(=O)Nc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2)cc1 5864254 LSSHYYMJEMVTAL-UHFFFAOYSA-N 314.297 2.815 5 40 DFBB CC[N+](C)(CC)CCC[C@@H](C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 16991721 YXUAYPZTVHXYSJ-PMPSAXMXSA-N 309.474 2.817 5 40 DFBB CC(=O)Nc1cccc(C(=O)OCc2ccccc2[N+](=O)[O-])c1 6304379 BXGQLLVHJBYXKP-UHFFFAOYSA-N 314.297 2.910 5 40 DFBB C[C@H](NC(=O)N[C@H](C)C1CCOCC1)c1cccc([N+](=O)[O-])c1 97015974 PFNDYUFQIMNUIA-NEPJUHHUSA-N 321.377 2.770 5 40 DFBB Cc1cc(N[C@H]2CCC[C@@H]2C(N)=O)c2cccc([N+](=O)[O-])c2n1 95463620 YNAKUYOHZRALFL-RYUDHWBXSA-N 314.345 2.517 5 40 DFBB O=[N+]([O-])c1nn(C2CCCC2)cc1I 72339393 GVUIDFSWFHXQIM-UHFFFAOYSA-N 307.091 2.511 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)NCC2=CCCCC2)c1 224482139 KOYKMILTQSELDU-UHFFFAOYSA-N 310.375 2.515 5 40 DFBB Cc1nc2c([N+](=O)[O-])c(N3CCCCC3)c([N+](=O)[O-])cc2[nH]1 5116025 IGCKSSGGIKBOHB-UHFFFAOYSA-N 305.294 2.678 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1ccccc1 16088938 OTCQFLJPUMIOCV-LBPRGKRZSA-N 320.370 2.943 5 40 DFBB CC(C)N(C1CC1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 30354759 JUEGVWICTBPTPF-UHFFFAOYSA-N 318.782 2.810 5 40 DFBB Cc1cc(C)n(CCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)n1 24933115 MIQZOVKYGQVPQO-UHFFFAOYSA-N 302.334 2.745 5 40 DFBB Cc1ccc([N+](=O)[O-])c(O[C@@H](C)C(=O)Nc2cc(C)on2)c1 9114795 PTNODPJZYGJHJT-JTQLQIEISA-N 305.290 2.606 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc2c(c1)OCO2 4672734 JHVLJTNTSNUPAT-UHFFFAOYSA-N 316.269 2.584 5 40 DFBB COc1ccc([C@H](CO)N(C)Cc2csc([N+](=O)[O-])c2)cc1 71904359 XDPSWKSDAPNCKA-AWEZNQCLSA-N 322.386 2.830 5 40 DFBB C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1nnc2ccccn12 97111422 FJLZRCQBIIBZAF-SNVBAGLBSA-N 315.308 2.627 5 40 DFBB O=[N+]([O-])c1cccc([C@H](O)Cn2ccnc2-c2cccnc2)c1 95974671 IPUJQQLHMUMHPY-OAHLLOKOSA-N 310.313 2.587 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1cc2ccccc2[nH]1 96483117 FRINCSLLZMVTQL-UHFFFAOYSA-N 323.352 2.978 5 40 DFBB CC(C)C(=O)NC(=S)Nc1nc2ccc([N+](=O)[O-])cc2s1 17066418 MPXJSGDNVZZDNP-UHFFFAOYSA-N 324.387 2.674 5 40 DFBB O=C(CCOc1ccc([N+](=O)[O-])cc1)NCCc1ccccc1 31553388 VZCYLXQRYXWHKQ-UHFFFAOYSA-N 314.341 2.723 5 40 DFBB O=C(NCc1ccc(-c2ccc(Cl)cc2)o1)[C@H]1C[C@H]1[N+](=O)[O-] 32932526 XKRKXCPGEHMFKC-QWHCGFSZSA-N 320.732 2.881 5 40 DFBB O=[N+]([O-])c1cccc(CN2CCN([C@H]3C[C@H]4CC[C@@H]3C4)CC2)c1 4724430 LYSZMVOIADELTI-LESCRADOSA-N 315.417 2.901 5 40 DFBB C[C@H](Nc1cncc(-n2cccn2)n1)c1cccc([N+](=O)[O-])c1 58150405 BBGHEZKHGGPDNY-NSHDSACASA-N 310.317 2.744 5 40 DFBB O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccc(F)cc1 5569533 IBPAHAHXLLAMAY-UHFFFAOYSA-N 318.260 2.757 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCCN1CCCCC1 13648853 OQCZVYKNEMROQP-CMDGGOBGSA-N 317.389 2.600 5 40 DFBB COc1ccc(-n2cc3c([N+](=O)[O-])cc([N+](=O)[O-])cc3n2)cc1 2190621 BUNRNLIOGMHMGV-UHFFFAOYSA-N 314.257 2.851 5 40 DFBB COc1ccc(C(=O)Nc2nc3c(s2)CCC3)cc1[N+](=O)[O-] 6470468 HAZLQELNBDIVQQ-UHFFFAOYSA-N 319.342 2.801 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)Oc1ccc2c(c1)OCO2 6946508 MPEZKGUEFOVAFU-QPJJXVBHSA-N 313.265 2.942 5 40 DFBB CC(C)C(=O)Nc1nnc(COc2ccc([N+](=O)[O-])cc2)s1 17058826 NKBFQAXVZMIAST-UHFFFAOYSA-N 322.346 2.620 5 40 DFBB O=C(Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)N1CCCCC1 95983956 SDEFHDYBVHVNLH-UHFFFAOYSA-N 322.752 2.610 5 40 DFBB Cc1ccccc1COc1cc(C(=O)O)c(O)c([N+](=O)[O-])c1 216753568 ZYYQDQWPPMUVEV-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB Cc1cc(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(Cl)cc1F 84077298 GMUBQJXTAUPWAP-UHFFFAOYSA-N 324.695 2.740 5 40 DFBB O=C1Nc2ccccc2Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c21 2025124 KLNXLERKYIWYAC-UHFFFAOYSA-N 301.214 2.861 5 40 DFBB O=C1C(O)=C[C@@]2(c3cccc([N+](=O)[O-])c3)Nc3ccccc3N12 13961555 VJXADKDYIADNKQ-MRXNPFEDSA-N 309.281 2.662 5 40 DFBB CCC(CC)(CNC(=O)Nc1ccccc1[N+](=O)[O-])N(C)C 31094566 REHNAGYKQCEHMT-UHFFFAOYSA-N 308.382 2.837 5 40 DFBB CCc1n[nH]c(SCCCOc2ccc([N+](=O)[O-])cc2)n1 54916102 RYWXAWWSATVVIY-UHFFFAOYSA-N 308.363 2.837 5 40 DFBB C[C@H](Cn1cccc([N+](=O)[O-])c1=O)C(=O)c1ccc(F)c(F)c1 97082087 CBQORCQBKSQRLP-SECBINFHSA-N 322.267 2.554 5 40 DFBB Cc1ccc(O[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)cc1 225125197 NGWGEKSKBFQEBX-OAHLLOKOSA-N 301.298 2.978 5 40 DFBB O=c1nc2n(-c3ccccc3Cl)c3ccccc3cc-2c(=O)[nH]1 59484169 BZSKGMDUZZJJBH-UHFFFAOYSA-N 323.739 2.832 5 40 DFBB NC(=O)c1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 6332029 YZQIFMDEGYMJFY-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB CCC[C@@H]1C[C@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 75373721 JDQUKFHBYWOWNB-IAQYHMDHSA-N 314.345 2.699 5 40 DFBB CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cn1 76346750 QYMOVIYQYKHVOO-UHFFFAOYSA-N 305.721 2.849 5 40 DFBB O=C(Nc1ccccc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 174967 NDMMIVPXGAPYKM-UHFFFAOYSA-N 310.265 2.954 5 40 DFBB Cc1noc(C2CC2)c1NC(=O)Cc1ccccc1[N+](=O)[O-] 96012114 BSQPPIQFARYXQJ-UHFFFAOYSA-N 301.302 2.950 5 40 DFBB O=C(CN1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1 8763059 OKYBSASLWDAKOQ-UHFFFAOYSA-N 317.370 2.653 5 40 DFBB Cc1cc(NC(=O)N[C@H](C)C2CCOCC2)ccc1[N+](=O)[O-] 97163040 NUFVHRQSLPLXQE-LLVKDONJSA-N 307.350 2.840 5 40 DFBB O=C(CCOc1ccc([N+](=O)[O-])cc1)NCc1ccccc1F 31491130 NHTHNUCUMVIIEV-UHFFFAOYSA-N 318.304 2.819 5 40 DFBB COc1ccc(-c2nc3sccn3c2C=O)cc1[N+](=O)[O-] 36138730 QZMADOIFOOUKKL-UHFFFAOYSA-N 303.299 2.792 5 40 DFBB CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)cc1 36382472 JULPKLXBGSSYNU-UHFFFAOYSA-N 302.286 2.951 5 40 DFBB COc1cc(NCc2c(C)cc(C)[nH]c2=O)ccc1[N+](=O)[O-] 89568568 ISRMPURKCXPIFP-UHFFFAOYSA-N 303.318 2.521 5 40 DFBB Cc1ccc(OCC(=O)Nc2cccc(Cl)c2)c([N+](=O)[O-])n1 13285349 RBSQUAMJHUOCJO-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1OCc1cc(=O)n2ccsc2n1 42180612 ZOERWQASRQVXCN-UHFFFAOYSA-N 317.326 2.552 5 40 DFBB O=[N+]([O-])c1ccc(NCCNCc2ccncc2)c(Cl)c1 8418162 QKIKPLVHRLYMHB-UHFFFAOYSA-N 306.753 2.845 5 40 DFBB O=C(OCc1ccc(Oc2cccnc2)cc1)[C@@H]1C[C@@H]1[N+](=O)[O-] 95350488 LTPIEVMVIQGVNX-CABCVRRESA-N 314.297 2.582 5 40 DFBB CC[C@]1(C)CN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CCO1 187881631 PUMCQCMLOBTTJV-MLGOLLRUSA-N 321.377 2.866 5 40 DFBB COc1ccc(Cn2c(=O)oc3ccccc32)cc1[N+](=O)[O-] 8783091 JNSVZHHXSLQXPR-UHFFFAOYSA-N 300.270 2.560 5 40 DFBB C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 23994267 AVTXFAAHUCOQKI-JTQLQIEISA-N 324.333 2.773 5 40 DFBB CC[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1cnn(CC)c1 95401904 NKOYQYYNJWYRON-HNNXBMFYSA-N 316.361 2.621 5 40 DFBB O=[N+]([O-])c1cnn(C[C@H](O)c2ccc(C(F)(F)F)cc2)c1 95974747 ABKMETTWTPERLJ-NSHDSACASA-N 301.224 2.544 5 40 DFBB CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 25093500 SNUSMPYCSYOEEX-OLZOCXBDSA-N 308.382 2.512 5 40 DFBB CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 44485654 NUZWTGPEDQCDGA-IAGOWNOFSA-N 310.353 2.977 5 40 DFBB O=C1COc2cc([N+](=O)[O-])ccc2N1Cc1ccccc1F 13534478 UPDBDEOUYQEBCX-UHFFFAOYSA-N 302.261 2.660 5 40 DFBB O=C(Nc1ccccc1-n1cccn1)c1ccc([N+](=O)[O-])c(O)c1 96004292 DRJUBTZXVKEFNW-UHFFFAOYSA-N 324.296 2.738 5 40 DFBB O=C(O)c1ccc(Nc2ncnc3ccc([N+](=O)[O-])cc23)cc1 4342276 DHWNXEVICXEICS-UHFFFAOYSA-N 310.269 2.980 5 40 DFBB COc1cc(C(=O)O)ccc1OCc1ccc([N+](=O)[O-])cc1 7603960 YMONHLJJRRITER-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB O=C(Cc1ccon1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 97050432 PQXUHHFVENXOSZ-UHFFFAOYSA-N 315.207 2.783 5 40 DFBB O=[N+]([O-])c1cccc(OCCn2nccc2-c2ccncc2)c1 97082506 WFIYVNHGJZSWQB-UHFFFAOYSA-N 310.313 2.932 5 40 DFBB CN(CC1CCCCC1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 24830146 AOJPXZNOUHGZSF-UHFFFAOYSA-N 312.391 2.796 5 40 DFBB O=[N+]([O-])c1cnn(CCN[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 130222827 KVAMYHJVFADLLK-NXEZZACHSA-N 306.288 2.502 5 40 DFBB C[C@H](CNc1ncccc1[N+](=O)[O-])N1CCc2ccccc2C1 26729815 IFDMTJDHKSTYAB-CYBMUJFWSA-N 312.373 2.849 5 40 DFBB CO[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 58378736 OBMFBKLWFSTFGO-OAHLLOKOSA-N 300.314 2.599 5 40 DFBB Cc1ccc(NC(=O)[C@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 4291933 YFYWCKDAYSLMJI-OAHLLOKOSA-N 314.297 2.682 5 40 DFBB COc1ccc(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 149042091 HNVLNISYWDQQQQ-UHFFFAOYSA-N 317.297 2.852 5 40 DFBB COc1ccc(NC(=O)c2cccnc2Cl)cc1[N+](=O)[O-] 14258207 PBPILCACOYNGIF-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB COC(=O)COc1ccc([N+](=O)[O-])cc1Cc1ccccc1 18386476 ZULWJXAKEUKXEX-UHFFFAOYSA-N 301.298 2.737 5 40 DFBB CCOc1ccccc1NC(=O)CCCn1cc([N+](=O)[O-])cn1 1423780 ASILWLLUNZJGGU-UHFFFAOYSA-N 318.333 2.609 5 40 DFBB O=C(Nc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])s1 4276169 UDKJHSALNPYOAB-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB Cc1ccccc1NCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 187265 ZHKNRKQNOZOZHA-UHFFFAOYSA-N 311.297 2.569 5 40 DFBB CCOc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 10112203 XPITUVOMARWKBH-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB O=[N+]([O-])c1c(Nc2ccc3[nH]ncc3c2)nc2sccn12 8319163 GZRRYDBSARCYMC-UHFFFAOYSA-N 300.303 2.924 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)Cc1cnn(C)c1 97145791 UDDHTSWZWSEDAC-UHFFFAOYSA-N 317.349 2.609 5 40 DFBB CC(C)[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1nccn1C 32933001 KETKELGKEIMMMJ-ZDUSSCGKSA-N 317.349 2.847 5 40 DFBB CC[C@@H]1CCCCN1C(=O)CSc1[nH]nc(C)c1[N+](=O)[O-] 249625 LEVDTFAPJPTPPZ-SNVBAGLBSA-N 312.395 2.510 5 40 DFBB CCc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1CC 20033746 NTZFJAJVCCRSKP-UHFFFAOYSA-N 320.374 2.744 5 40 DFBB CC(=O)Nc1nc(CSc2ncccc2[N+](=O)[O-])cs1 48309001 QGHPKCSBZCDWAK-UHFFFAOYSA-N 310.360 2.697 5 40 DFBB NC(=O)c1cc(Cl)ccc1OCc1ccc([N+](=O)[O-])cc1 6127768 YYJUUBIMFHEGCK-UHFFFAOYSA-N 306.705 2.926 5 40 DFBB O=[N+]([O-])c1ccc([C@H]2CC(c3cccc([N+](=O)[O-])c3)=NN2)cc1 4359648 BXVPNPDHHLGLQY-CQSZACIVSA-N 312.285 2.942 5 40 DFBB O=C(NC1CC1)[C@H](Oc1ccccc1[N+](=O)[O-])c1ccccc1 8291264 ZFWUIRUMSNPCKH-MRXNPFEDSA-N 312.325 2.994 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCSc2ncccc21 76040906 AEIMVTQXSZYHBG-UHFFFAOYSA-N 315.354 2.671 5 40 DFBB CCCCOC(=O)c1ccc(Sc2ncn[nH]2)c([N+](=O)[O-])c1 70462352 VTKQOLVZDPRXBM-UHFFFAOYSA-N 322.346 2.821 5 40 DFBB Cc1nc(C)c(CCNC(=O)c2cccc([N+](=O)[O-])c2)s1 4392420 ZVZOCEKTNDHMMF-UHFFFAOYSA-N 305.359 2.641 5 40 DFBB CC(C)CN(CC(C)C)C[C@H](O)COc1ccc([N+](=O)[O-])cc1 2205599 VVUMJBSALUOGNP-INIZCTEOSA-N 324.421 2.949 5 40 DFBB CC(=O)c1c[nH]c(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 7949409 SZEOHJHVZUTCOB-SNVBAGLBSA-N 315.329 2.959 5 40 DFBB COc1cccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2)c1 14864005 KGWPRDWMXKLLPT-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB Cc1ccc(S(=O)(=O)NCC2CCCCC2)cc1[N+](=O)[O-] 46543070 VATCKLNBWSUDNG-UHFFFAOYSA-N 312.391 2.762 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 100936992 VTAPUJBSGAMKHF-QQXRRDQMSA-N 318.716 2.560 5 40 DFBB C/C=C1\C[N+]2(C)CC[C@]34c5ccccc5N[C@H]3[C@H](CO)[C@H]1C[C@H]42 103982312 LKZQOCJBJKPRFV-OPUABZPCSA-N 311.449 2.526 5 40 DFBB Cc1sc(C(=O)Nc2ccc(CCO)cc2)cc1[N+](=O)[O-] 48325172 AJSGQAXWAAFALD-UHFFFAOYSA-N 306.343 2.752 5 40 DFBB O=[N+]([O-])c1cnc(N[C@H]2C[C@H]2c2ccccc2)nc1NC1CC1 63248815 GFUQSWSZTCCBOZ-STQMWFEESA-N 311.345 2.927 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCCC(=O)N(C)c1ccccc1 95394077 VUCCJCQHYAOHLH-UHFFFAOYSA-N 314.345 2.763 5 40 DFBB COc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C 8747415 RHHNFUMJNSUXCA-UHFFFAOYSA-N 315.329 2.922 5 40 DFBB CCc1cnc([C@H](C)NC(=O)c2c(N)cccc2[N+](=O)[O-])s1 97050652 VYJVWEACUMYMDJ-QMMMGPOBSA-N 320.374 2.687 5 40 DFBB O=c1cc(C2CCC2)ncn1Cc1c(F)cccc1[N+](=O)[O-] 89704097 YTCHSBYWVDEVEB-UHFFFAOYSA-N 303.293 2.606 5 40 DFBB COc1ccc([C@H](O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 149478937 PAPDDAQERZQYLZ-MRXNPFEDSA-N 319.313 2.702 5 40 DFBB C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1 3382335 XYKXXDPQWFQJDG-LBPRGKRZSA-N 300.314 2.851 5 40 DFBB Cc1c(C(=O)Nc2cc(-c3ccncc3)n[nH]2)cccc1[N+](=O)[O-] 69585781 AHKHRXBJNFFYAY-UHFFFAOYSA-N 323.312 2.941 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CC(=O)c1cccc(OC(F)F)c1 72291232 GHXNZHAJUOOBSN-UHFFFAOYSA-N 311.244 2.584 5 40 DFBB Cc1ncsc1C(=O)N1CCCc2c1cccc2[N+](=O)[O-] 95436686 IASWVSFNKDGRFB-UHFFFAOYSA-N 303.343 2.953 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c(C)n1 89587581 XPMKSJNIHHALTP-UHFFFAOYSA-N 301.302 2.868 5 40 DFBB COc1cc(N2CCC[C@H]2Cn2ccnc2C)ccc1[N+](=O)[O-] 225598221 CDIYOCAFEGJFJO-AWEZNQCLSA-N 316.361 2.777 5 40 DFBB CCOC(=O)C[C@H](n1nc([N+](=O)[O-])cc1C1CC1)C(F)(F)F 675032200 UFNCBAWXUORGLQ-VIFPVBQESA-N 321.255 2.725 5 40 DFBB O=c1ccn(CCOc2cccc3ccccc23)cc1[N+](=O)[O-] 84598638 QMAIHQWBPXLREP-UHFFFAOYSA-N 310.309 2.989 5 40 DFBB Cc1c(C(=O)NC[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] 40074534 XGKCNBDIBBVJQQ-ZDUSSCGKSA-N 312.325 2.637 5 40 DFBB C[C@H](NC[C@H](O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 6007597 YJRADHWTWDJRKO-BBRMVZONSA-N 316.357 2.685 5 40 DFBB O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cc(C2CC2)n[nH]1 58166115 VSATYYWQIADVIS-UHFFFAOYSA-N 315.333 2.636 5 40 DFBB O=C(N[C@@H]1CCOc2ccccc21)c1ccc(F)c([N+](=O)[O-])c1 7312720 PSWCFOOQRZNVBT-CYBMUJFWSA-N 316.288 2.988 5 40 DFBB N[C@H](c1ccc(F)cc1)c1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 95533250 OCBVFCQKQMXAMA-CYBMUJFWSA-N 313.292 2.567 5 40 DFBB Cc1cc(NCCCc2nnc3ccccn23)ccc1[N+](=O)[O-] 92631070 PDWVLHQYBJPTEW-UHFFFAOYSA-N 311.345 2.991 5 40 DFBB Cc1ccccc1CCNc1nc2ccccn2c(=O)c1[N+](=O)[O-] 26082038 KUZGBPHRFDXSFI-UHFFFAOYSA-N 324.340 2.566 5 40 DFBB O=C(COC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 5673139 UOBUJOQJTUNSQJ-UHFFFAOYSA-N 321.235 2.913 5 40 DFBB CC(=O)Nc1ccccc1C(=O)OCc1ccc([N+](=O)[O-])cc1 5833632 NMSYPFJOLCSRQT-UHFFFAOYSA-N 314.297 2.910 5 40 DFBB CN(CC(=O)Nc1cccc([N+](=O)[O-])c1)Cc1ccsc1 7926921 QTLGYPJISSLIQK-UHFFFAOYSA-N 305.359 2.727 5 40 DFBB CC(C)c1cnc(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)o1 79091519 JJJOSKMIDFBTLE-UHFFFAOYSA-N 315.285 2.502 5 40 DFBB COc1ccc([C@H](O)[C@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 96485324 CINCMBUGBGAPPG-MEDUHNTESA-N 317.345 2.841 5 40 DFBB O=[N+]([O-])c1ccc(NCCNCc2cccc([N+](=O)[O-])c2)cc1 8418453 DXZAKVDBXLTTPP-UHFFFAOYSA-N 316.317 2.705 5 40 DFBB COc1ccc(NC(=O)COc2ccc(C)cc2)cc1[N+](=O)[O-] 9141540 QSOJURIPHYRWSN-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB CCCCc1noc(CN2CCc3cc([N+](=O)[O-])ccc32)n1 95365080 FUVRBYNDVYGDLO-UHFFFAOYSA-N 302.334 2.883 5 40 DFBB CC(C)(NC(=O)Nc1ccncc1[N+](=O)[O-])c1nccs1 97080932 NGDAAKYTIZYMSA-UHFFFAOYSA-N 307.335 2.503 5 40 DFBB O=[N+]([O-])c1ccc(NC2CCC(O)CC2)cc1OC(F)F 96427277 XUPLEIAEKBNCJF-UHFFFAOYSA-N 302.277 2.912 5 40 DFBB CCN(c1cccnc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 96406681 YHUFKSXZYRMXQT-UHFFFAOYSA-N 321.358 2.513 5 40 DFBB CO[C@H](CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(C)C 72511520 CGNHORVNVNYPHX-LLVKDONJSA-N 300.742 2.649 5 40 DFBB CC1([N+](=O)[O-])COP(=O)(Nc2cccc(Cl)c2)OC1 1704622 QQVBDURDWCTDJS-UHFFFAOYSA-N 306.642 2.942 5 40 DFBB COc1cccc(OCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 1473159 NLYKAAKKZFRWKX-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB CC(C)c1noc(-c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)n1 20898120 WJKALFYZGFPQOE-UHFFFAOYSA-N 318.333 2.605 5 40 DFBB O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@H](CO)C1 8177856 WLCRIHGFLMUGQV-VIFPVBQESA-N 304.268 2.822 5 40 DFBB CCCc1cc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])n[nH]1 71896439 PJQBIKCTNHBWOI-UHFFFAOYSA-N 304.306 2.531 5 40 DFBB Cc1ccc([C@H](N)c2n[nH]c(-c3ccccc3[N+](=O)[O-])n2)cc1 95534090 XJPVASSYBBIWAK-AWEZNQCLSA-N 309.329 2.736 5 40 DFBB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 5944022 FWMZYGAEPXRDNX-ZJUUUORDSA-N 324.720 2.854 5 40 DFBB C[C@@H]1CCN(C(=O)CCn2cnc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]21 40090671 HQSAKDAJSYPHDI-MCIONIFRSA-N 320.393 2.609 5 40 DFBB O=[N+]([O-])c1cccc(C[S@](=O)Cc2nnsc2Cl)c1 32801277 DIAUTORQDAKOQT-LJQANCHMSA-N 317.779 2.549 5 40 DFBB C[C@H]1Cc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1 3563902 WZZTWXMWFOXLGH-LBPRGKRZSA-N 312.325 2.951 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1C(=O)O 33563350 ULABKYQAUTYOEA-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1nc2[nH]nc(O)c2c2c1c(=O)oc1ccc(Cl)cc12 20085976 IBGRNKSPPGFIST-UHFFFAOYSA-N 301.689 2.885 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@@H](CO)C2)c(C(F)(F)F)c1 40452902 JNPNEIFVXQBUJX-SECBINFHSA-N 304.268 2.822 5 40 DFBB CCOC(=O)[C@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1 25405630 UOCCKWDRWRCLSS-CYBMUJFWSA-N 302.286 2.673 5 40 DFBB Cn1c(CCNc2ccc([N+](=O)[O-])cn2)nc2ccc(F)cc21 71920525 RKJNZIJOZJKWMZ-UHFFFAOYSA-N 315.308 2.670 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 4291932 YFYWCKDAYSLMJI-HNNXBMFYSA-N 314.297 2.682 5 40 DFBB Cc1c(CO)cc([N+](=O)[O-])c(N2CCC[C@@H](C)CC2)c1[N+](=O)[O-] 68824718 NTQRUIKGNHKGMW-SNVBAGLBSA-N 323.349 2.930 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCCc1c[nH]c2ccccc12 17295686 AIXGIAYLCFITRT-UHFFFAOYSA-N 323.352 2.978 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](O)c1ccsc1 97096150 DPBJNMGCHDWDTB-ZDUSSCGKSA-N 321.358 2.820 5 40 DFBB CCS[C@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 225541843 ZNDLUCAXAYJAGN-ONGXEEELSA-N 309.391 2.581 5 40 DFBB Cn1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Cl)n1 209851 VJJAKRNGBUIQCP-UHFFFAOYSA-N 315.116 2.887 5 40 DFBB O=C(NCc1cccc([N+](=O)[O-])c1)NOCc1ccccc1 71186030 CNLYPDHPSXSICC-UHFFFAOYSA-N 301.302 2.526 5 40 DFBB CNc1snc(C)c1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 84026767 BFRLHNPJWNVDPT-QMMMGPOBSA-N 320.374 2.892 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1nc2ccccc2o1 95965154 DNPWXJUETJQJMV-UHFFFAOYSA-N 311.253 2.692 5 40 DFBB C[C@@H](NC(=O)[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 72986939 BTYTXEODBNQNGG-IAQYHMDHSA-N 300.314 2.506 5 40 DFBB Cc1ccc([C@H](N)c2n[nH]c(Cc3ccc([N+](=O)[O-])cc3)n2)cc1 95534150 KIYKTIQRWJGULC-INIZCTEOSA-N 323.356 2.660 5 40 DFBB CN(C)C[C@H](CNc1ncc([N+](=O)[O-])s1)c1ccccc1 252508941 XYITYNZSWHEERK-LBPRGKRZSA-N 306.391 2.809 5 40 DFBB O=C(Nc1cc(Cl)ccc1O)c1n[nH]c([N+](=O)[O-])c1Cl 17054133 DMMQKCIRIMGCDE-UHFFFAOYSA-N 317.088 2.583 5 40 DFBB CCOC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1C 4194745 JZLGWRBRTHFOIK-UHFFFAOYSA-N 324.314 2.987 5 40 DFBB CC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 42102666 NSHXZICZHVUDEB-LLVKDONJSA-N 312.391 2.625 5 40 DFBB CC(=O)c1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 3515189 ALUZHNQGRKCDMY-UHFFFAOYSA-N 314.297 2.815 5 40 DFBB Cc1cc(S(=O)(=O)NCc2ccccc2)cc([N+](=O)[O-])c1C 5235058 PMWVCYUZMQPJTC-UHFFFAOYSA-N 320.370 2.690 5 40 DFBB 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CC(C)(C)OCCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O 50957478 KHQQJPIFJNEGOC-UHFFFAOYSA-N 317.345 2.634 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1ccco1 1764014 SWLVCQZCBKEISL-UHFFFAOYSA-N 305.290 2.860 5 40 DFBB CC(C)C[C@]1(C)NC(=O)N(Cc2csc([N+](=O)[O-])c2)C1=O 54421944 SQSKCBXJMAYVHV-ZDUSSCGKSA-N 311.363 2.513 5 40 DFBB C[C@@H]1CCC[C@@H](C)N1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 226722374 PKJOQFCLAGSZLV-MGPQQGTHSA-N 308.378 2.597 5 40 DFBB Cc1cc(C)cc([C@@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 69697005 BQDQNYDGHLXTJL-CYBMUJFWSA-N 316.361 2.676 5 40 DFBB COc1ccccc1NCC(=O)Nc1ccc([N+](=O)[O-])cc1 7953446 RMCWZINLVMHTGJ-UHFFFAOYSA-N 301.302 2.654 5 40 DFBB Cc1cc(NC(=O)N(C)CCCn2ccnc2)ccc1[N+](=O)[O-] 97163042 UWNAQXHFIYAFPR-UHFFFAOYSA-N 317.349 2.654 5 40 DFBB CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ccccn1 96437086 KSHAAWPFHKGNHD-OAHLLOKOSA-N 315.329 2.823 5 40 DFBB COCCNC(=S)Nc1cc2cccnc2c2cccnc12 6570790 JTFYLKOGFKOEDX-UHFFFAOYSA-N 312.398 2.716 5 40 DFBB Cc1cccc(C(=O)N2CCOC3(CCCC3)C2)c1[N+](=O)[O-] 84225715 SPMXZIOGFXVBDY-UHFFFAOYSA-N 304.346 2.688 5 40 DFBB CCOc1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1 993537 UBLKNFUAHZYWPW-UHFFFAOYSA-N 312.281 2.794 5 40 DFBB CN(CC1CCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 12770106 GNSHHQYMGNRICG-UHFFFAOYSA-N 312.391 2.796 5 40 DFBB COc1cccc(C(=O)OCc2cccc([N+](=O)[O-])c2)c1OC 3325553 VKCQXESSJYMWSN-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H](C(C)C)CC1 71908064 KALZUZHDLIYRAO-AWEZNQCLSA-N 322.409 2.775 5 40 DFBB COc1cc(N2C[C@@H]3CN4CCCC[C@@H]4[C@H]3C2)ccc1[N+](=O)[O-] 245289616 DAZGMCGHBZIPNQ-AEGPPILISA-N 317.389 2.524 5 40 DFBB CCNc1ccc(C(=O)OCC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 5700649 UUHITVQWJZYKIT-UHFFFAOYSA-N 324.333 2.525 5 40 DFBB COc1ccc(C(=O)Nc2ccccc2[N+](=O)[O-])cc1OC 5514213 HJMOLWTXKZYWAE-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CN(C)[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 10017754 MOQWPCZOVXAFHI-INIZCTEOSA-N 313.357 2.628 5 40 DFBB COc1ccc(C)c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 6270318 LFEXOVIAPKDYDI-UHFFFAOYSA-N 322.342 2.713 5 40 DFBB O=c1[nH]c(CSc2ncccc2[N+](=O)[O-])nc2ccccc12 95373492 VVGRRGUZVHYYCE-UHFFFAOYSA-N 314.326 2.519 5 40 DFBB COc1ccc(C(=O)Nc2cc(C(C)(C)C)n[nH]2)cc1[N+](=O)[O-] 58137529 OTIMKBPKTXFKHZ-UHFFFAOYSA-N 318.333 2.876 5 40 DFBB COc1cc(/C=C\c2onc(C)c2[N+](=O)[O-])cc(OC)c1O 408542428 JJLNAXYGDGTZRZ-PLNGDYQASA-N 306.274 2.784 5 40 DFBB Cc1csc(-c2cccc(OC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])c2)n1 65491536 SZIYJNCCPQLVIR-VXGBXAGGSA-N 304.327 2.689 5 40 DFBB CC(=O)Nc1ccc(C(=O)Oc2cccc([N+](=O)[O-])c2)s1 14086204 MBUSDUHXLQCBDN-UHFFFAOYSA-N 306.299 2.834 5 40 DFBB O=C1c2ccccc2C(=O)N1Cc1c(F)cccc1[N+](=O)[O-] 78756966 PQPSXQMPYPVSIF-UHFFFAOYSA-N 300.245 2.530 5 40 DFBB COC(=O)c1ccc(SCC(=O)c2ccc([N+](=O)[O-])o2)cc1 1565714 USXBCDYQHNTZKF-UHFFFAOYSA-N 321.310 2.949 5 40 DFBB Cc1cccc(NC(=O)COc2nc(C)cc(C)c2[N+](=O)[O-])c1 96006430 UCLOZMRYJMVPAR-UHFFFAOYSA-N 315.329 2.933 5 40 DFBB CCCN(C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C1 81361228 RKBDOIZKDQCFCB-CQSZACIVSA-N 319.405 2.707 5 40 DFBB Cc1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])c1 169302111 BVUUQMPZCQAOIE-YIKOMLBNSA-N 312.325 2.605 5 40 DFBB CC(C)CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] 58418208 ZRFSJBONVPNHIO-UHFFFAOYSA-N 302.334 2.627 5 40 DFBB O=C(CSCc1ccc([N+](=O)[O-])cc1)NCc1ccncc1 20238377 ZNZAREXCXHCBCS-UHFFFAOYSA-N 317.370 2.539 5 40 DFBB Cc1cc(Cl)cc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1O 72286997 FBQRJEVTHDJKML-UHFFFAOYSA-N 310.697 2.546 5 40 DFBB O=C(NCc1cccc(F)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 74362126 COAAEBYQDPXZOY-UHFFFAOYSA-N 319.248 2.572 5 40 DFBB CCO[C@@H](C)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 91963312 SAJQRKOQSOJRFF-ZETCQYMHSA-N 317.139 2.721 5 40 DFBB COC(=O)c1ccccc1N(C)C(=O)c1ccc([N+](=O)[O-])cc1 12752571 WGSUUUMOHNQRFO-UHFFFAOYSA-N 314.297 2.658 5 40 DFBB Cc1c(NC(=O)CCSc2ncccn2)cccc1[N+](=O)[O-] 40489173 HOCRETSIDSWUAR-UHFFFAOYSA-N 318.358 2.814 5 40 DFBB CCOC(=O)c1ccoc1COc1ccc(OC)cc1[N+](=O)[O-] 22044052 XVGTXHSZCGPLFP-UHFFFAOYSA-N 321.285 2.952 5 40 DFBB C[C@@H]1CCCC[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cn1 178753096 BIZJJGYGOFEJIK-PWSUYJOCSA-N 309.391 2.777 5 40 DFBB Cc1cc(C)cc([C@@H](C)NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1 71884449 MTVGMRLIQHCGLG-GFCCVEGCSA-N 316.361 2.594 5 40 DFBB CCC[C@](C)(O)CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] 76019198 WWKOZVQFLOIHFD-AWEZNQCLSA-N 312.391 2.598 5 40 DFBB CS[C@@H]1CC[C@@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 95990196 HIYQQSZQPANSQN-HTQZYQBOSA-N 316.329 2.887 5 40 DFBB Cc1cc(SC2=NCCCN2C)c([N+](=O)[O-])cc1[N+](=O)[O-] 4553482 LAMCGSHPJMWALJ-UHFFFAOYSA-N 310.335 2.595 5 40 DFBB CCCN(C[C@H]1CCCCO1)Cn1nc(C)c([N+](=O)[O-])c1C 71883586 NHYCZVDISHUBHN-CQSZACIVSA-N 310.398 2.647 5 40 DFBB CC(C)[C@H](Nc1ccccc1[N+](=O)[O-])c1nnc2n1CCC2 89801905 CUDBRJMIHFEVNF-AWEZNQCLSA-N 301.350 2.942 5 40 DFBB O=[N+]([O-])c1ccc(-c2n[nH]cc2I)cc1 82565123 WEURNUWKXFKOFC-UHFFFAOYSA-N 315.070 2.590 5 40 DFBB CC(=O)N1c2ccccc2C(=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1 205681 USQALIUOSHNUBF-OAHLLOKOSA-N 312.281 2.817 5 40 DFBB C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 9913937 GGGVKDIWIDYXIF-LLVKDONJSA-N 324.340 2.891 5 40 DFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])OC1([C@H]2CCOC2)CC1 96442323 ORWQLYUSNKNFSE-GFUIURDCSA-N 303.314 2.720 5 40 DFBB Cc1ccc(NC(=O)[C@@H](C)OCC(F)(F)F)cc1[N+](=O)[O-] 31701942 QABHTTGHWUUGGZ-MRVPVSSYSA-N 306.240 2.809 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc2c(c1)OCO2 6233214 QDDYVOANGWMODW-UHFFFAOYSA-N 300.270 2.884 5 40 DFBB Cc1nc([N+](=O)[O-])c(N2CCc3[nH]c4ccccc4c3C2)n1C 65226916 QDXVTLLUGJZZIE-UHFFFAOYSA-N 311.345 2.681 5 40 DFBB CCO[C@@H]1C[C@H](O)C12CCN(c1ccc(C)cc1[N+](=O)[O-])CC2 84800913 QGSYNLALEKHAHC-JKSUJKDBSA-N 320.389 2.660 5 40 DFBB CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])c2cc(F)ccc21 72503021 NNEPOXDRPPMCDR-UHFFFAOYSA-N 315.304 2.831 5 40 DFBB CCc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 225026322 WAHNPWAYGNWBCV-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB CC(C)(C)Cc1csc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n1 96494221 SOXJSEWDYPJVGV-UHFFFAOYSA-N 309.351 2.615 5 40 DFBB O=[N+]([O-])c1cccc(OCCN2CCC(N3CCCC3)CC2)c1 84374565 JDYCDNLUMUWOOM-UHFFFAOYSA-N 319.405 2.534 5 40 DFBB Cc1ccc2[nH]c(=O)cc(OC(=O)c3ccc([N+](=O)[O-])cc3)c2c1 5530189 RKXYSJVBWPCAIA-UHFFFAOYSA-N 324.292 2.964 5 40 DFBB O=C(O)/C=C\C(=O)Nc1ccc2c(c1)Cc1cc([N+](=O)[O-])ccc1-2 17285189 UWWANAPPEOJEGH-WAYWQWQTSA-N 324.292 2.745 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ccc(F)cc1 19159809 UWRZQQNKWROQPP-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB C[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 18207489 VRXOXICTLIABFM-GFCCVEGCSA-N 317.389 2.726 5 40 DFBB O=C(CSC(=S)N1CCCC1)c1ccc([N+](=O)[O-])cc1 301702 HZZLPUSCQWEVCU-UHFFFAOYSA-N 310.400 2.891 5 40 DFBB COC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 485331 DEHKYKNRRCXLJB-UHFFFAOYSA-N 300.270 2.634 5 40 DFBB CC[C@](CO)(NCc1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 83469433 ZCVNJBZXLDNCLQ-QGZVFWFLSA-N 316.357 2.688 5 40 DFBB CSc1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cn1 69487084 OFWRXYJUPNPKMU-UHFFFAOYSA-N 304.331 2.546 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccccc1 5208316 UACMDBXMMBPVJL-UHFFFAOYSA-N 301.302 2.925 5 40 DFBB O=C(NCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3093746 FUAXLQOABVNDLJ-UHFFFAOYSA-N 319.248 2.572 5 40 DFBB Cc1nn([C@@H](C)C(=O)N[C@@H](C)[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1[N+](=O)[O-] 101617430 DQKCGZGIMIXYSB-RORMEEMCSA-N 320.393 2.602 5 40 DFBB CC(C)O[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1(C)C 95944393 LPHHUWIWQRLEJS-HUUCEWRRSA-N 320.389 2.846 5 40 DFBB Cn1cnnc1-c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 31806553 BMNZIQLQBYCQHE-UHFFFAOYSA-N 323.312 2.643 5 40 DFBB C[C@H](c1cccs1)N(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 32851092 CPRYYYKKBQFCJN-SNVBAGLBSA-N 319.386 2.948 5 40 DFBB O=C(Oc1cc(=O)oc2ccccc12)c1ccc([N+](=O)[O-])cc1 3149501 MDTXRPIVTOZIJD-UHFFFAOYSA-N 311.249 2.920 5 40 DFBB COc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])c([N+](=O)[O-])c1 4616871 VWVRZSUBCWBLDM-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB CCc1nn(C)c(N2CCC[C@@H](c3nccs3)C2)c1[N+](=O)[O-] 95994724 QDSLBWVYPFVRHK-SNVBAGLBSA-N 321.406 2.731 5 40 DFBB COc1ccc(NC(=O)c2cc(OC)cc([N+](=O)[O-])c2)cc1 14168987 IEJJRIGQEHCXNI-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB O=C(Nc1nnc(-c2ccccc2)o1)c1ccccc1[N+](=O)[O-] 4330303 LBYMWFUABOIOPZ-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB O=C(Nc1cccnc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 24332505 LZHYKSRUDWMNEY-UHFFFAOYSA-N 312.329 2.842 5 40 DFBB CN(CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 57455966 DNVDQPFSBBMXEW-UHFFFAOYSA-N 317.320 2.804 5 40 DFBB C[C@H]1CCCCN1c1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 26508784 FLHJAAVNTLOAEJ-QMMMGPOBSA-N 309.278 2.580 5 40 DFBB O=C(NCCOc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F 68185902 PESOHIWXKBHVCG-UHFFFAOYSA-N 322.267 2.682 5 40 DFBB C[C@@H]1CCN(C(=O)c2c[nH]c(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C 96011244 MHHOKEODINYRFM-GHMZBOCLSA-N 314.345 2.855 5 40 DFBB COc1cccc(NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c1 20452071 SBHCGTCKINDRJN-UHFFFAOYSA-N 322.342 2.545 5 40 DFBB Cc1csc([C@@H](Nc2c([N+](=O)[O-])c(C)nn2C)C2CC2)n1 78381468 HIVSVEGSQLLQRV-JTQLQIEISA-N 307.379 2.965 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)N(Cc1nnc(C3CCC3)o1)CC2 97374260 XRJIPDHRZSJNJI-UHFFFAOYSA-N 300.318 2.808 5 40 DFBB O=Cc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 98063789 AIFMVMVBXRQMLR-UHFFFAOYSA-N 311.341 2.734 5 40 DFBB Cc1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 304323 IKWBQSXCLRVUNN-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB COc1cc(OC)c(C(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 1727044 AEBVSRZEWZJVMZ-UHFFFAOYSA-N 317.297 2.852 5 40 DFBB CCCc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 20033806 MUYYWSDZGHEMAG-UHFFFAOYSA-N 322.346 2.661 5 40 DFBB CCOC(=O)CCCCC(=O)c1ccc(OC)c([N+](=O)[O-])c1 2580512 ZXYKLGQSWHLDLV-UHFFFAOYSA-N 309.318 2.910 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)C1C[C@@H]2CCC[C@H](C1)C2=O 14128851 QGFXNALCBONDTN-FOSCPWQOSA-N 302.330 2.929 5 40 DFBB CCOCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 9724681 CVVWPVVHYUXMBK-UHFFFAOYSA-N 308.359 2.966 5 40 DFBB CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)cc1 132243304 RRSVASQSCLMHSU-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB C[N+]1(C)CC[C](OC(=O)[C@](O)(c2ccccc2)C2CCCC2)C1 1560406263 USQAFIWEBOJSSG-IBGZPJMESA-N 317.429 2.620 5 40 DFBB COc1ccc(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 2736765 JNOCZIUQUNKYKA-UHFFFAOYSA-N 314.341 2.505 5 40 DFBB O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 3523768 RHIWVDNCONRGRG-UHFFFAOYSA-N 315.281 2.818 5 40 DFBB O=C(NCCc1cccs1)NCc1ccccc1[N+](=O)[O-] 43309640 ZOTAJNSLWYPFBQ-UHFFFAOYSA-N 305.359 2.698 5 40 DFBB Cc1oc(-c2ccccc2)nc1Cn1cc([N+](=O)[O-])ccc1=O 45548526 YWKRRAFPSWIXEU-UHFFFAOYSA-N 311.297 2.768 5 40 DFBB Cc1ccc(N(C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])C2CCCCC2)nc1 71888168 BREOTGBDRONABH-KGLIPLIRSA-N 303.362 2.721 5 40 DFBB Cc1ncc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c(C(C)C)n1 71907993 UEFHFZMELOKNAM-UHFFFAOYSA-N 314.345 2.747 5 40 DFBB O=[N+]([O-])c1ccccc1-c1ccc(CN2CCNCC2)s1 20282646 KYIVPMPGFGHZHK-UHFFFAOYSA-N 303.387 2.729 5 40 DFBB in-vitro CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Cl 3156575 OPWVFHZIAZMMIB-UHFFFAOYSA-N 301.686 2.685 5 40 DFBB Cc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1[N+](=O)[O-] 5754053 APPOJKIPELHCPS-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB C[S@](=O)CCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 69743022 LPEJCUKAXYYVGO-HXUWFJFHSA-N 310.297 2.794 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2c(O)cccc21 72283857 XUKXZJHQXQOKDT-HNNXBMFYSA-N 312.325 2.647 5 40 DFBB Cc1cc(C)c(OCC(=O)N2CCC(C)CC2)c([N+](=O)[O-])c1 8944642 CEUJEIACCODYIV-UHFFFAOYSA-N 306.362 2.849 5 40 DFBB CC(C)Oc1cccc([C@H](O)CNc2ccncc2[N+](=O)[O-])c1 72286891 AJGFOJPGUHJCAP-MRXNPFEDSA-N 317.345 2.923 5 40 DFBB O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCC(F)F 96009632 YTUPLHXCOUGJCP-UHFFFAOYSA-N 310.709 2.722 5 40 DFBB C[C@H](O)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 97232714 AHQMFJZVVKNFDX-TVQRCGJNSA-N 312.753 2.624 5 40 DFBB CC(C)c1ccc(NCCn2cc([N+](=O)[O-])ccc2=O)cc1 95445292 GIZBTFPAAFARDA-UHFFFAOYSA-N 301.346 2.992 5 40 DFBB CCN1CCC[C@@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C 89977237 KRVBHPWMIRIFCE-GFCCVEGCSA-N 306.366 2.509 5 40 DFBB C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 32804221 YYKFWMOGIQNPKB-LBPRGKRZSA-N 320.370 2.775 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)c1ccc(C2OCCO2)s1 43210416 LGFQTQCRIDYSOW-UHFFFAOYSA-N 305.311 2.933 5 40 DFBB C[C@@H](NCc1cccc([N+](=O)[O-])c1)[C@H](O)Cc1ccccc1 96483231 LZFXIMYMYDEEBJ-CXAGYDPISA-N 300.358 2.677 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)N1CCC(C)CC1 3337313 ZRNKIQKXWMGJSC-UHFFFAOYSA-N 305.378 2.882 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([N+](=O)[O-])cc1 2027962 AFTKLRSJXYBWJS-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB CN1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 20426974 CKUICTQEOBDACZ-UHFFFAOYSA-N 308.381 2.694 5 40 DFBB biogenic CCc1nc(CCNC(=O)c2ccccc2[N+](=O)[O-])sc1C 70014252 ZAQAQFJHYHWWQB-UHFFFAOYSA-N 319.386 2.895 5 40 DFBB CC(C)(CNC(=O)OC(C)(C)C)Nc1ccc([N+](=O)[O-])cn1 69538240 CMVYEEVTDYJAOU-UHFFFAOYSA-N 310.354 2.705 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])c1nnnn1C1CCCCC1 188787047 ZFDIWVDNNLTODR-JTQLQIEISA-N 318.337 2.622 5 40 DFBB Cc1nn(CCC(=O)N2[C@@H](C)CCC[C@H]2C)c(C)c1[N+](=O)[O-] 18095864 XWZGHWMGJXTJPR-PHIMTYICSA-N 308.382 2.588 5 40 DFBB CCN(CC)CCCOC(=O)c1noc2cc([N+](=O)[O-])ccc12 1670689 AYSCOGZIXLZLMD-UHFFFAOYSA-N 321.333 2.625 5 40 DFBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC3CCCCC3)cc21 3904424 UNGMEFJYZAQFKO-UHFFFAOYSA-N 304.350 2.530 5 40 DFBB CCNc1nc2c(cc1C(=O)OCC)c(=O)oc1ccccc12 24718170 NSVPEIDDWNWTPZ-UHFFFAOYSA-N 312.325 2.950 5 40 DFBB biogenic Cc1ccccc1[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16087327 FNIFVHNHAVXMNF-GFCCVEGCSA-N 320.370 2.943 5 40 DFBB CCOC(=O)C=Cc1ccc(Br)cc1[N+](=O)[O-] 1857793019 XRTBTPDPXPXTDW-UHFFFAOYSA-N 300.108 2.934 5 40 DFBB O=C1NC2(CCCCCC2)C(=O)N1Cc1ccc([N+](=O)[O-])cc1 3256890 OKOZNRXJYZFOCX-UHFFFAOYSA-N 317.345 2.740 5 40 DFBB Cc1cc(C)c(NC(=O)CSc2nnc(C)o2)c([N+](=O)[O-])c1 6201473 OFVZWWTTWIVPSV-UHFFFAOYSA-N 322.346 2.634 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 25214583 VDSMIJHLQUTLPI-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB C[C@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1cccs1 97236999 QNIUBBSMFJQFKT-SECBINFHSA-N 306.343 2.895 5 40 DFBB O=C(O)c1cc(Br)cc([N+](=O)[O-])c1Br 140299338 ZLXBCTDPBNEWRX-UHFFFAOYSA-N 324.912 2.818 5 40 DFBB COC(=O)c1cnn(-c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 12398224 LKKYWTWZRGEHPZ-UHFFFAOYSA-N 315.207 2.586 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1ncccn1 40047226 HEAYQPBJZNGEPQ-UHFFFAOYSA-N 318.358 2.814 5 40 DFBB O=C1NC(=O)/C(=C\c2cccn2-c2cccc([N+](=O)[O-])c2)S1 987371 OYJHFMMPTCRFCK-XYOKQWHBSA-N 315.310 2.709 5 40 DFBB CNc1snc(C)c1C(=O)OCc1ccccc1[N+](=O)[O-] 16551911 LVVVCFJPJFPDDN-UHFFFAOYSA-N 307.331 2.758 5 40 DFBB COc1ccc(C(=O)Nc2ccc([C@H](C)O)cc2)cc1[N+](=O)[O-] 226273546 WOJNLQQMNABJHT-JTQLQIEISA-N 316.313 2.909 5 40 DFBB COc1ccc(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 196352599 UMMRBPUWOHIQPN-UHFFFAOYSA-N 317.297 2.852 5 40 DFBB CS(=O)(=O)Cc1ccccc1NCc1cccc([N+](=O)[O-])c1 96427475 NRZXRJJLSIGVGU-UHFFFAOYSA-N 320.370 2.752 5 40 DFBB CC(=O)c1cccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 353837 MUEMPOMWDZTNBB-UHFFFAOYSA-N 310.265 2.598 5 40 DFBB O=C(OC[C@@H]1CCCO1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 29866314 JVPSNEBZXGPECW-LBPRGKRZSA-N 306.318 2.505 5 40 DFBB COc1ccc(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 72291393 LAHPKAGLQISQGK-UHFFFAOYSA-N 312.325 2.735 5 40 DFBB Cc1noc(/C=C/c2cccc(OCC(=O)O)c2)c1[N+](=O)[O-] 408602128 AOWSUFHZKOXPGN-AATRIKPKSA-N 304.258 2.525 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)c1c[nH]c2ccccc2c1=O 32643873 DBPABDCWYILUGQ-UHFFFAOYSA-N 309.281 2.689 5 40 DFBB CN(c1ccccc1)S(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 14021031 HQJWXBGOSLGJAI-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB Cc1ccc(OCC(=O)NCCC2=CCCCC2)c([N+](=O)[O-])n1 12645676 JYTWRZVUDAYJDL-UHFFFAOYSA-N 319.361 2.684 5 40 DFBB C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 65575247 RNFBYAKXZOPPRK-MRVPVSSYSA-N 320.326 2.876 5 40 DFBB O=C(c1ccc2nc3ccccc3c(=O)n2c1)c1ccccc1O 14187775 HAOVOAHFEJLSMZ-UHFFFAOYSA-N 316.316 2.784 5 40 DFBB O=[N+]([O-])c1ccc([C@@H](O)CNc2ncnc3sccc23)cc1 8147913 ZNKYVZZBNITIKH-LBPRGKRZSA-N 316.342 2.745 5 40 DFBB O=[N+]([O-])c1cccc(-c2ncn(CC3(O)CCCCC3)n2)c1 96435837 NCCYTFIKXDNIRS-UHFFFAOYSA-N 302.334 2.549 5 40 DFBB C[C@H](NC[C@@H](O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 6007601 YJRADHWTWDJRKO-XJKSGUPXSA-N 316.357 2.685 5 40 DFBB O=C(c1ccnc(Cl)c1)N1CCc2ccc([N+](=O)[O-])cc21 54758572 WAKMCPPZIBJUFL-UHFFFAOYSA-N 303.705 2.846 5 40 DFBB Cc1nn([C@H](C)C(=O)N[C@@H](C)[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1[N+](=O)[O-] 101617434 DQKCGZGIMIXYSB-RBQFQAMWSA-N 320.393 2.602 5 40 DFBB CCOc1cccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 10112196 HXSFWAZNHZWHIG-UHFFFAOYSA-N 322.342 2.794 5 40 DFBB CN(C)c1ccc(C(=O)Nc2ccccc2O)cc1[N+](=O)[O-] 9364381 DKFWXDVDXCODBN-UHFFFAOYSA-N 301.302 2.619 5 40 DFBB CN(CCn1cccn1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 97084144 JYHPGAQBHHNUBB-UHFFFAOYSA-N 323.740 2.609 5 40 DFBB N[C@H](Cc1ccccc1)c1n[nH]c(-c2ccccc2[N+](=O)[O-])n1 95534839 RHPUPHUTMGUYDV-CYBMUJFWSA-N 309.329 2.622 5 40 DFBB Cn1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 79368005 FVWMIJHNYHNNHY-UHFFFAOYSA-N 314.223 2.599 5 40 DFBB O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2cc3c(cc2[nH]1)OCCO3 13637800 YLIGDYQQZUVHEH-UHFFFAOYSA-N 324.292 2.875 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)NC1CCCCCC1 7202812 DOPKOHJSIQPYOX-NSHDSACASA-N 307.350 2.596 5 40 DFBB CC[C@@H]1CCCCN1c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 7736349 XMRSHCTUIDZUEB-LLVKDONJSA-N 312.391 2.767 5 40 DFBB CC(C)c1ccc(/C=C\c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)cc1 33458641 DYUKDMLWCXKOSP-YVMONPNESA-N 301.302 2.678 5 40 DFBB Cc1noc([C@@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])n1 42650927 XAKYKSZPTLSQAR-ZCFIWIBFSA-N 311.681 2.858 5 40 DFBB Cc1ccc(C(=O)Oc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 5577132 ZTWYSNIPKOVPOW-UHFFFAOYSA-N 301.254 2.851 5 40 DFBB O=C(c1cc2ccccc2o1)N1CCc2ncc([N+](=O)[O-])cc2C1 95992866 SNFCCVBHSMSSJH-UHFFFAOYSA-N 323.308 2.935 5 40 DFBB C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)Nc1ccccc1 96449978 DOUSMKAKZHFAAK-NSHDSACASA-N 315.329 2.531 5 40 DFBB CC(C)(C)OC(=O)N1CC[C@@]2(c3ccc([N+](=O)[O-])cc3)O[C@H]2C1 242522247 INXVAUGPWTYTKB-BBRMVZONSA-N 320.345 2.830 5 40 DFBB Cn1c(SC[C@@H]2CCCO2)nnc1-c1cccc([N+](=O)[O-])c1 1332924 VUWVECNQWVZJCZ-LBPRGKRZSA-N 320.374 2.661 5 40 DFBB O=C(c1ccccc1)c1cccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1 58426275 ZKKOQZSFINPJQN-HUUCEWRRSA-N 310.309 2.521 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C1CCCCC1 6639388 QFVNGDREAVRWBF-UHFFFAOYSA-N 321.377 2.806 5 40 DFBB Cc1c(NC(=O)[C@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] 8269950 KZXHNVBTFLNDBP-OAHLLOKOSA-N 314.297 2.682 5 40 DFBB CC(C)n1cc(NC(=O)NCCc2cccc([N+](=O)[O-])c2)cn1 89224429 LTEQGAYCDGKPME-UHFFFAOYSA-N 317.349 2.736 5 40 DFBB COC(=O)c1cc(C(=O)Nc2cccc(F)c2)cc([N+](=O)[O-])c1 60864 NYQHMEDRWMBSPQ-UHFFFAOYSA-N 318.260 2.773 5 40 DFBB Cc1cc(C(=O)/N=c2\cc[nH]n2[C@@H](C)C2CC2)ccc1[N+](=O)[O-] 105724860 KJWRHBQKXAWDJE-IRPICPOESA-N 314.345 2.745 5 40 DFBB Cc1ccc(SCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 12764564 IUZVJFUMPCSMCU-UHFFFAOYSA-N 305.359 2.753 5 40 DFBB O=[N+]([O-])c1ccccc1NC[C@@H](O)COc1ccc(F)cc1 57149212 XQOVTFDLHPJYBB-GFCCVEGCSA-N 306.293 2.586 5 40 DFBB Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cc(C(=O)O)c1O 20140844 DQODOMOFKYIBRB-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB CCn1ncc(CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c1C 6243812 UNGOKCKIWJIFPM-UHFFFAOYSA-N 319.390 2.606 5 40 DFBB O=[N+]([O-])c1c(Nc2ccc3c(c2)OCCO3)nc2ccccn12 9739953 OZRKLFTUVGMDSM-UHFFFAOYSA-N 312.285 2.757 5 40 DFBB COC(=O)c1ccsc1NC(=O)c1ccc([N+](=O)[O-])s1 4281353 RXXAODFUYOGAJE-UHFFFAOYSA-N 312.328 2.757 5 40 DFBB CC(=O)c1ccccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 73032748 ASSOPWVIBMAXBW-UHFFFAOYSA-N 312.325 2.770 5 40 DFBB O=[N+]([O-])c1ccc([C@@H]2C=C(c3ccccc3)Nc3nnnn32)cc1 101168835 WXYIPTCNSDOONK-HNNXBMFYSA-N 320.312 2.637 5 40 DFBB COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)c1 12729877 ZCFRIBKNTRHANR-OAHLLOKOSA-N 316.361 2.713 5 40 DFBB Cc1nccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)n1 97145744 LNAXLDZCWZZIKL-UHFFFAOYSA-N 315.333 2.632 5 40 DFBB CC1CCN(C(=O)c2cn[nH]c2-c2ccc([N+](=O)[O-])cc2)CC1 72328732 ZNSDSIZGORLDDW-UHFFFAOYSA-N 314.345 2.857 5 40 DFBB COc1ccc2[nH]nc(NC(=O)c3ccc([N+](=O)[O-])s3)c2c1 390835509 OWZFOKCODXXAAU-UHFFFAOYSA-N 318.314 2.794 5 40 DFBB CN(C(=S)NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 343152 ULVRJJRMXDBTFY-UHFFFAOYSA-N 315.354 2.746 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 3506566 GNTJSJYOXWIEMN-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB CCCCN(C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 23991616 VJUJXNRRKHILOQ-LLVKDONJSA-N 309.366 2.662 5 40 DFBB COc1cccc(C(=O)OCc2ccc([N+](=O)[O-])cc2)c1OC 3320113 KEXOCVZBYPZFDZ-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB CC(C)(C)c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n(C(C)(C)C)n1 66664558 LWGXPFVKYUFDGF-NXEZZACHSA-N 308.382 2.539 5 40 DFBB COC(=O)[C@@H](CC1CCCCC1)Nc1ncccc1[N+](=O)[O-] 20389711 WLPJQKWBQLOJER-GFCCVEGCSA-N 307.350 2.914 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccccc1 5128211 UPGQWWGMEFFDKR-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc([N+](=O)[O-])s1 4070842 MLLZDZUODBKUEA-UHFFFAOYSA-N 323.286 2.825 5 40 DFBB CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 25093502 SNUSMPYCSYOEEX-STQMWFEESA-N 308.382 2.512 5 40 DFBB CCN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H](C)c1cccnc1 97097440 HIDBVSZPRDPLRE-LLVKDONJSA-N 315.329 2.919 5 40 DFBB C[C@H]1CCCC[C@@]12NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C2=O 8943867 XHMJFJKYYHYPLV-MEDUHNTESA-N 317.345 2.596 5 40 DFBB COc1cc(OC)c(OC)cc1CNc1ncccc1[N+](=O)[O-] 22815455 ZYWNIBPDOSRUBL-UHFFFAOYSA-N 319.317 2.628 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CC[C@H](OCc2ccccn2)C1 84610118 AMJRUIDTBJAUPL-AWEZNQCLSA-N 317.320 2.924 5 40 DFBB COC[C@H](Cc1ccccc1)NC(=O)c1csc([N+](=O)[O-])c1 72309318 MNXTVJSYEAYCQQ-ZDUSSCGKSA-N 320.370 2.644 5 40 DFBB Cc1ccc(COc2cc(O)c(C(=O)O)cc2[N+](=O)[O-])cc1 216933366 ABPOTHLKTGBICR-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB CCc1ccc(OCCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 223373454 UVURWGPNSQWAFC-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB Cc1ccc(S(=O)(=O)NC2CCCCCC2)cc1[N+](=O)[O-] 5815048 ZMWIXHCXVPJMBS-UHFFFAOYSA-N 312.391 2.904 5 40 DFBB CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([N+](=O)[O-])cc1 4014288 JZWWZXWIUDOMQV-UHFFFAOYSA-N 316.273 2.797 5 40 DFBB CCOc1ccc(C(=O)COc2cccnc2[N+](=O)[O-])cc1 5970859 VKAMLACWFNSZEP-UHFFFAOYSA-N 302.286 2.650 5 40 DFBB O=[N+]([O-])c1c(NCCOc2ccccc2)nc2sccn12 8337011 AQGSGZJJVKIXDD-UHFFFAOYSA-N 304.331 2.795 5 40 DFBB C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1COc2ccccc2O1 36093459 AVLGWDQMJOYJQR-PXAZEXFGSA-N 314.341 2.913 5 40 DFBB COc1ccc([C@@H](O)[C@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 96485322 CINCMBUGBGAPPG-ZBEGNZNMSA-N 317.345 2.841 5 40 DFBB Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)cc1 3149529 KYEMGSVVAZJBLL-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB O=C(Nn1cnc2ccccc21)c1ccc([N+](=O)[O-])cc1Cl 12559437 HOJAGRHLBISHML-UHFFFAOYSA-N 316.704 2.982 5 40 DFBB CC(C)Oc1cccc([C@@H](O)CNc2ccncc2[N+](=O)[O-])c1 72286892 AJGFOJPGUHJCAP-INIZCTEOSA-N 317.345 2.923 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 65547514 INZLCRPVLPSQDZ-UHFFFAOYSA-N 303.245 2.774 5 40 DFBB Cc1ccc(OCC(=O)Nc2ccc(Cl)cc2)c([N+](=O)[O-])n1 9671161 PBLTZGOKLODIRG-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB O=C(NCc1cn2ccccc2n1)Nc1cccc([N+](=O)[O-])c1 18172453 FVITYUAWLCLLLF-UHFFFAOYSA-N 311.301 2.564 5 40 DFBB Cc1c(C(=O)NCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] 23142379 GBTJDMHZGSERQY-UHFFFAOYSA-N 318.304 2.851 5 40 DFBB O=[N+]([O-])c1cccc([C@@H]2C=C(c3ccccc3)Nc3nnnn32)c1 101038339 PFFMMLVDTRUIGI-HNNXBMFYSA-N 320.312 2.637 5 40 DFBB O=Cc1cccc[n+]1Cc1cccc2cc3cccc[n+]3cc12 1713777 KAAADOKNZMIHDL-UHFFFAOYSA-N 300.361 2.727 5 40 DFBB COc1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc(OC)c1 6509397 BKCJQTGGEIVKNO-UHFFFAOYSA-N 316.313 2.793 5 40 DFBB C[C@H]1CCCC[C@H]1NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 12739514 VOBDOXZUMVOMEG-SWLSCSKDSA-N 320.393 2.885 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CC[C@@H](OCc2ccccn2)C1 84610116 AMJRUIDTBJAUPL-CQSZACIVSA-N 317.320 2.924 5 40 DFBB Cc1ccccc1[C@@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C1CC1 79002068 NIVITJJEMBJYQG-ZDUSSCGKSA-N 314.345 2.816 5 40 DFBB O=C(NCc1ccc(F)cc1)NCc1ccccc1[N+](=O)[O-] 43025863 BABGRMIALRHERD-UHFFFAOYSA-N 303.293 2.733 5 40 DFBB C[C@@H](Nc1ccc2cc([N+](=O)[O-])ccc2n1)C(=O)NC(C)(C)C 72283342 RXRFRKFMYMKONG-SNVBAGLBSA-N 316.361 2.858 5 40 DFBB O=C(NCCNc1ccccc1[N+](=O)[O-])NC1CCCCC1 48302848 ROEHDHWBIZBWCX-UHFFFAOYSA-N 306.366 2.639 5 40 DFBB O=C(NC[C@H]1CCCO1)c1cccc2nc3ccccc3nc12 5444620 DDBOESJGMIPTQZ-GFCCVEGCSA-N 307.353 2.692 5 40 DFBB Cc1cc(C)cc(NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 10325409 PYNRYCKPWHIXCI-UHFFFAOYSA-N 313.313 2.789 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC(Cc2ccccc2)CC1 4728988 RRLHRRGYNYEFBN-UHFFFAOYSA-N 300.362 2.787 5 40 DFBB Nc1cccc([N+](=O)[O-])c1C(=O)N1CCc2cc(F)ccc2C1 97050775 IWYNRVJFCVFGBS-UHFFFAOYSA-N 315.304 2.515 5 40 DFBB O=[N+]([O-])c1ccccc1N1CCO[C@H](c2cccc(O)c2)C1 84506014 KERBQBIFMPQMSA-INIZCTEOSA-N 300.314 2.878 5 40 DFBB COc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 6285209 UYTNSPYHUIHYCU-UHFFFAOYSA-N 316.313 2.542 5 40 DFBB CCOc1cccc(NC[C@](C)(O)CSC)c1[N+](=O)[O-] 96011586 MDQGKNJRWCTNMY-ZDUSSCGKSA-N 300.380 2.519 5 40 DFBB CCCSCC(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 68103457 IMBSAOVELGLYPZ-UHFFFAOYSA-N 320.374 2.862 5 40 DFBB O=[N+]([O-])c1cc(Br)ccc1OC[C@H]1CCCNC1 42775696 UIGOMKCDUOMMMJ-VIFPVBQESA-N 315.167 2.736 5 40 DFBB COC(C)(C)C[C@H](C)NC(=O)NCc1cccc([N+](=O)[O-])c1 96439524 FFJAEGVDLCSKKF-NSHDSACASA-N 309.366 2.598 5 40 DFBB O=c1oc(-c2ccc([N+](=O)[O-])cc2)nc(O)c1Cc1ccccc1 19596962 OSCYYJYBPNRPPV-UHFFFAOYSA-N 324.292 2.906 5 40 DFBB C[N+]1(CC[C@@](O)(c2ccccc2)c2cccs2)CCOCC1 1842660 HJDYAOBDPZQHOD-GOSISDBHSA-N 318.462 2.851 5 40 DFBB in-man O=C(N[C@H]1CCN2CCCC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] 60740089 PCFVLLHMHNKALH-STQMWFEESA-N 323.780 2.605 5 40 DFBB CCc1ccc(NC(=O)N2CCC[C@@H]([C@H](C)O)C2)cc1[N+](=O)[O-] 95972425 FXVJNTGIFUMDQW-WCQYABFASA-N 321.377 2.782 5 40 DFBB COc1c([N+](=O)[O-])c(Cl)c([N+](=O)[O-])c(Cl)c1[N+](=O)[O-] 77291408 CNNAAYAAYYSHRV-UHFFFAOYSA-N 312.021 2.727 5 40 DFBB in-vitro O=C(NC1CC1)[C@@H]1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 50933561 SKFZHRHTRMAVDF-SNVBAGLBSA-N 323.780 2.743 5 40 DFBB O=C(NOCc1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 52952552 KOIQSTBRUGNBEE-UHFFFAOYSA-N 311.297 2.938 5 40 DFBB Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@@H]3C23CC3)c([N+](=O)[O-])c1 4155648 JBXTZRPOFLDERS-JLUCKKNBSA-N 324.336 2.605 5 40 DFBB O=C(Nc1cccc(F)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3151911 GXQOYOZYGRMBIW-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB Cc1ccc(OCCNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 8193928 VTSQLXDLEPGWOR-UHFFFAOYSA-N 314.341 2.641 5 40 DFBB CC(C)C(NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)C 20240026 NQQPHWYHSSAZHD-UHFFFAOYSA-N 309.322 2.913 5 40 DFBB COc1cccc(-c2cnc(Cn3nc([N+](=O)[O-])cc3C)o2)c1 225477404 MVUQSDAGFLZWFH-UHFFFAOYSA-N 314.301 2.812 5 40 DFBB COC(=O)[C@H]1CC[C@@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])C1 278594547 AGQZSANCUMPGMV-NWDGAFQWSA-N 306.318 2.551 5 40 DFBB C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Br)C[C@@H](C)O1 226300737 UIDXZCSPVXPLDP-RKDXNWHRSA-N 315.167 2.971 5 40 DFBB O=[N+]([O-])c1cccc(CN2CCN([C@@H]3C[C@H]4CC[C@@H]3C4)CC2)c1 4724429 LYSZMVOIADELTI-YXJHDRRASA-N 315.417 2.901 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1ccc(F)cc1 5120655 RQTDMLXBJJNJMJ-UHFFFAOYSA-N 324.333 2.521 5 40 DFBB COc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)c(OC)c1 5461784 OJYBNIADKPXPMQ-UHFFFAOYSA-N 308.315 2.926 5 40 DFBB CCOC(=O)C[C@@H](n1nc([N+](=O)[O-])cc1C1CC1)C(F)(F)F 675032194 UFNCBAWXUORGLQ-SECBINFHSA-N 321.255 2.725 5 40 DFBB O=C(O)c1cc(Br)cc(Br)c1[N+](=O)[O-] 2573852 OMBRWZUUZWYLAP-UHFFFAOYSA-N 324.912 2.818 5 40 DFBB CCc1ccc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc1 3322002 UALNDOXKMWXPHG-UHFFFAOYSA-N 302.334 2.609 5 40 DFBB COc1ccc([N+](=O)[O-])cc1COC(=O)c1c(C)noc1C 24222517 GYVXWUBOMAFWIG-UHFFFAOYSA-N 306.274 2.565 5 40 DFBB CSc1cccc(N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)c1 69434066 CKYIGCYINIEPQY-UHFFFAOYSA-N 320.374 2.566 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)C2CCCCC2)c1 95962367 UCFISEQQLQRMBV-OAHLLOKOSA-N 306.362 2.574 5 40 DFBB COc1cc(C=O)ccc1OC(=O)c1ccc([N+](=O)[O-])c(C)c1 3208657 KEHJEDWYLZSKRH-UHFFFAOYSA-N 315.281 2.944 5 40 DFBB C[C@H](OC(=O)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 2649412 PDONBOODSZOEOK-VIFPVBQESA-N 320.326 2.840 5 40 DFBB Cc1c(NC(=O)[C@@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] 8269946 KZXHNVBTFLNDBP-HNNXBMFYSA-N 314.297 2.682 5 40 DFBB Cc1ccc([S@](=O)c2ccc([N+](=O)[O-])c3nonc23)cc1 5339808 FRBRHPUZSWIODD-OAQYLSRUSA-N 303.299 2.606 5 40 DFBB O=C(Nc1ncnc2sccc12)c1cccc([N+](=O)[O-])c1 5299387 ZFHFNAHJXMATLM-UHFFFAOYSA-N 300.299 2.852 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1Cc1coc(-c2cccs2)n1 8988424 TUBZQAAFJAWKRP-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB Cc1cc(C)nc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 5935336 OEDPFRRFDQHJDZ-UHFFFAOYSA-N 316.273 2.767 5 40 DFBB CCOC(=O)COc1cc(O)c2c(=O)c3ccccc3oc2c1 8476747 MNDDVNNUUPBREF-UHFFFAOYSA-N 314.293 2.594 5 40 DFBB biogenic Cc1cc(NC(=O)[C@@H]2CCO[C@H]2C)c2cc([N+](=O)[O-])ccc2n1 97142438 QBAOMWNSAOIUPX-CMPLNLGQSA-N 315.329 2.815 5 40 DFBB O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(-n2ccnc2)c1 95961427 ZWUAUCMLZFDLKW-UHFFFAOYSA-N 322.324 2.962 5 40 DFBB COc1ccccc1[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 17971953 JCNRUBOYBSARIV-SNVBAGLBSA-N 316.313 2.800 5 40 DFBB C[C@@H]1[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CCC[C@H]1C 102430638 GCXCZOHOPBMYLM-AGIUHOORSA-N 306.362 2.915 5 40 DFBB CC[C@H](C)OC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1795152 GTAVDIQQBYWSBV-QMMMGPOBSA-N 314.319 2.937 5 40 DFBB O=C(Oc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCCC[C@H]21 245380389 YEIHKLUYLWIVOO-GDGBQDQQSA-N 306.274 2.845 5 40 DFBB COC(=O)c1ccc(C(=O)OC)c2nc3cc(C)ccc3nc12 5813564 ZDNKMDSEIJLOBG-UHFFFAOYSA-N 310.309 2.665 5 40 DFBB C[C@@H]1C[C@@H](C)CN(CCCNC(=O)c2cccc([N+](=O)[O-])c2)C1 13673832 FUGLVOLTNUAYMU-ZIAGYGMSSA-N 319.405 2.693 5 40 DFBB COc1ccccc1O[C@@H](C)CNc1ccc([N+](=O)[O-])nc1 78504453 HTUFJXZJQRPWOE-NSHDSACASA-N 303.318 2.878 5 40 DFBB Cc1ccc(C(=O)Nc2cccnc2-n2cccn2)cc1[N+](=O)[O-] 23171253 PXNXTJWCRIKZBC-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB COc1ccc(C)cc1CN(C)C(=O)c1ccc([N+](=O)[O-])o1 24324561 MIGHLUTYUCNGLR-UHFFFAOYSA-N 304.302 2.777 5 40 DFBB CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-] 44485652 NUZWTGPEDQCDGA-SJORKVTESA-N 310.353 2.977 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(N2CCCCCC2)c([N+](=O)[O-])c1 59417380 NCEBNZBEHVDCGN-UHFFFAOYSA-N 309.278 2.582 5 40 DFBB CN[C@H](COC(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 1710472 BDAIIJHUCROYRN-OAHLLOKOSA-N 306.362 2.920 5 40 DFBB Cc1ccc(OCC(=O)N[C@@H](C)c2ccco2)c([N+](=O)[O-])c1 8506311 KALXJSXDXBADPR-NSHDSACASA-N 304.302 2.752 5 40 DFBB COc1ccc([N+](=O)[O-])cc1O[C@H](C)C(=O)N1CCCCCC1 15395042 NQNHVFDPBYVNHW-GFCCVEGCSA-N 322.361 2.773 5 40 DFBB COc1ccc([C@H](CO)N(C)Cc2cccc([N+](=O)[O-])c2)cc1 83864181 VSZOOHGGOWLTJW-KRWDZBQOSA-N 316.357 2.769 5 40 DFBB O=C(Nc1nnc(-c2ccco2)s1)c1cccc([N+](=O)[O-])c1 17248577 IWRKDYHKPAPOIZ-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1c(C)noc1C 97097558 TWVWWCNIBJUJRT-GFCCVEGCSA-N 319.317 2.786 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCc1nc2ccccc2[nH]1 508271 WBAASOFAXBHLSF-CMDGGOBGSA-N 322.324 2.801 5 40 DFBB O=C(Nc1cc(-c2ccsc2)n[nH]1)c1ccc([N+](=O)[O-])cn1 95966659 RZXQKKQGVDWWPV-UHFFFAOYSA-N 315.314 2.694 5 40 DFBB O=C(O)c1cn(-c2ccc(F)cc2[N+](=O)[O-])nc1C(F)(F)F 575441600 ICJDPMDWTMSMCV-UHFFFAOYSA-N 319.170 2.637 5 40 DFBB Cc1ccccc1NC(=O)OCCn1c([N+](=O)[O-])cnc1C 31177 ZNJZAQAJOYCRNN-UHFFFAOYSA-N 304.306 2.657 5 40 DFBB O=C(CCc1ccccc1)COC(=O)c1ccc([N+](=O)[O-])cc1 1600768 ABMFNHAGXUTSHE-UHFFFAOYSA-N 313.309 2.954 5 40 DFBB Cc1cc(C)cc([C@H](C)NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1 71884451 MTVGMRLIQHCGLG-LBPRGKRZSA-N 316.361 2.594 5 40 DFBB CC1(C)CC(Nc2nc3ccccn3c2[N+](=O)[O-])CC(C)(C)N1 12629973 RKCCORBTLRBMJB-UHFFFAOYSA-N 317.393 2.964 5 40 DFBB Cc1cc(N(C)C[C@@H]2CCOC2)c2cc([N+](=O)[O-])ccc2n1 96008497 HFHYDEIJZUHVKS-LBPRGKRZSA-N 301.346 2.924 5 40 DFBB CC(C)(C)n1cc(NC(=O)Nc2ccncc2[N+](=O)[O-])cn1 97080911 NADSMUYOMCWDCL-UHFFFAOYSA-N 304.310 2.585 5 40 DFBB O=[N+]([O-])c1ccc(NCCc2csc(N3CCCC3)n2)nc1 78340385 IRLZBDCZLDAZBS-UHFFFAOYSA-N 319.390 2.701 5 40 DFBB O=C(O)c1cn(-c2ccc([N+](=O)[O-])cc2F)nc1C(F)F 575441567 VXLOXEUEYJTXDZ-UHFFFAOYSA-N 301.180 2.555 5 40 DFBB C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[C@H]2CC[C@H]1C2 104094315 HSQVKSGLOXCONI-ZPFDUUQYSA-N 303.362 2.732 5 40 DFBB Cc1nn(C)cc1COC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 2727099 CZTJJGAIUGEGBP-UHFFFAOYSA-N 309.709 2.647 5 40 DFBB O=C(OC[C@@H]1CCCO1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 25396883 KPEOXJUISDFEAL-ZDUSSCGKSA-N 320.345 2.531 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@H]2OCCC[C@H]2C1 97095523 PUOZPFAOJNSRAO-SMDDNHRTSA-N 324.764 2.889 5 40 DFBB O=[N+]([O-])c1ccc(NC(=S)NCc2ccc(F)cc2)nc1 13838303 VIAOTMUEFYXPRW-UHFFFAOYSA-N 306.322 2.616 5 40 DFBB CCN(c1ccncc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1C 152647119 WSTXRRTXVDYRGJ-UHFFFAOYSA-N 321.358 2.513 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)C=C1CCCC[C@@]1(N1CCOCC1)O2 19706885 FHAYFSMLDULMNT-QGZVFWFLSA-N 316.357 2.973 5 40 DFBB CNc1nc(Nc2ccc(C)c(Cl)c2)nc(N)c1[N+](=O)[O-] 4140238 XQQZFOLGPKGQRT-UHFFFAOYSA-N 308.729 2.714 5 40 DFBB Cc1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2Cl)c(=O)[nH]1 97047027 NQEDLXUYKPZWQE-UHFFFAOYSA-N 322.704 2.602 5 40 DFBB C=C(NC(=O)OC(C)(C)C)C(=O)OCc1ccc([N+](=O)[O-])cc1 140733191 TYXZKFKUZCKSRM-UHFFFAOYSA-N 322.317 2.676 5 40 DFBB O=C(c1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccccc2)C1 13012226 VNTFVVMPQSZSEV-MRXNPFEDSA-N 312.325 2.809 5 40 DFBB CN(C)CCNc1ccc(N)c2sc3ccccc3c(=O)c12 5386486 UGSXHXJSXPJTTF-UHFFFAOYSA-N 313.426 2.970 5 40 DFBB COc1cc(C(=O)Nc2cccc(C)n2)c([N+](=O)[O-])cc1OC 5571291 GRXYXNJCHSBVDZ-UHFFFAOYSA-N 317.301 2.568 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C 5786499 VRNLPPIGDIYAEJ-GXFFZTMASA-N 312.391 2.760 5 40 DFBB O=C(N=c1[nH]c2ccccc2[nH]1)c1cc([N+](=O)[O-])ccc1Cl 9716310 YDWMSHNGFHBIHC-UHFFFAOYSA-N 316.704 2.799 5 40 DFBB O=C(CCNc1ccccc1[N+](=O)[O-])NCCc1cccs1 11563637 JRCNQHSXPSFSSQ-UHFFFAOYSA-N 319.386 2.817 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCCc2occc21 12952513 WXECGQJNRHPAOQ-LLVKDONJSA-N 322.342 2.544 5 40 DFBB CC[C@H](CCO)CNc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 79075266 OEVMIKVKVZHZTM-HOSRBBHYSA-N 322.361 2.602 5 40 DFBB C[C@H]1c2cc(F)ccc2CCN1CCn1cc([N+](=O)[O-])cn1 89941494 QDRQLTCEVXHFRH-NSHDSACASA-N 304.325 2.550 5 40 DFBB CC1(C2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)OCCO1 96481010 ROEZNPUERCIECX-UHFFFAOYSA-N 310.325 2.713 5 40 DFBB O=[N+]([O-])c1ccc(CSc2cnn[nH]2)c(Br)c1 130955574 CFBQOJPZDCUPSO-UHFFFAOYSA-N 315.152 2.768 5 40 DFBB COc1cccc(CNc2ccc([N+](=O)[O-])cc2C(=O)O)c1 220524817 WSZWKTGBQPROEI-UHFFFAOYSA-N 302.286 2.914 5 40 DFBB S=C(Nc1cc2cccnc2c2ncccc12)N1CCOCC1 408977220 VZILZWSOWIFCAY-UHFFFAOYSA-N 324.409 2.812 5 40 DFBB O=[N+]([O-])c1ccc(N(CCO)Cc2cccnc2)c2ncccc12 79022786 XPTYFNCUBOZTFT-UHFFFAOYSA-N 324.340 2.537 5 40 DFBB Cc1cc(-c2nnc(CN3CCCCC3)o2)ccc1[N+](=O)[O-] 4336056 VBSVETDPJKYPCJ-UHFFFAOYSA-N 302.334 2.939 5 40 DFBB CC(C)Cn1ccc2cc(NC(=O)[C@H]3C[C@@H]3[N+](=O)[O-])ccc21 84575376 BMQRJUMQBRKSFM-ZFWWWQNUSA-N 301.346 2.901 5 40 DFBB O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ncc([N+](=O)[O-])s1 5417403 MIGGXRLGNLZDAR-AATRIKPKSA-N 320.286 2.611 5 40 DFBB O=C(CCc1cccc([N+](=O)[O-])c1)N1CCOc2ccccc21 87099243 ZRVMMBSIROXLMF-UHFFFAOYSA-N 312.325 2.953 5 40 DFBB COc1ccccc1O[C@H](Cc1cccc([N+](=O)[O-])c1)C(=O)O 225126133 COGVUJDYFLWJHO-OAHLLOKOSA-N 317.297 2.678 5 40 DFBB CCOC(=O)c1nc2ccccc2c2nc3ccccc3c(=O)n12 223813135 NTOVMAQFDXGQBG-UHFFFAOYSA-N 319.320 2.573 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N(C)Cc1ccc([S@](C)=O)cc1 96453903 NMKVZBVFDZYHFW-JOCHJYFZSA-N 319.386 2.672 5 40 DFBB COc1cc(CNc2ccc([N+](=O)[O-])cn2)cc(OC)c1OC 19309454 QWNRGYILTJJEIK-UHFFFAOYSA-N 319.317 2.628 5 40 DFBB biogenic,in-vitro Cc1ccn2cc(CCNC(=O)c3ccc([N+](=O)[O-])cc3)nc2c1 4248441 CFAUPNIOFJBRCZ-UHFFFAOYSA-N 324.340 2.523 5 40 DFBB CC[N+](C)(C)CCOC(=O)[C@@](O)(c1ccccc1)C1CCCC1 5955191 ZKEUIGZJPBJVCK-LJQANCHMSA-N 320.453 2.704 5 40 DFBB C[C@@H](c1nc(Cc2ccc(F)cc2)no1)n1cc([N+](=O)[O-])cn1 97048017 MQGBCULGVLICMW-VIFPVBQESA-N 317.280 2.514 5 40 DFBB O=[N+]([O-])c1ccc2ncnc(NCCc3nccs3)c2c1 81589959 NVMSGEXSZGDXKD-UHFFFAOYSA-N 301.331 2.649 5 40 DFBB Cn1cc(C=O)c2nc3cc(C(F)(F)F)ccc3cc2c1=O 8861663 HUDWWWMEFMFYQO-UHFFFAOYSA-N 306.243 2.918 5 40 DFBB Cc1cc(F)ccc1S(=O)(=O)Nc1cccc([N+](=O)[O-])c1 43767372 KCQMDLDXLXBWLA-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB CCOc1ccc(C(=O)OCc2c(C)noc2C)cc1[N+](=O)[O-] 32516201 OPGPWFZLNQLXNA-UHFFFAOYSA-N 320.301 2.955 5 40 DFBB COc1cc(NC(=O)CN2CCCC[C@@H]2C)c(C)cc1[N+](=O)[O-] 7486592 GSAWCAVIHFXXOC-LBPRGKRZSA-N 321.377 2.725 5 40 DFBB NC(=O)c1ccc(NCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 5832517 OWLCWKKFYMLQLT-UHFFFAOYSA-N 305.721 2.959 5 40 DFBB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc([N+](=O)[O-])c1 9667444 RUNXNYLXDLFKJZ-LLVKDONJSA-N 318.354 2.735 5 40 DFBB O=C(N[C@@H](c1nccs1)C1CC1)c1cccc([N+](=O)[O-])c1O 96481522 HRQDWWLRRKHUID-LLVKDONJSA-N 319.342 2.638 5 40 DFBB O=C(COc1cc([N+](=O)[O-])ccc1Cl)NCc1ccco1 96447828 AGZMCSHASAHJON-UHFFFAOYSA-N 310.693 2.536 5 40 DFBB CC(C)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCCCC1 32841244 AVVQCANXIXRVCK-UHFFFAOYSA-N 320.393 2.981 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]2CC[C@H]1C2 104863422 XTLHJSZKNPFOPV-HUBLWGQQSA-N 303.362 2.559 5 40 DFBB Cc1ccc(OCC(=O)Nc2ccc(C)c(F)c2)c([N+](=O)[O-])n1 9119450 SWKHEOHUFIMFOD-UHFFFAOYSA-N 319.292 2.763 5 40 DFBB CC(C)=CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4870738 MESRBRSCRQAIKV-UHFFFAOYSA-N 312.709 2.696 5 40 DFBB CSc1nc(N)c(C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 5493068 GEIOINRAOZYYMJ-UHFFFAOYSA-N 310.360 2.608 5 40 DFBB COc1ccc(CCNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 5917089 TWJCGHSHWTVCAX-UHFFFAOYSA-N 314.341 2.505 5 40 DFBB Cc1ccc(C)c(NC(=O)COc2ccc(C)nc2[N+](=O)[O-])c1 9130936 AYCHMIRGNOLKSW-UHFFFAOYSA-N 315.329 2.933 5 40 DFBB COc1c(CNc2ncc([N+](=O)[O-])s2)oc2ccccc12 330032386 MKOLYYAHAJWWSY-UHFFFAOYSA-N 305.315 3.418 5 40 DFBB CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1nc(C)n[nH]1 75092627 HEYCSWCANWGHTB-NSHDSACASA-N 323.740 2.556 5 40 DFBB CCCNC(=O)Nc1cccc(Oc2c([N+](=O)[O-])ncn2C)c1 65585777 ZHAVNFJJFFDGFO-UHFFFAOYSA-N 319.321 2.652 5 40 DFBB COc1ccc(C(=O)OCc2scnc2C)cc1[N+](=O)[O-] 72280762 HGZOATMNJKVKCF-UHFFFAOYSA-N 308.315 2.725 5 40 DFBB CN(Cc1cnn(C)c1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 24585682 MBGFPSFTKHRSNT-UHFFFAOYSA-N 314.267 2.984 5 40 DFBB C[C@H](Oc1ccccc1)C(=O)NCc1ccc([N+](=O)[O-])cc1 55797976 UDHQGVWLSFUOFZ-LBPRGKRZSA-N 300.314 2.679 5 40 DFBB O=C(O[C@H]1[C@H]2CC[C@@H]2[C@H]2C[C@H]12)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 103904584 MRHJYWPULMAEJR-HPCHECBXSA-N 318.285 2.704 5 40 DFBB COc1cc([C@H]2NC[C@H](c3ccc([N+](=O)[O-])cc3)O2)ccc1O 19643018 MGHHNWNXFHDEBT-CVEARBPZSA-N 316.313 2.669 5 40 DFBB CC(C)(NC(=O)CC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 79630665 VMFPFRZTZJMQCF-CQSZACIVSA-N 306.362 2.905 5 40 DFBB O=[N+]([O-])c1ccccc1N1CCN[C@H](c2ccc(F)cc2)C1 35572393 BQKXNYJJHVVFJC-AWEZNQCLSA-N 301.321 2.885 5 40 DFBB COc1ccccc1C1=N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1 297242 QWIWCGCBBCUOEV-GXDHUFHOSA-N 324.292 2.948 5 40 DFBB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 6315600 JNNHYXIFAVSLFA-LLVKDONJSA-N 318.354 2.735 5 40 DFBB C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 36093461 AVLGWDQMJOYJQR-SJKOYZFVSA-N 314.341 2.913 5 40 DFBB Cc1c(C2CC2)n[nH]c1NC(=O)COc1cccc([N+](=O)[O-])c1 58216549 VWJGWVNJGAYQNR-UHFFFAOYSA-N 316.317 2.521 5 40 DFBB CCN(c1cccc(F)c1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 55663176 QNPCSZJEPNUAGH-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB O=C(N[C@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1O 96012352 RBPCODPSXQVBIZ-AWEZNQCLSA-N 316.288 2.857 5 40 DFBB COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 9338523 ILNIBNBRSDEANQ-JTQLQIEISA-N 301.302 2.950 5 40 DFBB CC(C)c1nnc(CNc2ncc(Cl)cc2[N+](=O)[O-])n1C 95997048 CQHFXRRRWWQYSS-UHFFFAOYSA-N 310.745 2.507 5 40 DFBB CC[C@@](C)(CCO)NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145826 NWADUZOJAGKLRG-HNNXBMFYSA-N 309.366 2.884 5 40 DFBB CC(C)(C)c1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])[nH]n1 58137768 GEHYZTOZHKFKJP-UHFFFAOYSA-N 302.334 2.797 5 40 DFBB C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 2356728 VEKBPVWDPZSHHF-JTQLQIEISA-N 310.313 2.962 5 40 DFBB Cc1cc(C)c(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c(C)c1 72332092 FWPOVJGOIZNJHZ-UHFFFAOYSA-N 302.334 2.664 5 40 DFBB O=C(C[S@@](=O)c1ccccc1[N+](=O)[O-])OC1CCCCC1 6182965 ZKLQUAVOTDHGKM-NRFANRHFSA-N 311.359 2.578 5 40 DFBB Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(Cl)cc1 13207472 NMXSQMILUARPIL-UHFFFAOYSA-N 309.709 2.610 5 40 DFBB CCOC(=O)C1=C(C)O[C@H]([N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 100783332 YTFFDIORXYPXAC-OLZOCXBDSA-N 311.721 2.894 5 40 DFBB CC(C)(Nc1ccc(Br)cc1[N+](=O)[O-])C(=O)O 40911198 ORHKPTVTFPKWSQ-UHFFFAOYSA-N 303.112 2.632 5 40 DFBB in-vitro CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(Cl)ccn1 32816873 QEJBWLNYUKACSY-UHFFFAOYSA-N 305.721 2.915 5 40 DFBB O=C(Nc1ccc(C(=O)O)c(Cl)c1)c1ccc([N+](=O)[O-])o1 20139735 YBQSVIKHQLVENU-UHFFFAOYSA-N 310.649 2.792 5 40 DFBB CCOC(=O)N1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 25281718 BNDINIHJHYGTPU-UHFFFAOYSA-N 311.313 2.767 5 40 DFBB CCc1ccc(-c2nn3c(O)nc4ccccc4c3nc2=O)cc1 71924135 BNUFXBQJCFCIOH-UHFFFAOYSA-N 318.336 2.573 5 40 DFBB CCc1cnccc1C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] 97109330 GKZLICHJDJITQP-UHFFFAOYSA-N 301.302 2.813 5 40 DFBB COc1cccc(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)c1 332886 SHLKVQBPUBMAGS-UHFFFAOYSA-N 315.281 2.643 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1NC[C@@H]([C@@H]1CCOC1)N1CCCC1 44976802 APHADQOHQAZUCW-WBMJQRKESA-N 323.368 2.647 5 40 DFBB CN(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C1CCCC1 48340495 XWXXEWLZZVSTTD-UHFFFAOYSA-N 301.350 2.685 5 40 DFBB Cc1csc(Nc2ccc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2)n1 69896439 AXPURAYRSAHXRO-VXGBXAGGSA-N 318.358 2.799 5 40 DFBB COc1ccc(C(=O)Nc2cccc3[nH]cnc23)cc1[N+](=O)[O-] 72288816 GMINUGYVKCHHHU-UHFFFAOYSA-N 312.285 2.732 5 40 DFBB Cc1cc(C(=O)COC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1C 5044551 LCEHPWCIXGDHSD-UHFFFAOYSA-N 316.313 2.590 5 40 DFBB CCOC(=O)c1ccc([C@H](O)c2ccccc2)c([N+](=O)[O-])c1 21990617 JIOSDTQFIXMHSE-OAHLLOKOSA-N 301.298 2.853 5 40 DFBB Cc1nn(Cc2cc(Cl)cc3c2OCOC3)c(C)c1[N+](=O)[O-] 6112073 HCSKNGKVSQJFSP-UHFFFAOYSA-N 323.736 2.976 5 40 DFBB CCS[C@@H]1CCC[C@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 96450522 QJRKUDCDUGJPTC-DGCLKSJQSA-N 309.391 2.581 5 40 DFBB Cc1cc(N2CCC(CC(N)=O)CC2)c(Cl)cc1[N+](=O)[O-] 80576564 NBMDAZBBZXJQHP-UHFFFAOYSA-N 311.769 2.648 5 40 DFBB CS[C@@H](CO)[C@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 76018804 AWYARWFRDJVTSH-XPTSAGLGSA-N 307.375 2.667 5 40 DFBB COc1cccc(CCCNC(=O)c2ccc([N+](=O)[O-])cc2)c1 13670221 HWWRFDUIPUHNSE-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB O=C(Nc1ccon1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 4868581 GMROWGUIVLEKNK-UHFFFAOYSA-N 316.317 2.825 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]2C1=O)C31CC1 100046102 XTOIUIXMPLPZLM-NZBPQXDJSA-N 324.336 2.605 5 40 DFBB CSc1ccccc1NC(=O)CCn1cnc([N+](=O)[O-])c1 24433256 MHWODLVPQDVDEU-UHFFFAOYSA-N 306.347 2.542 5 40 DFBB O=c1cc(CSc2ccc([N+](=O)[O-])cc2)nc2sccn12 3355912 TVXNFZJYMMOEAL-UHFFFAOYSA-N 319.367 2.957 5 40 DFBB Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)Nc1ccc(F)cc1F 2787800 DPELOBYKFUCGIU-MRVPVSSYSA-N 324.287 2.653 5 40 DFBB Cn1/c(=N\C(=O)c2cccs2)sc2cc([N+](=O)[O-])ccc21 8642728 DKCVNWKMWXNBCY-BUHFOSPRSA-N 319.367 2.951 5 40 DFBB CS[C@@H](CO)[C@@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 76018806 AWYARWFRDJVTSH-OTYXRUKQSA-N 307.375 2.667 5 40 DFBB COC(=O)[C@H](c1ccc([N+](=O)[O-])cc1)c1ccccc1OC 169800230 OPWMTBCPZYGTGN-OAHLLOKOSA-N 301.298 2.908 5 40 DFBB O=C(O)/C(=C/c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 1716380 QMXRAGWVFVHMHK-KPKJPENVSA-N 313.265 2.949 5 40 DFBB CC[C@@H]1CCCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 30144050 AHGWJGRNVVUBRH-CYBMUJFWSA-N 317.389 2.606 5 40 DFBB C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[C@H]2CC[C@H]1C2 104094329 HSQVKSGLOXCONI-MPPDQPJWSA-N 303.362 2.732 5 40 DFBB O=C(O)c1cc(Nc2ccccc2)c([N+](=O)[O-])cc1C(=O)O 4798256 FVJBRBSYICZDQX-UHFFFAOYSA-N 302.242 2.735 5 40 DFBB C[C@H]1CCC[C@@H](C)N1C[C@H](O)COc1ccccc1[N+](=O)[O-] 8241015 PKJOQFCLAGSZLV-MJBXVCDLSA-N 308.378 2.597 5 40 DFBB O=C(O)C1=NN(c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 71979120 WWXPRKHOMXCVGH-OAHLLOKOSA-N 311.297 2.987 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)c1cc2ccccc2c(=O)[nH]1 60739953 DYVVTIDDAORGDT-UHFFFAOYSA-N 309.281 2.689 5 40 DFBB O=C(c1ccncc1)N1C(=O)c2cccc3c([N+](=O)[O-])ccc1c23 11691544 VGFMOLBRTSSUAP-UHFFFAOYSA-N 319.276 2.944 5 40 DFBB Cc1cc(SC(=O)c2cccc([N+](=O)[O-])c2)nc(S)n1 16283628 KEOCCBSHSLLYEP-UHFFFAOYSA-N 307.356 2.914 5 40 DFBB O=C(NOCCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 4318212 BTZWXJJKTSFJFK-UHFFFAOYSA-N 301.302 2.891 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)C(=O)NC1CCCCCC1 10327819 IOLBKICCOHQKPY-UHFFFAOYSA-N 319.361 2.681 5 40 DFBB O=C(O)[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 3864754 OCAPOQDIRKGNKV-QMMMGPOBSA-N 318.251 2.915 5 40 DFBB Cc1cc([N+](=O)[O-])sc1N1CCN(c2ccccc2O)CC1 66446529 AKBIEJASOGJNKQ-UHFFFAOYSA-N 319.386 2.997 5 40 DFBB CCn1ccc(=O)nc1SCc1c(F)cccc1[N+](=O)[O-] 69529934 CEDAZVGACSNYSX-UHFFFAOYSA-N 309.322 2.603 5 40 DFBB Cc1c(C(=O)NCCN(C)C2CCCC2)cccc1[N+](=O)[O-] 69560531 WZARENCSWYRCTM-UHFFFAOYSA-N 305.378 2.507 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H](CCO)c1cccs1 72294029 NVZBSIXSRYPLER-LBPRGKRZSA-N 321.358 2.902 5 40 DFBB CO[C@@H]1CCC[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145844 RANGKTILZDMNRL-SMDDNHRTSA-N 307.350 2.901 5 40 DFBB CCOc1cc(CS(=O)(=O)c2ccccc2)ccc1[N+](=O)[O-] 390835519 PFAMZSYCJCTACM-UHFFFAOYSA-N 321.354 2.967 5 40 DFBB COC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 5541221 JSNSBVSNAVHJIS-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB Cc1ccc(CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 14737408 JYKFMNNRPZYTAB-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB O=C1NC(c2cccc([N+](=O)[O-])c2)=N/C1=C\c1ccccc1F 5583323 KFIYKOXBHOYQSB-ZROIWOOFSA-N 311.272 2.651 5 40 DFBB O=C1NCCCC[C@H]1Sc1nc2ccc([N+](=O)[O-])cc2s1 11075374 USCGGNIQELCAEV-SNVBAGLBSA-N 323.399 2.965 5 40 DFBB CNC(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 9314898 ZGNCYGPQPIONEC-UHFFFAOYSA-N 313.313 2.515 5 40 DFBB Cc1ccc(C(=O)N(C)Cc2c(C)noc2C)cc1[N+](=O)[O-] 46406320 GDKLSFIVUAGBDR-UHFFFAOYSA-N 303.318 2.780 5 40 DFBB CO[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccccc1 69517488 DZVGCUIOCUGSEP-OAHLLOKOSA-N 318.304 2.851 5 40 DFBB COc1ccc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] 97083132 LOKOMLZLRXYNDF-GHMZBOCLSA-N 305.334 2.867 5 40 DFBB O=C(O)/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 1569684 ZZFKPNPIOBGWHW-SDQBBNPISA-N 313.265 2.949 5 40 DFBB O=C1CCCN1CCc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 30447757 OEWADDGDZBNPDE-UHFFFAOYSA-N 317.370 2.883 5 40 DFBB O=c1c2ccccc2c(O)nn1-c1cc(Cl)ccc1[N+](=O)[O-] 561778 ZFWHXWYDPSVECB-UHFFFAOYSA-N 317.688 2.653 5 40 DFBB CS(=O)(=O)c1cc(C(F)(F)F)cc([N+](=O)[O-])c1Cl 1683105 XFNGWOWMYAHAFP-UHFFFAOYSA-N 303.645 2.671 5 40 DFBB Cc1ccc(C(=O)OCC(=O)NC2CCCCC2)cc1[N+](=O)[O-] 3387480 RGPAYVHUTYXZDK-UHFFFAOYSA-N 320.345 2.509 5 40 DFBB COc1cc(C(=O)Nc2ccccc2O)c([N+](=O)[O-])cc1OC 58356974 DQJGEBZPQFTOKB-UHFFFAOYSA-N 318.285 2.570 5 40 DFBB CC[N+](C)(CC)CCC[C@H](C)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 104377569 YXUAYPZTVHXYSJ-JYJNAYRXSA-N 309.474 2.817 5 40 DFBB O=[N+]([O-])c1c(NCc2cn3ccccc3n2)nc2sccn12 9156844 IJCHULFDSROIIO-UHFFFAOYSA-N 314.330 2.564 5 40 DFBB CS(=O)(=O)c1ccc(CCNc2ccc([N+](=O)[O-])cc2)cc1 76064078 SBLCIQSLMZDIPB-UHFFFAOYSA-N 320.370 2.653 5 40 DFBB O=[N+]([O-])c1cnn(C[C@H](O)CSc2ccc(Cl)cc2)c1 76082242 AMQWWVACQLXLMZ-NSHDSACASA-N 313.766 2.598 5 40 DFBB CCc1ccc(NC(=O)NC[C@@H](C)C[C@@H](C)O)cc1[N+](=O)[O-] 77677195 LNMQDWHKWGWECS-WDEREUQCSA-N 309.366 2.686 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccc([N+](=O)[O-])cc1Cl 5394773 KNPCXCJDNOTUDV-UHFFFAOYSA-N 322.664 2.804 5 40 DFBB Cc1cc(C(=O)Nc2ncc([N+](=O)[O-])s2)ccc1[N+](=O)[O-] 4141651 BDONMFHWEYSYGF-UHFFFAOYSA-N 308.275 2.520 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCC(C)CC2)c([N+](=O)[O-])c1 26508833 PSENJCKBKLZGTM-UHFFFAOYSA-N 323.305 2.526 5 40 DFBB Cc1nc2nc(Sc3ccncc3[N+](=O)[O-])nn2c(C)c1C 66809954 PVXNBHLUSNHYCV-UHFFFAOYSA-N 316.346 2.504 5 40 DFBB C[C@@](O)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccsc1 72294030 PRTODUJIEPZMAZ-CQSZACIVSA-N 321.358 2.686 5 40 DFBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1ccc(C(=O)O)cc1 3194255 UCYXMSKZNCHRLI-RUDMXATFSA-N 312.281 2.945 5 40 DFBB O=C(COC(=O)C1CCCCC1)Nc1cc([N+](=O)[O-])ccc1F 3320917 VYQIPBGWKATTOI-UHFFFAOYSA-N 324.308 2.796 5 40 DFBB CCc1ccc(NC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)cc1[N+](=O)[O-] 110680961 OYHLJJVBEQLGMZ-YRGRVCCFSA-N 305.334 2.599 5 40 DFBB CC[C@](C)(CCO)NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145828 NWADUZOJAGKLRG-OAHLLOKOSA-N 309.366 2.884 5 40 DFBB CCC(CC)(CNC(=O)c1ccc([N+](=O)[O-])cc1C)C(=O)O 95972852 LSKZFUPYNCXWHZ-UHFFFAOYSA-N 308.334 2.524 5 40 DFBB Cc1cc(NC(=O)N2CC[C@H]3OCCC[C@H]3C2)ccc1[N+](=O)[O-] 97095984 GJCOYWCVWGYGKW-SWLSCSKDSA-N 319.361 2.936 5 40 DFBB CC(C)(C)c1ccc(C(=O)NC2=NCCS2)cc1[N+](=O)[O-] 8774383 DUDAEAYXTACQQJ-UHFFFAOYSA-N 307.375 2.725 5 40 DFBB Cn1c(Cl)cnc1COC(=O)/C=C/c1ccccc1[N+](=O)[O-] 11148795 MOZLUXSWMVJFGY-VOTSOKGWSA-N 321.720 2.738 5 40 DFBB O=C(CSc1ncccn1)Nc1ccc(Cl)c([N+](=O)[O-])c1 3466671 MFZWGDBPRYAHIT-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB O=C(CCNc1ccccc1[N+](=O)[O-])N1CCc2ccccc21 14814452 GLEFFYGCAZZZQM-UHFFFAOYSA-N 311.341 2.986 5 40 DFBB CCOC(=O)c1ccc(N(CC)C(=O)OCC)c([N+](=O)[O-])c1 4928578 QVFCBHJJKPMKCI-UHFFFAOYSA-N 310.306 2.754 5 40 DFBB O=C(Nc1nnc(-c2ccc([N+](=O)[O-])cc2)s1)C(F)(F)F 408710502 XCPJCIRAEKTYST-UHFFFAOYSA-N 318.236 2.614 5 40 DFBB Cc1ccc(-c2csc(CN3CCOCC3)n2)cc1[N+](=O)[O-] 78823039 RWYAJCRLLMRUBM-UHFFFAOYSA-N 319.386 2.859 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cc1 571629 STQICQHWPGCOBW-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB OCc1cc(CO)c2ccc3c(CO)cc(CO)c4ccc1c2c43 1857793079 DJMLWWMSCHAGPL-UHFFFAOYSA-N 322.360 2.553 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 3383707 HKHKETKFAOBKGG-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB Cc1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 42118166 INFJZNUVSRLTSK-UHFFFAOYSA-N 311.750 2.943 5 40 DFBB C[C@H](O)C[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 139634292 BACPTLQCQOAGTM-GXSJLCMTSA-N 312.753 2.624 5 40 DFBB CCS[C@@H]1CCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 96450536 WHEOKYDBGOPOKL-ZIAGYGMSSA-N 308.403 2.928 5 40 DFBB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 6828720 RJVVQUURVYDMTH-ZJUUUORDSA-N 324.720 2.854 5 40 DFBB CN(C)c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cn1 22396388 VSTCPULIBFTMTE-UHFFFAOYSA-N 320.736 2.962 5 40 DFBB COC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1 3123139 HMXVDNOGULOYGE-UHFFFAOYSA-N 301.254 2.601 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1nnc(C2CC2)s1 33761082 TVKNTBMMEGOFRM-FPYGCLRLSA-N 316.342 2.976 5 40 DFBB O=C(NC1CCCCC1)c1ccc2nc3ccccc3c(=O)n2c1 57477658 NRZLXNOLTGSIHH-UHFFFAOYSA-N 321.380 2.910 5 40 DFBB O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1[N+](=O)[O-] 2131802 UKYBPUKCPILCOY-UHFFFAOYSA-N 305.221 2.894 5 40 DFBB CO[C@@H]1CCC[C@H]1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 97145842 RANGKTILZDMNRL-BXUZGUMPSA-N 307.350 2.901 5 40 DFBB N[C@@H](Cc1ccccc1)c1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 95534832 PELAPVHVRSZGGE-AWEZNQCLSA-N 309.329 2.622 5 40 DFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1C=C[C@H]2C1 100556100 ZNGVWFJIYHCABA-XMUKKISLSA-N 318.716 2.560 5 40 DFBB O=c1c2ccc(Cl)cc2nc(-c2ccc([N+](=O)[O-])cc2)n1O 1401796 BGVCMWMQKJAGHT-UHFFFAOYSA-N 317.688 2.862 5 40 DFBB CSc1nc2oc3ccccc3c(=O)c2c(=O)n1C(C)C 5428407 KWWZLGUGEVMNPJ-UHFFFAOYSA-N 302.355 2.806 5 40 DFBB COc1ccccc1CN(C)C(=O)Cc1ccccc1[N+](=O)[O-] 18076278 JTYXLROAILIWOE-UHFFFAOYSA-N 314.341 2.805 5 40 DFBB COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(C)c1 23038395 CBHGGLLLZGGXPW-UHFFFAOYSA-N 300.314 2.842 5 40 DFBB C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(S(C)(=O)=O)cc1 36785937 NZUSTFDQTZIQTJ-SNVBAGLBSA-N 321.358 2.566 5 40 DFBB Cc1noc(C)c1CCC(=O)OCc1ccc([N+](=O)[O-])cc1 12792617 XUFYRTLCYAUGGN-UHFFFAOYSA-N 304.302 2.876 5 40 DFBB CN(C(=O)CSc1ccccc1[N+](=O)[O-])c1ncccc1F 96501965 VGTCCCSWLRHYOJ-UHFFFAOYSA-N 321.333 2.884 5 40 DFBB CCn1ccc2ccc(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])cc21 96437180 GVVULKQIJPTKBS-UHFFFAOYSA-N 313.317 2.853 5 40 DFBB C[N@+]12CCCC[C@H]1[C@@H](COC(=O)c1ccccc1O)CCC2 247695428 ZOEVRBRMARFYMK-SIXWZSSISA-O 304.410 2.958 5 40 DFBB biogenic,in-vitro O=[N+]([O-])c1c(N2CCC[C@@H]2c2cccnc2)nc2ccccn12 21760185 UBWSGCULSUHZID-CYBMUJFWSA-N 309.329 2.979 5 40 DFBB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)Nc1ccccc1[N+](=O)[O-])OC2=O 100261103 XXWHHFVELSAZAJ-HOTGVXAUSA-N 318.329 2.655 5 40 DFBB O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc3c(c2)CCC3)c1 6919713 KRTYNFOCOLGVDC-UHFFFAOYSA-N 318.354 2.884 5 40 DFBB Cc1nnc(SC[C@H](O)c2ccc([N+](=O)[O-])cc2)n1C1CC1 97035083 LGMZBJRPEKJUBV-ZDUSSCGKSA-N 320.374 2.655 5 40 DFBB CC1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 25912743 PKDOFNUTXVYCFD-UHFFFAOYSA-N 302.334 2.877 5 40 DFBB O=[N+]([O-])c1cn(C[C@H](O)C2CCCCC2)nc1-c1ccncc1 191350292 WFIMKSUIHKLMAC-HNNXBMFYSA-N 316.361 2.795 5 40 DFBB COc1ccccc1[C@H](C)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] 9884254 GNBYDIQBMUMJNQ-JTQLQIEISA-N 315.329 2.875 5 40 DFBB Cc1ccc(C(=O)O)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 12030691 BSUSOHXVRUFKQX-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB CC(=O)Nc1cc([N+](=O)[O-])ccc1C[C@@H](O)c1ccccc1 1729114 RCLULDDTHVAVPE-MRXNPFEDSA-N 300.314 2.829 5 40 DFBB CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 7248956 XWUUZOIBQAJQSF-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB CCCCN(C)C(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408534228 UIKMIJKMCKSHPM-UHFFFAOYSA-N 314.345 2.924 5 40 DFBB CCC(C)(C)NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 69559411 NTWXLKCDRURMQZ-UHFFFAOYSA-N 316.361 2.763 5 40 DFBB Cc1nc(NCc2cc(C(F)(F)F)on2)ccc1[N+](=O)[O-] 521395075 DKYKJBVBFALDOZ-UHFFFAOYSA-N 302.212 2.917 5 40 DFBB CNc1ccc(CNCc2cn3ccsc3n2)cc1[N+](=O)[O-] 78394157 SNIGXAOYGPFKPR-UHFFFAOYSA-N 317.374 2.636 5 40 DFBB CCc1nnc(S/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O)o1 214860403 AALQRAUNYYMLEA-YFHOEESVSA-N 321.314 2.758 5 40 DFBB COc1ccc(NC(=O)CCCn2nc([N+](=O)[O-])cc2C)cc1 3896244 MMULFWCAMAVSMM-UHFFFAOYSA-N 318.333 2.527 5 40 DFBB Cc1c(C(=O)O)sc2nc(-c3ccc([N+](=O)[O-])cc3)cn12 33418251 URVQNGRXQFRHDO-UHFFFAOYSA-N 303.299 2.978 5 40 DFBB CC[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1cnn(CC)c1 95401905 NKOYQYYNJWYRON-OAHLLOKOSA-N 316.361 2.621 5 40 DFBB CCOCCSc1ncc(Br)cc1[N+](=O)[O-] 95966502 OMPQPCURVFEVLU-UHFFFAOYSA-N 307.169 2.881 5 40 DFBB Cc1cccc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)c1[N+](=O)[O-] 96402853 GMBRKCQFYIDPFC-LBPRGKRZSA-N 314.345 2.646 5 40 DFBB CC1=NN(c2nc(-c3cccc([N+](=O)[O-])c3)cs2)C(=O)C1 334326 HOUDWKXATNEHKD-UHFFFAOYSA-N 302.315 2.831 5 40 DFBB CC(C)CN(CCN(C)C)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 79099010 YPFSFWFAXLFJDP-UHFFFAOYSA-N 310.354 2.527 5 40 DFBB O=[N+]([O-])c1ccc(NC(=S)N(C[C@H]2CCOC2)C2CC2)cc1 44078834 UVILXNACTAFEJQ-LLVKDONJSA-N 321.402 2.793 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1n[nH]c2ccccc12 48250335 XOQCKQYBFBYHTM-UHFFFAOYSA-N 310.313 2.743 5 40 DFBB C[C@H]1CCc2noc(NC(=O)c3ccccc3[N+](=O)[O-])c2C1 8612455 CMGBDNPSMDDWDE-VIFPVBQESA-N 301.302 2.960 5 40 DFBB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)Nc1ccncc1[N+](=O)[O-] 97080945 IRBGYQGXIVZZPI-QWHCGFSZSA-N 312.329 2.915 5 40 DFBB CS[C@H]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 96409404 WLSKDNDDTYXRHM-JSGCOSHPSA-N 308.403 2.928 5 40 DFBB Nc1nc(CSc2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 4370319 DCQNPYKNFWXABS-UHFFFAOYSA-N 307.360 2.802 5 40 DFBB O=[N+]([O-])c1cccc(CN2CCN([C@@H]3C[C@@H]4CC[C@@H]3C4)CC2)c1 100802225 LYSZMVOIADELTI-QGPMSJSTSA-N 315.417 2.901 5 40 DFBB COCCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CCCCC1 6832056 YHXKUBCGCBKLIJ-UHFFFAOYSA-N 321.377 2.716 5 40 DFBB Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1F 7405748 OKMBGZAMYRZZJX-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB COc1ccc(COC(=O)c2cc([N+](=O)[O-])ccc2N)cc1F 24534863 KBLDYZLYZGQURM-UHFFFAOYSA-N 320.276 2.682 5 40 DFBB CO[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 72291389 FIKIPIFZAFULKN-INIZCTEOSA-N 312.325 2.872 5 40 DFBB Cc1c(C(=O)NCCCN2CCCCC2)cccc1[N+](=O)[O-] 10276820 VNFGTKPILVYEDP-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB COc1ccc2[nH]c3c(c2c1)CCN[C@@H]3c1ccc([N+](=O)[O-])o1 19874121 XQXQYIIUQFRGRJ-MRXNPFEDSA-N 313.313 2.913 5 40 DFBB O=[N+]([O-])c1ccc2ncnc(NCCc3cscn3)c2c1 81590036 OFNRFSNSDRGPQG-UHFFFAOYSA-N 301.331 2.649 5 40 DFBB Cc1ccn(Cc2cc([N+](=O)[O-])ccc2OC(C)C)c(=O)c1 69739658 DYVBDWGYNYIZFE-UHFFFAOYSA-N 302.330 2.900 5 40 DFBB O=[N+]([O-])c1ccc(F)cc1S(=O)(=O)Nc1ccsc1 76082563 HYCGLMFPYDJWQN-UHFFFAOYSA-N 302.308 2.596 5 40 DFBB CN(Cc1ccccc1F)S(=O)(=O)c1cccc([N+](=O)[O-])c1 23370578 NYKQQJMXEBRWGR-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB O=[N+]([O-])c1ccc([C@H](NCc2ccccc2)P(=O)(O)O)cc1 12949530 MNUXVJVGJZPLNT-CQSZACIVSA-N 322.257 2.561 5 40 DFBB O=[N+]([O-])c1ccccc1NCCNC(=S)Nc1ccccc1 18162160 GAQQXQYPKPJJKY-UHFFFAOYSA-N 316.386 2.993 5 40 DFBB COc1ccccc1C1=N/C(=C/c2ccccc2[N+](=O)[O-])C(=O)O1 297678 VDQKRMOLRHILIC-JLHYYAGUSA-N 324.292 2.948 5 40 DFBB O=c1c2ccccc2c2ccccc2c(=O)n1Cc1ccccn1 2501844 SVZXTPHATUWHKV-UHFFFAOYSA-N 314.344 2.958 5 40 DFBB COC(=O)c1occc1COc1cc([N+](=O)[O-])ccc1OC 24949262 LWRBAFZPFYROJN-UHFFFAOYSA-N 307.258 2.562 5 40 DFBB Cc1cc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)n[nH]2)no1 72294082 BVIHAFXPKLZJIB-UHFFFAOYSA-N 313.273 2.534 5 40 DFBB CO[C@@H](C)c1nsc(NCCNc2ccc([N+](=O)[O-])cc2)n1 252500338 SSNCJUUFEGYTOL-VIFPVBQESA-N 323.378 2.678 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])nn1Cc1cccc(Cl)c1Cl 408717584 JAJLMHFKJIFYDY-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB Nc1c([N+](=O)[O-])cc(Br)c(F)c1OC(F)(F)F 604221662 OYFAWZQAQGRXGC-UHFFFAOYSA-N 319.008 2.977 5 40 DFBB Cc1ccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)cc1 4331241 NMGGKSDFNGSJSV-UHFFFAOYSA-N 310.317 2.931 5 40 DFBB C[C@H]1CCC[C@@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 17031494 SXZJZZVFAKEFFX-AOOOYVTPSA-N 307.306 2.906 5 40 DFBB O=C(COc1ccccc1F)N1CCc2ccc([N+](=O)[O-])cc21 8734259 SFDYGZVVNMYPAS-UHFFFAOYSA-N 316.288 2.702 5 40 DFBB Cc1ccccc1[C@H](O)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 95965250 OHAUTOIZTPGDAF-OAHLLOKOSA-N 318.304 2.506 5 40 DFBB CC1(C)C[C@]2(C)C[C@H]1N(S(=O)(=O)c1ccccc1[N+](=O)[O-])C2 41107682 VZNPTUJAWWRQLL-HIFRSBDPSA-N 324.402 2.794 5 40 DFBB Cc1cccc([C@H](C)NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1C 71908955 PUGBASIZBIXADL-JTQLQIEISA-N 302.334 2.734 5 40 DFBB O=Cc1cc([N+](=O)[O-])ccc1OCc1ccc([N+](=O)[O-])cc1 2162670 XSINFCLTANMRDY-UHFFFAOYSA-N 302.242 2.895 5 40 DFBB O=C(NCc1ccco1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 9064367 QTRUNXYSZROPNX-UHFFFAOYSA-N 315.329 2.718 5 40 DFBB COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)cc1 12765521 PTBHUGFYDHSZQC-HNNXBMFYSA-N 316.361 2.713 5 40 DFBB O=[N+]([O-])c1ccccc1CN1CCN([C@@H]2C[C@@H]3CC[C@@H]2C3)CC1 100743411 HUYZTWXQPXNEDQ-IIDMSEBBSA-N 315.417 2.901 5 40 DFBB COc1ccc(C(=O)COc2ccc([N+](=O)[O-])cc2)cc1OC 3515120 KCFJFEALKHCAEE-UHFFFAOYSA-N 317.297 2.874 5 40 DFBB O=C(CNc1ccc([N+](=O)[O-])cc1Cl)NCc1ccco1 65513340 UKPWAHBHSRHBEN-UHFFFAOYSA-N 309.709 2.570 5 40 DFBB CCCN(CC(=O)OCC)c1c(F)cc([N+](=O)[O-])cc1F 97230039 ITJSSELWBCEPKT-UHFFFAOYSA-N 302.277 2.653 5 40 DFBB CCC[C@@H](C)NC(=O)CN(CC)Cc1cccc([N+](=O)[O-])c1 40088659 VBLNRVFWDOYTSZ-CYBMUJFWSA-N 307.394 2.722 5 40 DFBB O=C(NCCc1ccccc1)C1(c2ccc([N+](=O)[O-])cc2)CC1 225990579 IOHXAYSPQRKQAY-UHFFFAOYSA-N 310.353 2.985 5 40 DFBB CCCc1nc2c(c(=O)c3ccccc3n2C)c(=O)n1CCC 5354699 SYHHPPFYTGLYIE-UHFFFAOYSA-N 311.385 2.611 5 40 DFBB CN(Cc1ccc(Cl)nc1)C(=O)c1ccc([N+](=O)[O-])c(O)c1 30643544 VKOUSSSGOLORQA-UHFFFAOYSA-N 321.720 2.621 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)Cc1cccc(F)c1 40511083 JISKGXFVHHDZEA-UHFFFAOYSA-N 302.305 2.935 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC(n2ccnc2)C1 95462311 BZXCQZBYBJMTHB-UHFFFAOYSA-N 321.724 2.534 5 40 DFBB COc1cc([N+](=O)[O-])c(C(=O)NC2CCCC2)cc1SC 71796369 MURIZKAZBPLZMF-UHFFFAOYSA-N 310.375 2.998 5 40 DFBB Cn1nccc1[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 84303743 UMCWDUBZQJJOCP-OAHLLOKOSA-N 314.389 2.750 5 40 DFBB O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1ccc[nH]1 5112832 BTDBFOWCGYXQHY-UHFFFAOYSA-N 308.677 2.616 5 40 DFBB CCc1ccc(NS(=O)(=O)c2ccccc2)c([N+](=O)[O-])c1 5486013 JBDDVIWMFUSRFW-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB CC(=O)Nc1cccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])o2)c1 30279715 IEEMIDDOYSKADE-VIFPVBQESA-N 317.301 2.637 5 40 DFBB COc1ccc([C@H](O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 550340 OKQAUKWXEQDHKU-INIZCTEOSA-N 319.313 2.702 5 40 DFBB CCC[C@H](C)C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F 3303296 IWENQXVWERORSF-VIFPVBQESA-N 312.297 2.652 5 40 DFBB CCCCN1C(=O)CC[C@H](C(=O)O)[C@H]1c1ccc([N+](=O)[O-])cc1 5596565 QIVUKYXJVZGOBR-DZGCQCFKSA-N 320.345 2.759 5 40 DFBB Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] 96455225 WQTTWOBBWMPPHC-WHOFXGATSA-N 321.377 2.567 5 40 DFBB CC(C)[C@H]1OCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1F 96454447 DVPQQIRZGNWUBD-IINYFYTJSA-N 310.325 2.525 5 40 DFBB CN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCCC[C@H]1O 13670943 OMKKAVMNNKBKMC-CHWSQXEVSA-N 312.753 2.624 5 40 DFBB COc1ccc(C2=N/C(=C/c3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1 430702 ROLOKHBYEURLEL-XNTDXEJSSA-N 324.292 2.948 5 40 DFBB O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1c1cccnc1 480255 YRQANYDPLZYOTB-UHFFFAOYSA-N 319.276 2.944 5 40 DFBB Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(C(C)C)cc1 1428833 UPHQXGNKKFOYDL-UHFFFAOYSA-N 302.334 2.862 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2C[C@@H](C)C[C@H](C)C2)n1 5163887 JFXKQUVPZMIDHL-DCAQKATOSA-N 322.413 2.660 5 40 DFBB O=C(CN1CCc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1 6880833 UXLSGLWACQIZHV-UHFFFAOYSA-N 311.341 2.592 5 40 DFBB COc1ccc(F)cc1COC(=O)c1ccc(N)c([N+](=O)[O-])c1 7122647 HGAPLAKBINPWMY-UHFFFAOYSA-N 320.276 2.682 5 40 DFBB CC1CCN(C(=O)CCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 8739341 OZNYUUPUUOBOEC-UHFFFAOYSA-N 316.361 2.662 5 40 DFBB CS(=O)(=O)c1ccc(NC(C2CC2)C2CC2)c([N+](=O)[O-])c1 25143530 FFZDWKOHTFNSAA-UHFFFAOYSA-N 310.375 2.599 5 40 DFBB C[C@@H]1CCN(C(=O)CCn2cnc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]12 32561673 HQSAKDAJSYPHDI-HZSPNIEDSA-N 320.393 2.609 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@@H](C3OCCO3)C2)c(Cl)c1 60362983 VXTBZKPCBKKGMN-SNVBAGLBSA-N 312.753 2.838 5 40 DFBB Cc1csc(C2(NCCn3cc([N+](=O)[O-])cn3)CCCC2)n1 83215579 UFGPVCOHJUAXNJ-UHFFFAOYSA-N 321.406 2.615 5 40 DFBB CN(Cc1ccc(O)cc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] 95965238 DBWFZNJZZHYGGX-UHFFFAOYSA-N 304.277 2.712 5 40 DFBB COc1cc(F)ccc1N(C)C(=O)Cc1cccc([N+](=O)[O-])c1 96425285 UDCZOPOHPCBDCP-UHFFFAOYSA-N 318.304 2.948 5 40 DFBB O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])Nc1cn[nH]c1 97107222 KFDVAUQUKFNGGL-UHFFFAOYSA-N 312.738 2.702 5 40 DFBB CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCO1 97162567 QOYZUOWKYLBGKN-NSHDSACASA-N 312.753 2.889 5 40 DFBB O=c1[nH]c2c(s1)[C@H]1c3cc([N+](=O)[O-])ccc3OC[C@@H]1CS2 2487400 VDJBLTVFFSDNLR-LHLIQPBNSA-N 322.367 2.591 5 40 DFBB O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Cl 3885195 CRHJSGALSIKJLW-UHFFFAOYSA-N 318.782 2.813 5 40 DFBB COc1ccc2oc3cccc(NCCN(C)C)c3c(=O)c2c1 5486754 VZEANJLRFRGUBQ-UHFFFAOYSA-N 312.369 2.928 5 40 DFBB CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)c1ccccc1 6178456 VFVBLWQUQGKYRX-UHFFFAOYSA-N 324.292 2.978 5 40 DFBB O=[N+]([O-])c1cnc(N2CCC[C@@H]3CCC[C@@H]32)nc1NC1CC1 72302139 YNJYFUXYEHPFQG-JQWIXIFHSA-N 303.366 2.728 5 40 DFBB CCc1cc(NC(=O)[C@@H]2CCCO2)c2cc([N+](=O)[O-])ccc2n1 95997600 IFAUNMPEYMFXBR-HNNXBMFYSA-N 315.329 2.823 5 40 DFBB CC[C@H](NC(=O)NCc1ccn(C)c1)c1cccc([N+](=O)[O-])c1 90601744 KJPFFRWWMGLMHZ-HNNXBMFYSA-N 316.361 2.884 5 40 DFBB COc1cc(N2C[C@@H]3CN4CCCC[C@H]4[C@H]3C2)ccc1[N+](=O)[O-] 245289618 DAZGMCGHBZIPNQ-QEJZJMRPSA-N 317.389 2.524 5 40 DFBB COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 3195194 WISTZTSQKCONMP-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CC(C)=C1[C@H]2C=C[C@@H]1[C@@H]1C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]21 101366484 RWCBIWIPRCRLLY-OJXGSEEGSA-N 324.336 2.853 5 40 DFBB Cc1cc(OCC(=O)NCc2ccccc2F)ccc1[N+](=O)[O-] 7549586 XYBVGFKVHQYRSX-UHFFFAOYSA-N 318.304 2.738 5 40 DFBB CCc1cnccc1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 95988417 DGKKIVUKSABAOP-UHFFFAOYSA-N 311.341 2.751 5 40 DFBB Cc1cc(NC(=O)N2CC[C@@H]3OCCC[C@@H]3C2)ccc1[N+](=O)[O-] 97095983 GJCOYWCVWGYGKW-DOMZBBRYSA-N 319.361 2.936 5 40 DFBB Cc1ccc(S(=O)(=O)N(C2CCCC2)C2CC2)cc1[N+](=O)[O-] 24687075 RKPFCODAHULBGB-UHFFFAOYSA-N 324.402 2.999 5 40 DFBB C[C@@H]1O[C@@](O)(c2ccc([N+](=O)[O-])cc2)CC[N+]12CCCCC2 162705 SODNBJROKAQGMX-XJKSGUPXSA-N 307.370 2.507 5 40 DFBB CN(C)c1cc(Nc2cccc(O)c2)c([N+](=O)[O-])c2nonc12 5032641 DDOYWXWZKWCSAW-UHFFFAOYSA-N 315.289 2.646 5 40 DFBB Cc1cc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(C)c2)no1 8257138 LFJARAXNEMRTHS-SNVBAGLBSA-N 305.290 2.606 5 40 DFBB O=C(CCOc1cccc([N+](=O)[O-])c1)NCc1ccc(F)cc1 31487892 HISNYEBWFJICMU-UHFFFAOYSA-N 318.304 2.819 5 40 DFBB COc1cc(C(=O)O)c(OCc2ccccc2)c([N+](=O)[O-])c1 43827884 RBJBSBKZKPBLTP-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB O=[N+]([O-])c1cccnc1NCCc1nc2ccc(F)cc2[nH]1 72313853 JWJOJLATDJSXPO-UHFFFAOYSA-N 301.281 2.660 5 40 DFBB Cc1cnn(CCCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 97095569 VWCAOVLWZVRBOI-UHFFFAOYSA-N 322.752 2.573 5 40 DFBB COCCCN1C(=O)S/C(=C/c2cccc([N+](=O)[O-])c2)C1=O 409253359 UCYBKEIMWJFFDO-FMIVXFBMSA-N 322.342 2.668 5 40 DFBB Cc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 8372231 FTDYVANKDZFDFH-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB COc1cccc(OC)c1CNCCc1ccc([N+](=O)[O-])cc1 97021072 MPWIURVMBIOCMQ-UHFFFAOYSA-N 316.357 2.944 5 40 DFBB COCc1noc([C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)n1 97085690 UZUILKFENNJLHI-SSDOTTSWSA-N 313.697 2.918 5 40 DFBB CO[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1O)c1ccccc1 89531344 VDFUCQPJXCTVLG-AWEZNQCLSA-N 302.286 2.627 5 40 DFBB COc1cc(/C=C/c2onc(C)c2[N+](=O)[O-])ccc1OC(C)=O 408543334 OVPPNTXBVIKEPC-FNORWQNLSA-N 318.285 2.996 5 40 DFBB Cc1noc(C)c1CN1C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc21 94992578 DUKBOHZLFOXPNF-SNVBAGLBSA-N 317.301 2.514 5 40 DFBB C[C@H](OC(=O)[C@H]1CC=CC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 248319077 PPTUBSSINJWZBK-GDLCADMTSA-N 319.313 2.866 5 40 DFBB NC(=O)c1cc2cc([N+](=O)[O-])ccc2o/c1=N\c1ccccc1 13644323 ZURGUQOHQGFDEM-VLGSPTGOSA-N 309.281 2.672 5 40 DFBB O=[N+]([O-])c1ccc(NC[C@H](c2ccco2)N2CCCC2)nc1 25370733 XCISVOBMIDKNHG-CYBMUJFWSA-N 302.334 2.832 5 40 DFBB CC(C)[C@H](CNC(=O)Nc1ccccc1[N+](=O)[O-])N1CCCC1 12738796 VIGZYYGQLPLORU-HNNXBMFYSA-N 320.393 2.837 5 40 DFBB O=c1[nH]cnc2cc(NCc3ccc(F)cc3)c([N+](=O)[O-])cc12 29187053 FPZGJSOWQRBSNE-UHFFFAOYSA-N 314.276 2.583 5 40 DFBB O=C(COC(=O)c1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1 3510930 SQRGXIIOUTUDGY-UHFFFAOYSA-N 318.260 2.529 5 40 DFBB Cn1cc(CCC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cn1 68008358 VYYBAHRHGJKWMC-UHFFFAOYSA-N 308.725 2.553 5 40 DFBB Cc1cc(S(=O)(=O)N(C)c2ccccc2F)ccc1[N+](=O)[O-] 71908797 MYXXDOITBKOJQV-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB Cc1ccccc1[C@@H](O)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 95965251 OHAUTOIZTPGDAF-HNNXBMFYSA-N 318.304 2.506 5 40 DFBB Cc1cc(N(CCO)C(C)C)nc(-c2cccc([N+](=O)[O-])c2)n1 75109710 NKEDZPKVKXRLEB-UHFFFAOYSA-N 316.361 2.567 5 40 DFBB Cn1c(=O)c([N+](=O)[O-])c2c3c(cccc31)C(=O)c1ccccc1-2 34297 KWKWPFZXSWBCQB-UHFFFAOYSA-N 306.277 2.658 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C1CC1)[C@H](C)C1CC1 30337043 QNXDHKOLHCKTNF-LLVKDONJSA-N 324.402 2.855 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3cccc(Cl)c3)CC2)nc1 20405577 MZBSTHFKUOXTDU-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB O=C(N[C@H]1CCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl 47264450 QATQJSVIQADQPS-UONOGXRCSA-N 323.780 2.605 5 40 DFBB COc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2779976 XAUYKEJTKUTLSM-UHFFFAOYSA-N 317.257 2.764 5 40 DFBB CC1=CC[C@H]2C(=O)N(c3cc([N+](=O)[O-])ccc3F)C(=O)[C@@H]2C1 18241382 OTMTWADLLSVKQZ-GHMZBOCLSA-N 304.277 2.580 5 40 DFBB CS[C@@H]1CCC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 95468181 HMQNTEJUOOTWKS-NXEZZACHSA-N 309.391 2.581 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CNC(=O)Nc1ccncc1C 179856087 PAXYJEGDJUMDBV-UHFFFAOYSA-N 316.317 2.629 5 40 DFBB COC(=O)c1ccc(CN2CCc3ccc([N+](=O)[O-])cc3C2)o1 96461832 FFNRBBGCEPDRDI-UHFFFAOYSA-N 316.313 2.533 5 40 DFBB O=C(NOCCc1ccccc1)Nc1ccccc1[N+](=O)[O-] 4318211 YVBRXONQHXQXCN-UHFFFAOYSA-N 301.302 2.891 5 40 DFBB O=C(Cc1noc2ccccc12)N1CCc2ccc([N+](=O)[O-])cc21 29889886 POJFBCHQHOYKAX-UHFFFAOYSA-N 323.308 2.868 5 40 DFBB O=C(CN1CCc2ccccc2C1)Nc1cccc([N+](=O)[O-])c1 7782846 XFGOJIYHRLKQCN-UHFFFAOYSA-N 311.341 2.592 5 40 DFBB CC[C@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 9449807 PZRPBRSXGIHHAO-NSHDSACASA-N 323.280 2.826 5 40 DFBB CCCCCC(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1O 36541853 FQLXVOJGVUNPEH-UHFFFAOYSA-N 311.363 2.694 5 40 DFBB Cc1noc(C)c1[C@@H](C)CNC(=O)Nc1ccncc1[N+](=O)[O-] 195557371 KYSYNMPZCBWPCD-QMMMGPOBSA-N 319.321 2.520 5 40 DFBB CN(CCc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1 52639680 NPJSFQUHCHSIBZ-UHFFFAOYSA-N 313.357 2.708 5 40 DFBB Cn1cc(N2CCC[C@H](Nc3cccc(F)c3[N+](=O)[O-])C2)cn1 78367683 QQFNOFMPWVXJKP-NSHDSACASA-N 319.340 2.548 5 40 DFBB Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N(C)C2CCC2)c1 96001984 KWSTZGXSAAXVSE-UHFFFAOYSA-N 318.782 2.730 5 40 DFBB O=c1oc2cc([N+](=O)[O-])ccc2n1Cc1nc2ccccc2o1 84600392 FZPALRUCJBFMAP-UHFFFAOYSA-N 311.253 2.692 5 40 DFBB C[C@H](CNc1ccc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 26729884 DHGDBKJWMWUBTC-CYBMUJFWSA-N 312.373 2.849 5 40 DFBB O=[N+]([O-])c1ccc2nc(N(CCO)Cc3cccnc3)ccc2c1 95408843 ZKXGFVQWACAPLG-UHFFFAOYSA-N 324.340 2.537 5 40 DFBB Cc1noc(CCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)n1 95406083 SAOACQIEISTEPF-UHFFFAOYSA-N 316.239 2.960 5 40 DFBB Cc1nn(C)c(C)c1/C=C/C(=O)Nc1cccc([N+](=O)[O-])c1C 8704978 CXJITTHQKKEPDZ-CMDGGOBGSA-N 314.345 2.905 5 40 DFBB CCc1ccc(NC(=O)N2CCC[C@H]([C@H](C)O)C2)cc1[N+](=O)[O-] 95972424 FXVJNTGIFUMDQW-AAEUAGOBSA-N 321.377 2.782 5 40 DFBB Cc1cccc(C(=O)N2CCN=Cc3cc([N+](=O)[O-])ccc32)c1 73642276 MMXBFKPAKQAERQ-UHFFFAOYSA-N 309.325 2.983 5 40 DFBB Cn1cnnc1[C@H]1CCCN1c1ccc([N+](=O)[O-])c2cccnc12 89761919 RJGWFMDCAYIYNC-CQSZACIVSA-N 324.344 2.613 5 40 DFBB Cc1cc(C)n2c(SCc3cccc([N+](=O)[O-])c3)nnc2n1 6903950 WCQIXUZMWOCBDI-UHFFFAOYSA-N 315.358 2.942 5 40 DFBB COc1cccc(OCc2ccc([N+](=O)[O-])cc2C(=O)O)c1 72209200 SQEVRSBHNJKCQD-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB COC(=O)COc1c(Cl)cc([N+](=O)[O-])cc1Br 226241233 BZLYKTNUPLEXOS-UHFFFAOYSA-N 324.514 2.563 5 40 DFBB Cc1cc(S(=O)(=O)NCC2=CCCCC2)cc([N+](=O)[O-])c1C 19942780 JBVZLPOHVJFCME-UHFFFAOYSA-N 324.402 2.990 5 40 DFBB Cc1[nH]nc(C(=O)N2CCSC3(CCCCC3)C2)c1[N+](=O)[O-] 79026192 QGZBBXKOUOHJQO-UHFFFAOYSA-N 324.406 2.518 5 40 DFBB CC(C)CCNc1nc(N)c([N+](=O)[O-])c(N2CCC(C)CC2)n1 4305929 NSRKXWXSVWXAOC-UHFFFAOYSA-N 322.413 2.661 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)COCC(F)(F)F 225560804 KBFBAOWELUUZMB-VIFPVBQESA-N 320.267 2.600 5 40 DFBB CC(C)(C)c1nnc2n1N=C(c1ccc([N+](=O)[O-])cc1)CS2 4614770 NOWUMEVQYAUFDO-UHFFFAOYSA-N 317.374 2.842 5 40 DFBB COc1ccc(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1F 7122431 VTHIUSNGAHQVKW-UHFFFAOYSA-N 320.276 2.682 5 40 DFBB Cc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)s1 7192422 WOBKDIUXPWEPKS-UHFFFAOYSA-N 324.387 2.794 5 40 DFBB O=C(NCCNc1ccccc1[N+](=O)[O-])NCc1ccccc1 12556080 ZBPCWTTXMSAXOA-UHFFFAOYSA-N 314.345 2.506 5 40 DFBB CNc1ccc(C(=O)Nc2cc(C(C)C)n[nH]2)cc1[N+](=O)[O-] 58172715 SRBRQZOFQQQFKU-UHFFFAOYSA-N 303.322 2.735 5 40 DFBB Cc1ccc(OCC(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1C 13843341 PGAHIQBUGPLKBI-UHFFFAOYSA-N 316.313 2.935 5 40 DFBB CC[C@H]1CC[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 95459190 OUHRAFJVCABUIK-KOLCDFICSA-N 307.306 2.906 5 40 DFBB Cc1ccc(NC(=O)NCCCOCC2CC2)cc1[N+](=O)[O-] 40095643 NRSRDDPLHJIHIJ-UHFFFAOYSA-N 307.350 2.841 5 40 DFBB C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)c2ccc([N+](=O)[O-])o2)C1 40535201 ZJDJJFFYLWJFMX-CHWSQXEVSA-N 323.393 2.676 5 40 DFBB O=C(CN(Cc1ccco1)C1CC1)Nc1ccccc1[N+](=O)[O-] 26928069 KLIVKKBVGCDVPH-UHFFFAOYSA-N 315.329 2.791 5 40 DFBB CCOCCC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 97142416 YWTIMHULCUAGEG-UHFFFAOYSA-N 303.318 2.817 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1 9752943 CUKDTJKXNCNSBQ-UHFFFAOYSA-N 324.340 2.918 5 40 DFBB Cc1c(NS(=O)(=O)Cc2cccc(F)c2)cccc1[N+](=O)[O-] 95447381 LWTQHGYPMBVMGE-UHFFFAOYSA-N 324.333 2.984 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1c1nccn1C 95456718 LHXHQZSYOMRXTC-AWEZNQCLSA-N 314.345 2.614 5 40 DFBB Cc1ccnc(N(C)CCc2nc3ccccc3[nH]2)c1[N+](=O)[O-] 585142119 PGTQQVHQRUPFCV-UHFFFAOYSA-N 311.345 2.853 5 40 DFBB CCc1nnc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)s1 344498 MNCZTGBULWQFAU-UHFFFAOYSA-N 312.738 2.914 5 40 DFBB CC(=O)c1sc(NC(=O)c2ccccc2[N+](=O)[O-])nc1C 4031929 ILHCNNCOJQRJHV-UHFFFAOYSA-N 305.315 2.815 5 40 DFBB Cc1noc(C2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)n1 53576576 GOJIZDLQXZYRJL-UHFFFAOYSA-N 306.297 2.809 5 40 DFBB O=[N+]([O-])c1c(NCc2ccco2)ncnc1NCc1ccco1 4362463 YAKCXRCZVYGCIP-UHFFFAOYSA-N 315.289 2.795 5 40 DFBB Cc1cc(N(C)[C@@H](CCO)c2ccccc2)ncc1[N+](=O)[O-] 95411548 KQGOXVNYMCHLLL-AWEZNQCLSA-N 301.346 2.858 5 40 DFBB CNc1ccc(C(=O)Nc2ccc(C)cc2O)cc1[N+](=O)[O-] 8030422 OMXNBLVZTYARHK-UHFFFAOYSA-N 301.302 2.903 5 40 DFBB CC(=O)Nc1cccc(CNc2ncc([N+](=O)[O-])cc2C)c1 69741336 OIBFUBMGRXSSHX-UHFFFAOYSA-N 300.318 2.869 5 40 DFBB CN(C[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 83859202 LJEBKSSPJYTZNP-VIFPVBQESA-N 302.277 2.669 5 40 DFBB C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[C@H]2CC[C@H]1C2 104094324 HSQVKSGLOXCONI-MRBYEJRBSA-N 303.362 2.732 5 40 DFBB C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CN1C1CC1 97162529 GUOQVSMJYZRFNC-GXSJLCMTSA-N 323.780 2.603 5 40 DFBB O=C(c1cccs1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 48305786 RXWBIZWVNKNGEH-UHFFFAOYSA-N 317.370 2.619 5 40 DFBB O=C(Nc1ccsc1)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 97081352 UWWBTYZVYUGGKJ-ZDUSSCGKSA-N 317.326 2.788 5 40 DFBB O=C(c1ccc([N+](=O)[O-])s1)N1CCc2ccc([N+](=O)[O-])cc21 95947141 CHBMUPKNYHVZFO-UHFFFAOYSA-N 319.298 2.767 5 40 DFBB Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])nc3)CC2)nc1 78305695 LKBFRKONCBOXQI-UHFFFAOYSA-N 313.361 2.774 5 40 DFBB Cc1ccc(Sc2cccc(S(N)(=O)=O)c2[N+](=O)[O-])cc1 95997071 JFPDRALIEMHLNV-UHFFFAOYSA-N 324.383 2.702 5 40 DFBB CC(=O)c1ccc(N[C@H](CO)c2ccccc2)c([N+](=O)[O-])c1 69566370 HMXVLQBZLCWCPE-OAHLLOKOSA-N 300.314 2.943 5 40 DFBB C[N+]1(C)CCN(C[C@](O)(c2ccccc2)C2CCCCC2)CC1 897263 ZRYHPQCHHOKSMD-FQEVSTJZSA-N 317.497 2.847 5 40 DFBB world C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](c2ccccc2)O1 58282704 SUBDXADFZYXTFU-RISCZKNCSA-N 316.313 2.790 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])o1)NCCCc1ccccc1 14020573 QCOCIVACNHBGQT-CSKARUKUSA-N 300.314 2.950 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Cl)cc1F 65712995 RDYSDZCLBBQDTJ-UHFFFAOYSA-N 312.688 2.531 5 40 DFBB CC[C@](Cl)(C(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)CC 96518430 GVGFNFFJPUZRCT-GFCCVEGCSA-N 319.766 2.557 5 40 DFBB C[C@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] 245281181 ABEGTQJLWHFYNH-LEWSCRJBSA-N 315.329 2.736 5 40 DFBB CCN(CC)CCNC(=O)c1cccc2nc3ccccc3nc12 5807613 VCOKVCIDZAXMIL-UHFFFAOYSA-N 322.412 2.855 5 40 DFBB CCCCc1nnc2n1N=C(c1ccc([N+](=O)[O-])cc1)CS2 4580293 NPRGUJLAFIVMJD-UHFFFAOYSA-N 317.374 2.887 5 40 DFBB O=c1c([N+](=O)[O-])cccn1Cc1ccccc1Br 72280385 VFLUCYUNTNJBMS-UHFFFAOYSA-N 309.119 2.567 5 40 DFBB CCOC(=O)c1cc(N2C[C@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] 75107081 USPLORKZFCQIFM-NSHDSACASA-N 322.361 2.775 5 40 DFBB O=[N+]([O-])c1ccc(OC[C@H](O)CC(F)(F)F)c2cccnc12 189428477 KRUNPRAGIIDVHK-MRVPVSSYSA-N 316.235 2.835 5 40 DFBB O=[N+]([O-])[C@H]1C[C@H]1c1nc(-c2cc(Br)cs2)no1 78774473 LIPASYYTGKJUDX-RITPCOANSA-N 316.136 2.693 5 40 DFBB C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 7309563 FPJXHLLENDCVQR-GFCCVEGCSA-N 320.370 2.677 5 40 DFBB Cc1cc(S(=O)(=O)Nc2ccc([N+](=O)[O-])c(F)c2)c(C)o1 97162907 IZGUDQGPJFYLLS-UHFFFAOYSA-N 314.294 2.745 5 40 DFBB C/C=C/C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 8293030 HCMYNPGYEXMISC-CDAZIORVSA-N 303.274 2.825 5 40 DFBB CC(=O)c1csc(NC(=O)c2cc(F)c(C)c([N+](=O)[O-])c2)n1 69417556 VPFUNHWSQAKWPZ-UHFFFAOYSA-N 323.305 2.954 5 40 DFBB O=C1C/C(=C\c2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1 5081369 MUUGFWCNMNYPCH-JLHYYAGUSA-N 308.293 2.942 5 40 DFBB CCOC(=O)C1=C(C)O[C@@H]([N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 100783337 YTFFDIORXYPXAC-CHWSQXEVSA-N 311.721 2.894 5 40 DFBB O=C(CN1CCC[C@@H]1c1ccc[nH]1)Nc1ccc([N+](=O)[O-])cc1 84338994 GOAZXEODGITZLL-OAHLLOKOSA-N 314.345 2.699 5 40 DFBB Cn1nccc1CCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 193288595 DDYVAFQWARYVLT-INIZCTEOSA-N 300.362 2.538 5 40 DFBB Cc1ccc(OCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 5814579 PQOJORXLXMTKCX-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB Cn1c([N+](=O)[O-])cnc1CSc1nc(-c2ccccc2)no1 13207558 JDRPULZAJSMGBY-UHFFFAOYSA-N 317.330 2.671 5 40 DFBB Cc1nc(NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])sc1-c1ccccc1 44492449 PEOQSCKWJAIQNQ-QWRGUYRKSA-N 303.343 2.722 5 40 DFBB C[C@H](C(=O)N[C@H]1CCCc2ccccc21)n1cc([N+](=O)[O-])cn1 2747981 KLADXPKSQWKQFK-ABAIWWIYSA-N 314.345 2.546 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])nn1Cc1c(Cl)cccc1Cl 408717692 OMLKYHYGGGAPKV-UHFFFAOYSA-N 316.100 2.845 5 40 DFBB O=[N+]([O-])c1ccc(CC2=NCCc3cc4c(cc32)OCO4)cc1 5004200 AEPFXICHXOEZIZ-UHFFFAOYSA-N 310.309 2.911 5 40 DFBB CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CCCCC1 6552530 HQZDHHGIZKHTJZ-HNNXBMFYSA-N 308.378 2.599 5 40 DFBB Cc1ccc(S(=O)(=O)Nc2ccc(N)c([N+](=O)[O-])c2)c(C)c1 7357315 HQYRYNBBPFYREU-UHFFFAOYSA-N 321.358 2.595 5 40 DFBB Cc1cc(NC(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)n(C)n1 43433150 JDRLSABAIMQMPJ-LLVKDONJSA-N 317.349 2.862 5 40 DFBB Cc1ccc(CN(C)c2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 7903241 VNMAORTVKXQFCR-UHFFFAOYSA-N 313.357 2.947 5 40 DFBB COc1ccc(OC[C@H](O)C[N+]2(C)CCCC2)c(C(C)(C)C)c1 226071285 BEJSTAQLGMFKBA-OAHLLOKOSA-N 322.469 2.973 5 40 DFBB CS[C@@H]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1 96409403 WLSKDNDDTYXRHM-GXTWGEPZSA-N 308.403 2.928 5 40 DFBB O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc2c(c1)OCO2 568369 RAKLAMYWLLSOCH-UHFFFAOYSA-N 304.233 2.715 5 40 DFBB COCc1ccc(-c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)cc1 54756747 BNZZXXQWAAONIO-UHFFFAOYSA-N 311.297 2.645 5 40 DFBB C[S@@](=O)Cc1ccccc1NC(=O)c1ccccc1[N+](=O)[O-] 97139741 VNSGMZPDZMHUTA-QFIPXVFZSA-N 318.354 2.726 5 40 DFBB NC(=O)c1cn(Cc2cccc([N+](=O)[O-])c2)nc1-c1ccccc1 65593190 CGHCHNUZPNHPHH-UHFFFAOYSA-N 322.324 2.606 5 40 DFBB CN(c1nc2sccn2c1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 71920855 ZAZZYDDPKKWKEV-AEJSXWLSSA-N 322.390 2.554 5 40 DFBB O=C(Nc1ccc2c(c1)COC2)c1ccc([N+](=O)[O-])c(O)c1 92049072 PTMWVBLAOVYUDD-UHFFFAOYSA-N 300.270 2.583 5 40 DFBB COC(=O)COc1c(Cl)cc(Br)cc1[N+](=O)[O-] 147010809 XBDLEAOXPHXOOV-UHFFFAOYSA-N 324.514 2.563 5 40 DFBB O=c1ccc(-c2cccs2)nn1Cc1ccc([N+](=O)[O-])cc1 5388118 ZRFIHFBSFYPTHM-UHFFFAOYSA-N 313.338 2.928 5 40 DFBB COc1ccccc1COC(=O)c1cc([N+](=O)[O-])ccc1N 16814304 CMKUYLNYWXZPKC-UHFFFAOYSA-N 302.286 2.543 5 40 DFBB O=C(N[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 71882832 ZAADNNPQGHMGEB-CQSZACIVSA-N 311.341 2.604 5 40 DFBB Cc1ccc([N+](=O)[O-])c(=O)n1Cc1nc(C(C)(C)C)cs1 97164961 GTPIDPDZBFNQAL-UHFFFAOYSA-N 307.375 2.867 5 40 DFBB O=C(OCC1CCCCC1)c1cc([N+](=O)[O-])ccc1NCCO 6533017 NUMUHXXTXZTQTP-UHFFFAOYSA-N 322.361 2.736 5 40 DFBB CC1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1 6820483 MVNFTTKCGAYQNI-UHFFFAOYSA-N 305.378 2.969 5 40 DFBB CN(CCCNC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 17826738 QLHUQVOAJCWEAS-UHFFFAOYSA-N 313.357 2.851 5 40 DFBB O=[N+]([O-])c1c(NCCc2ccc(O)cc2)nc2sccn12 40445371 JFJPANQAHBMEAJ-UHFFFAOYSA-N 304.331 2.664 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1cccc(C)c1 84213110 ABWQQAIDCUUMAE-UHFFFAOYSA-N 321.354 2.886 5 40 DFBB Cc1ncc([N+](=O)[O-])n1C[C@H](C)C(=O)c1ccc(F)c(F)c1 97378362 JKTWEVDZKIYUIB-QMMMGPOBSA-N 309.272 2.897 5 40 DFBB C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])c1)c1cccc2ccccc12 12787374 QHTXMBRDDOSSIZ-LBPRGKRZSA-N 324.340 2.822 5 40 DFBB C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1cccs1 10671470 XZPWNDDDFWXLPI-SNVBAGLBSA-N 306.343 2.913 5 40 DFBB C[C@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C1CCOCC1 97015972 PFNDYUFQIMNUIA-NWDGAFQWSA-N 321.377 2.770 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@@H](C(=O)NC(C)C)C1 75140108 VOKBGCSVUFIDLX-OLZOCXBDSA-N 320.393 2.794 5 40 DFBB O=[N+]([O-])c1cccc(-c2nnc3n2N[C@@H](c2ccco2)S3)c1 3843206 BJNMEWNKEDECNF-GFCCVEGCSA-N 315.314 2.794 5 40 DFBB biogenic CCN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H](C)c1cccnc1 97097437 HIDBVSZPRDPLRE-NSHDSACASA-N 315.329 2.919 5 40 DFBB CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2F)cc1 40527898 OWHPJHOQMHUMKY-UHFFFAOYSA-N 317.276 2.945 5 40 DFBB 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2.635 5 40 DFBB Cc1cccc(C)c1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 8390719 YWICILWUDFLCHV-UHFFFAOYSA-N 302.334 2.664 5 40 DFBB O=C(O[C@H]1[C@H]2C[C@@H]2[C@H]2CC[C@@H]12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 103936006 DDDKPZKIQUKROA-ZKKPSOLOSA-N 318.285 2.704 5 40 DFBB CCCCN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1ccc([N+](=O)[O-])cc1 5596540 QIVUKYXJVZGOBR-UKRRQHHQSA-N 320.345 2.759 5 40 DFBB CN(Cc1ccsc1)C(=O)COc1ccccc1[N+](=O)[O-] 8062648 BIDDVPJCIPIJQW-UHFFFAOYSA-N 306.343 2.694 5 40 DFBB Cc1cc(N[C@@H](Cn2cncn2)c2ccccc2)ncc1[N+](=O)[O-] 74765900 FWJXOEDJXAACJG-AWEZNQCLSA-N 324.344 2.743 5 40 DFBB CCn1nc(C)c([N+](=O)[O-])c1C(=O)Nc1cc(Cl)ccc1O 96492966 UXLGTFRBBVHNPZ-UHFFFAOYSA-N 324.724 2.731 5 40 DFBB Cc1c(NC(=O)c2cccc(O)c2[N+](=O)[O-])cccc1N(C)C 252495828 PCPFPEIZXMWKEA-UHFFFAOYSA-N 315.329 2.927 5 40 DFBB O=C(COC(=O)c1ccco1)Nc1ccc([N+](=O)[O-])cc1Cl 5855065 FDGAJHXBYNJZRR-UHFFFAOYSA-N 324.676 2.637 5 40 DFBB C[C@H](c1ccccn1)N(C)C(=O)c1ccc(O)c([N+](=O)[O-])c1 164408499 GRWYOFZRONNDJA-SNVBAGLBSA-N 301.302 2.529 5 40 DFBB C[C@](O)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccsc1 72294031 PRTODUJIEPZMAZ-AWEZNQCLSA-N 321.358 2.686 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])n1cnc2ccccc21 37866378 XRLGZFHCFKKCQR-UHFFFAOYSA-N 312.241 2.541 5 40 DFBB Cc1nn(C)c(NCc2cccc(OC(C)(C)C)n2)c1[N+](=O)[O-] 390834642 KGWBATNBJBUQOH-UHFFFAOYSA-N 319.365 2.821 5 40 DFBB C/C=C1\C[N+]2(C)CC[C@]34c5ccccc5N[C@H]3[C@H](CO)[C@H]1C[C@@H]42 5829875 LKZQOCJBJKPRFV-ZRALJQDWSA-N 311.449 2.526 5 40 DFBB NC(=O)c1ccc(Sc2nc3ccccc3[nH]2)c([N+](=O)[O-])c1 16525111 IMRXPQHRRUSITG-UHFFFAOYSA-N 314.326 2.721 5 40 DFBB CC(C)Cn1ccnc1NC(=O)Cc1ccccc1[N+](=O)[O-] 58420748 PLGGMBIZUGPUPJ-UHFFFAOYSA-N 302.334 2.629 5 40 DFBB C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CN1C1CC1 97162527 GUOQVSMJYZRFNC-ONGXEEELSA-N 323.780 2.603 5 40 DFBB CC1=C(C)C[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C(=O)O)C1 4651854 GILTVGMGRNATNP-KGLIPLIRSA-N 318.329 2.981 5 40 DFBB Nc1nc(Sc2ncccc2[N+](=O)[O-])nc2sccc12 9428772 LCGDWDHGZGRSAH-UHFFFAOYSA-N 305.344 2.728 5 40 DFBB CCc1nc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1 71886505 WHVKHRIRIXIHIL-UHFFFAOYSA-N 309.322 2.683 5 40 DFBB CC(C)N1CSc2nnc(-c3cccc([N+](=O)[O-])c3)n2C1 24716586 AISVTKDECXQZTP-UHFFFAOYSA-N 305.363 2.584 5 40 DFBB biogenic O=C1NC(c2cccc(F)c2)=N/C1=C\c1cccc([N+](=O)[O-])c1 16399733 JNUXMUJRNNJJMN-ZSOIEALJSA-N 311.272 2.651 5 40 DFBB Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1O 3076825 KFVIBXQTSAJDAW-UHFFFAOYSA-N 317.257 2.769 5 40 DFBB CC(=O)c1ccc(N[C@@H](C)C(=O)NC2CCCC2)c([N+](=O)[O-])c1 58166064 LJQGCQATCWWSJZ-JTQLQIEISA-N 319.361 2.657 5 40 DFBB CCOC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4708892 ZMBACQXTHYRKKK-UHFFFAOYSA-N 313.741 2.527 5 40 DFBB Cc1cc(C(=O)Nc2ccncc2[N+](=O)[O-])nn1-c1ccccc1 67169616 HQYBPAJSSYSPRX-UHFFFAOYSA-N 323.312 2.736 5 40 DFBB O=c1c(Cl)c(Cl)cnn1Cc1c(F)cccc1[N+](=O)[O-] 71799793 YWJCKFFMBPTIEW-UHFFFAOYSA-N 318.091 2.646 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C(=O)N2CCOc3ncc(C)cc32)c1 95445560 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COc1cc([N+](=O)[O-])cc2sc(NC(=O)C(F)(F)F)nc12 10010585 PHZPCWSFMCDAOW-UHFFFAOYSA-N 321.236 2.714 5 40 DFBB O=[N+]([O-])c1cc2c(c(CSc3ncccn3)c1)OCOC2 3474783 VCZICHBWCOUZFU-UHFFFAOYSA-N 305.315 2.544 5 40 DFBB O=C(COc1ccc(Cl)cc1Cl)n1ccc([N+](=O)[O-])n1 78683 WPVGLWYGKTXKKC-UHFFFAOYSA-N 316.100 2.817 5 40 DFBB C[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 10434956 KXNARZPBMNWEOT-SNVBAGLBSA-N 316.313 2.716 5 40 DFBB CCCCOc1ccc(CSC2=NCCN2)cc1[N+](=O)[O-] 1903915 JZEBGWMCJWOXJX-UHFFFAOYSA-N 309.391 2.966 5 40 DFBB CC(C)c1csc(CNC(=O)Nc2ccncc2[N+](=O)[O-])n1 97237308 RADBJAYUYWJMLN-UHFFFAOYSA-N 321.362 2.891 5 40 DFBB O=c1oc(-c2cccs2)nn1Cc1ccccc1[N+](=O)[O-] 15399003 RMRBXKDMAHJOED-UHFFFAOYSA-N 303.299 2.521 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1Cc1csc(-c2cccs2)n1 8772584 ABQBGKKAQVWWOF-UHFFFAOYSA-N 319.367 2.990 5 40 DFBB C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@H](O)Cc1ccccc1 96483230 LZFXIMYMYDEEBJ-SUMWQHHRSA-N 300.358 2.677 5 40 DFBB CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1scnc1Cl 40554159 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301.331 2.582 5 40 DFBB CC(C)(C)OC(=O)N[C@H]1CCN(c2ccccc2[N+](=O)[O-])C1 67800658 ASGSCQCZBVODJB-NSHDSACASA-N 307.350 2.698 5 40 DFBB CC[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)on1 8769123 QWXSYBIVFWMEQG-GFCCVEGCSA-N 305.290 2.687 5 40 DFBB COC(=O)c1cc(NCCc2cscn2)cc(C)c1[N+](=O)[O-] 89587381 RVIIQAPFVSGKNM-UHFFFAOYSA-N 321.358 2.801 5 40 DFBB CCN(Cc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 32603647 UBQCYRAXBBRCNN-UHFFFAOYSA-N 320.370 2.806 5 40 DFBB CCN(Cc1ccoc1)S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 96406680 PELJCOPWXKFKIQ-UHFFFAOYSA-N 324.358 2.707 5 40 DFBB Cc1cc(C(=O)Nc2ccc(CC(=O)O)cc2)ccc1[N+](=O)[O-] 13439680 KNRLTXLYKHNRJF-UHFFFAOYSA-N 314.297 2.783 5 40 DFBB COc1cc([N+](=O)[O-])ccc1-n1c(C)nc2ccccc2c1=O 529670 RZHHDMJWDYJXAW-UHFFFAOYSA-N 311.297 2.611 5 40 DFBB CC(=O)c1cccc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 21821012 JJBJBXYICZTBGA-UHFFFAOYSA-N 321.310 2.565 5 40 DFBB CC1=C([N+](=O)[O-])[C@@H](c2ccccc2C(F)(F)F)NC(=O)N1 40549 BDJSNQKPJFTJCV-SECBINFHSA-N 301.224 2.568 5 40 DFBB 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BOANWHWVAYRMDQ-LBPRGKRZSA-N 320.370 2.775 5 40 DFBB Cc1cc(C(=O)NCCCN2CCCCCC2)ccc1[N+](=O)[O-] 13668225 NAODDHDESKADPZ-UHFFFAOYSA-N 319.405 2.899 5 40 DFBB CC1([N+](=O)[O-])COP(=O)(Nc2ccc(Cl)cc2)OC1 1704621 UYGSCCWRKCKXKC-UHFFFAOYSA-N 306.642 2.942 5 40 DFBB Cc1cc([N+](=O)[O-])nn1C[C@H](C)C(=O)Nc1ccc(F)cc1F 2787801 DPELOBYKFUCGIU-QMMMGPOBSA-N 324.287 2.653 5 40 DFBB COc1ccc(C)cc1NC(=O)CNc1ccc([N+](=O)[O-])cc1 7954869 CKFTZSHWHCWTON-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB Cc1cccc(CNc2cc([N+](=O)[O-])ccc2NCCO)c1 8779911 SZJFIIBLZXQGNF-UHFFFAOYSA-N 301.346 2.920 5 40 DFBB COC(=O)c1cc(C(=O)N(C)c2ccccc2)cc([N+](=O)[O-])c1 1097973 JITDORHAGIONML-UHFFFAOYSA-N 314.297 2.658 5 40 DFBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)N[C@H](C)c1ccccc1 196110 APQKKRUCJQQRDX-SECBINFHSA-N 322.752 2.631 5 40 DFBB CCOC[C@@H]1CCCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C1 72283358 ZACRBCVTGQARRF-CQSZACIVSA-N 321.377 2.553 5 40 DFBB Cc1cc(N2CCSCC2)nc(-c2cccc([N+](=O)[O-])c2)n1 76833091 RJXXWCJRTHUDSO-UHFFFAOYSA-N 316.386 2.913 5 40 DFBB COCCNC(=S)Nc1cc2ccncc2c2ncccc12 408974204 DIDDPJNVCNLLEP-UHFFFAOYSA-N 312.398 2.716 5 40 DFBB COc1ccc(C(=O)N(C)Cc2ccoc2C)cc1[N+](=O)[O-] 55461011 ITBLIMBKUINXQS-UHFFFAOYSA-N 304.302 2.777 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC[C@@H]1C1CCCC1 56142163 SEHJYUZIZBXEPV-CYBMUJFWSA-N 324.402 2.938 5 40 DFBB CC(=O)c1ccc(NC[C@@H](CO)Cc2ccco2)c([N+](=O)[O-])c1 12753903 CGSRDCAYYYUAPH-LBPRGKRZSA-N 318.329 2.654 5 40 DFBB O=[N+]([O-])c1cccc([C@@H](NCc2ccccc2)P(=O)(O)O)c1 65090420 OVSHTRIRRLHWHS-AWEZNQCLSA-N 322.257 2.561 5 40 DFBB O=[N+]([O-])c1ccc([C@H]2ON=C(c3ccccc3)[C@@H]2[N+](=O)[O-])cc1 4016989 HLCKDFGBHDBICY-LSDHHAIUSA-N 313.269 2.716 5 40 DFBB CNS(=O)(=O)c1ccc(Nc2cccc(C)c2)c([N+](=O)[O-])c1 6044719 JQUYVONFOMDZBM-UHFFFAOYSA-N 321.358 2.555 5 40 DFBB CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(NCc2ccccc2)n1 5053760 UPSHNCKTSIXXLO-SNVBAGLBSA-N 316.365 2.790 5 40 DFBB CSc1ccc(C(=O)NCCCOC(C)C)cc1[N+](=O)[O-] 6784298 WXRIKIJHQWYPDQ-UHFFFAOYSA-N 312.391 2.862 5 40 DFBB C[C@@H](O)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] 8177635 HEZJPPGWIGGQIT-LLVKDONJSA-N 300.314 2.619 5 40 DFBB O=[N+]([O-])c1cn(Cc2cc(F)ccc2Br)cn1 69654476 ZVTBLMVZOXAYHS-UHFFFAOYSA-N 300.087 2.741 5 40 DFBB CCN(Cc1ccoc1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 95433772 HJPDKUUOFNZLRH-UHFFFAOYSA-N 324.358 2.540 5 40 DFBB Cc1nc(NC(=O)[C@@H](C)Oc2ccccc2)ccc1[N+](=O)[O-] 96475305 SCCSKSAUHLNJFK-LLVKDONJSA-N 301.302 2.704 5 40 DFBB Cc1cccc(CNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 13671026 HDCCVGOZCMTSSD-UHFFFAOYSA-N 320.370 2.690 5 40 DFBB CC1(C)Oc2cc(I)c([N+](=O)[O-])cc2O1 345578 HLFRCAKBNGHGKI-UHFFFAOYSA-N 321.070 2.707 5 40 DFBB CCCc1nnc2sc(COc3ccc([N+](=O)[O-])cc3)nn12 8392322 JJSSRQDXNGVKNB-UHFFFAOYSA-N 319.346 2.626 5 40 DFBB CC(=O)c1cc(C(=O)Oc2ccc(C)c([N+](=O)[O-])c2)n(C)c1 95438582 PZPWLSVGDZVHJL-UHFFFAOYSA-N 302.286 2.664 5 40 DFBB Cc1nc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cs1 75127481 RIFGQCATWGSVBW-QMMMGPOBSA-N 303.343 2.951 5 40 DFBB CCOC(=O)N(CC[N+](C)(C)C)c1ccc(C(F)(F)F)cn1 91695658 UVRVOFOLRMGTGS-UHFFFAOYSA-N 320.335 2.770 5 40 DFBB CC[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1c(C)nn(C)c1C 96443182 YXZOMLASXXRYNH-CYBMUJFWSA-N 316.361 2.826 5 40 DFBB O=[N+]([O-])c1cccnc1Nc1ccc(N2CCOCC2)cc1 7185819 ALFRBQIYECJELU-UHFFFAOYSA-N 300.318 2.570 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)Cn1cnc2ccccc21 411822 HXZSQSKIEDSENV-UHFFFAOYSA-N 310.313 2.892 5 40 DFBB COc1ccccc1[C@@H](CNc1ncccc1[N+](=O)[O-])N(C)C 23702122 BFJYGXMSARAKIB-CQSZACIVSA-N 316.361 2.713 5 40 DFBB COCCCOc1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1 56147340 KYNAYYBUTNKJSD-UHFFFAOYSA-N 320.301 2.855 5 40 DFBB C[C@H]1Cc2ccccc2N1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 9157285 CFIOGYDXLCOIRE-NSHDSACASA-N 311.341 2.645 5 40 DFBB C[C@@H](c1ccccc1)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 8520172 YCKAIEFXPAHMOI-LBPRGKRZSA-N 320.370 2.977 5 40 DFBB CCN1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2OC)C1=O 409064035 BEFBRARIIRVTEQ-YRNVUSSQSA-N 308.315 2.660 5 40 DFBB O=Cc1ccc(N2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1 8055926 NPMQHKYCEGMRHC-UHFFFAOYSA-N 311.341 2.734 5 40 DFBB COc1ccc(-n2c(C)nc3cc([N+](=O)[O-])ccc3c2=O)cc1 127181 HCWLHEQICYCIMN-UHFFFAOYSA-N 311.297 2.611 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1cccc(F)c1F 28006025 HFWAQGORWQSQGC-UHFFFAOYSA-N 306.224 2.829 5 40 DFBB Cc1cc2ncc3c(n2n1)CCN(c1ccc([N+](=O)[O-])cc1)C3 4053188 BZRKRVPIZMSGJQ-UHFFFAOYSA-N 309.329 2.509 5 40 DFBB CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nccs2)cc1OC 8007641 PIVCZVORZBJKPL-UHFFFAOYSA-N 323.330 2.711 5 40 DFBB CCc1n[nH]c(Sc2ccc3ncccc3c2[N+](=O)[O-])n1 71899443 BVNUAMKOFIJYOK-UHFFFAOYSA-N 301.331 2.975 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC(C(F)(F)F)CC1 97163857 IVLJJTZMEIASMZ-UHFFFAOYSA-N 318.251 2.715 5 40 DFBB Cc1[nH]nc(C(=O)N[C@H]2C[C@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] 77141361 OOMSRYAINCACDC-QWRGUYRKSA-N 320.736 2.566 5 40 DFBB CSC[C@@H](CCO)Nc1ccc([N+](=O)[O-])c2cccnc12 77237009 CGHWAQJWRJWDML-SNVBAGLBSA-N 307.375 2.669 5 40 DFBB CCO[C@H](C)C(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc12 97378928 RCCXCMMQJZJONO-SNVBAGLBSA-N 303.318 2.815 5 40 DFBB O=C(Cn1cc([N+](=O)[O-])ccc1=O)C12CC3CC(CC(C3)C1)C2 18263150 VTLFIUXVUNBHDQ-UHFFFAOYSA-N 316.357 2.542 5 40 DFBB CS(=O)(=O)c1ccc(N2CCc3ccccc32)c([N+](=O)[O-])c1 4905570 CBABZRCJVRWZPR-UHFFFAOYSA-N 318.354 2.693 5 40 DFBB O=C(Nc1nnc(-c2cccs2)o1)c1cccc([N+](=O)[O-])c1 4330323 QPUSITKQBFAHIW-UHFFFAOYSA-N 316.298 2.959 5 40 DFBB O=C(NCCCOCC(F)(F)F)Nc1ccccc1[N+](=O)[O-] 32809036 MTAONICDAFTPHQ-UHFFFAOYSA-N 321.255 2.685 5 40 DFBB CC1CCN(CCCNc2nc3sccn3c2[N+](=O)[O-])CC1 21674649 TUVMPSKQEHMIKS-UHFFFAOYSA-N 323.422 2.838 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCC(O)CC1 43342049 QDLLSJUJOZEDKE-UHFFFAOYSA-N 313.741 2.673 5 40 DFBB CCOc1cc(C=O)cc([N+](=O)[O-])c1OCc1ccccn1 8702306 RXXHQBZZYUJFBU-UHFFFAOYSA-N 302.286 2.780 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccccc1Cl 3958937 HAFZOKKGRRFNAN-UHFFFAOYSA-N 320.732 2.943 5 40 DFBB C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2[nH]1 9364772 FXPXAFYGDLTUCZ-NSHDSACASA-N 324.340 2.891 5 40 DFBB O=[N+]([O-])c1ccccc1NNC(=S)NCCc1ccccc1 5127326 RQXLWPZQAYCZTL-UHFFFAOYSA-N 316.386 2.629 5 40 DFBB Cc1cc(NC(=O)NC[C@@](C)(O)c2ccco2)ccc1[N+](=O)[O-] 97163036 HIAWBQIJBGUVEA-OAHLLOKOSA-N 319.317 2.525 5 40 DFBB COC(=O)c1ccc(Nc2ccc([N+](=O)[O-])c3nonc23)cc1 4537874 GVIVYINOSAKYQJ-UHFFFAOYSA-N 314.257 2.661 5 40 DFBB COc1cc(F)ccc1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 25311919 VIOWMHYQHUTLBQ-UHFFFAOYSA-N 306.249 2.700 5 40 DFBB CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(N2CCCCCC2)n1 5215993 IGVGRNICLSNTAA-SNVBAGLBSA-N 308.386 2.558 5 40 DFBB O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC(C(F)(F)F)CC1 97112842 RGIUTCQUXQSWRO-UHFFFAOYSA-N 318.251 2.715 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(OCc2ccccc2F)cc1O 216933481 JRPUNVZIYPNFTF-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB Cc1nc(NC(=O)[C@H](C)Oc2ccccc2)ccc1[N+](=O)[O-] 96475306 SCCSKSAUHLNJFK-NSHDSACASA-N 301.302 2.704 5 40 DFBB COc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1[N+](=O)[O-] 13166539 ONTHXZZJQFNIKV-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB O=c1nc2n(-c3cccc(Cl)c3)c3ccccc3cc-2c(=O)[nH]1 9168881 YERZYJFBBYVUQW-UHFFFAOYSA-N 323.739 2.832 5 40 DFBB N=c1oc2ccc([N+](=O)[O-])cc2cc1C(=O)NCc1ccccc1 3897178 XOWPOGBKBUXEIQ-UHFFFAOYSA-N 323.308 2.750 5 40 DFBB CO[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 96007646 AOBSDGIBYZVTMU-ZETCQYMHSA-N 306.240 2.977 5 40 DFBB CSc1cc(Oc2ccnc(N)c2[N+](=O)[O-])ccc1[N+](=O)[O-] 82238070 INEZZZDYCSRZSU-UHFFFAOYSA-N 322.302 2.994 5 40 DFBB O=C(C1CCCCC1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 71911486 VCHZYNLDPJMSLT-CYBMUJFWSA-N 318.377 2.583 5 40 DFBB CCc1ccc(N(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 225002829 FRBJPFOYJSSRQN-UHFFFAOYSA-N 320.370 2.982 5 40 DFBB COCC[C@@H](C)NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 80108159 SIDGHQOPSFMSIG-LLVKDONJSA-N 309.366 2.554 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(=O)c2ccccc2o1 189202 SINQWTAMLFQBJZ-UHFFFAOYSA-N 310.265 2.954 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1-n1ccnc1 45859995 QFBOWOCYWXNHNZ-UHFFFAOYSA-N 322.324 2.962 5 40 DFBB CCN(CC)CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 49077758 XXPFGXOIGMCBRL-UHFFFAOYSA-N 319.405 2.789 5 40 DFBB CCOc1ccc(Nc2nc(Cl)nc(N)c2[N+](=O)[O-])cc1 5048451 KJCMAMNNUXLUEG-UHFFFAOYSA-N 309.713 2.763 5 40 DFBB CC(C)(C)n1ccc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1 69968513 YTFSMFWNTJUSMB-UHFFFAOYSA-N 304.306 2.504 5 40 DFBB CCCOc1ccccc1/C=C/c1nc(O)c([N+](=O)[O-])c(O)n1 408599950 PKNOZPACUJKGSM-BQYQJAHWSA-N 317.301 2.755 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)Cc2ccccn2)c(Cl)c1 195579545 DYKUBPOKDOKHHV-UHFFFAOYSA-N 312.734 2.617 5 40 DFBB O=[N+]([O-])c1ccc(NC[C@H](O)C(F)(F)F)cc1OC(F)F 96429284 YCGFVMRPWXXUBN-QMMMGPOBSA-N 316.182 2.531 5 40 DFBB Cc1c(C(=O)Nc2cccc([S@](C)=O)c2)cccc1[N+](=O)[O-] 71893544 VCLITHKLZDPBCV-JOCHJYFZSA-N 318.354 2.893 5 40 DFBB Cc1ccc(CSCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 24830721 MHFBOXGGRGCKKG-UHFFFAOYSA-N 319.386 2.895 5 40 DFBB COc1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1OC 1678818 YTHIGQZKJYHSBK-UHFFFAOYSA-N 317.297 2.852 5 40 DFBB COc1cc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)cc(OC)c1 35307862 FCUCWYPIEYLNRI-UHFFFAOYSA-N 318.285 2.570 5 40 DFBB O=[N+]([O-])c1ccccc1N/C=C\c1nnnn1-c1ccccc1 100975226 KDBNWIFKKHJGEI-KHPPLWFESA-N 308.301 2.653 5 40 DFBB O=C(Cc1cn2ccsc2n1)OCc1ccc([N+](=O)[O-])cc1 12602833 JJAFJRREZOPDQE-UHFFFAOYSA-N 317.326 2.590 5 40 DFBB O=c1c(Cl)c(Cl)cnn1CCc1ccc([N+](=O)[O-])cc1 48833632 VNLMPOHIDVGGEK-UHFFFAOYSA-N 314.128 2.701 5 40 DFBB CCCC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 5077137 IJJVZAHPYTWIBN-UHFFFAOYSA-N 300.698 2.530 5 40 DFBB Cc1ccc(CNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 16094315 FDFUTMMQCGIPIW-UHFFFAOYSA-N 320.370 2.690 5 40 DFBB O=[N+]([O-])c1cccnc1Sc1nnc(C2CC2)n1C1CC1 8745606 MRTPOVRKVQQADG-UHFFFAOYSA-N 303.347 2.945 5 40 DFBB C[C@H]1CCCC[C@]12NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C2=O 8943856 XHMJFJKYYHYPLV-ZBEGNZNMSA-N 317.345 2.596 5 40 DFBB Cc1cc(NC(=O)N[C@@H](C)C2CCOCC2)ccc1[N+](=O)[O-] 97163039 NUFVHRQSLPLXQE-NSHDSACASA-N 307.350 2.840 5 40 DFBB Cc1[nH]nc(C(=O)N[C@@H]2C[C@@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] 77141358 OOMSRYAINCACDC-GHMZBOCLSA-N 320.736 2.566 5 40 DFBB 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O=[N+]([O-])c1ccc(NCCNCc2cccnc2)c(Cl)c1 8419365 ODLCWJKJXWZECT-UHFFFAOYSA-N 306.753 2.845 5 40 DFBB Cc1nc2oc3ccccc3c(=O)c2c(=O)n1-c1ccccc1 2360917 MZFLINSGPLPSMW-UHFFFAOYSA-N 304.305 2.801 5 40 DFBB CN(Cc1ccsc1)C(=O)c1cc([N+](=O)[O-])ccc1N(C)C 24384566 BWWJORPXKNGSEV-UHFFFAOYSA-N 319.386 2.995 5 40 DFBB CCOC(=O)c1ccoc1CNc1cc([N+](=O)[O-])ccc1OC 9749093 PHAIWAKPQRWMPQ-UHFFFAOYSA-N 320.301 2.985 5 40 DFBB CCc1ccc([C@@H]2COCCN2c2ccc([N+](=O)[O-])cn2)o1 96453862 OYUWEQPPADSXJP-ZDUSSCGKSA-N 303.318 2.723 5 40 DFBB C[C@@H]1CCC[C@@H](C)N1C[C@H](O)COc1ccccc1[N+](=O)[O-] 8241084 PKJOQFCLAGSZLV-MCIONIFRSA-N 308.378 2.597 5 40 DFBB Cc1nn(C)c(C)c1[C@H](C)C(=O)N(C)c1ccc([N+](=O)[O-])cc1 60379551 QXNYDNMTJYUTKX-JTQLQIEISA-N 316.361 2.712 5 40 DFBB C[C@H](O)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 97232711 AHQMFJZVVKNFDX-ZANVPECISA-N 312.753 2.624 5 40 DFBB CCC[C@H](C)NC(=O)/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2 13988533 VVXKXLJVMZNCAB-PORFMDCZSA-N 306.318 2.642 5 40 DFBB C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)Oc1ccccc1 70909040 BCTLHXGCWKRLCY-CYBMUJFWSA-N 314.341 2.721 5 40 DFBB Cc1ccccc1O[C@@H](Cc1cccc([N+](=O)[O-])c1)C(=O)O 225124969 NOUCTKXNAJCALZ-HNNXBMFYSA-N 301.298 2.978 5 40 DFBB O=C(c1ccncc1F)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 96481374 QAYNZVMHERVSPE-UHFFFAOYSA-N 315.304 2.934 5 40 DFBB CC(C)c1nc([C@H](C)Nc2ncc([N+](=O)[O-])c(N)n2)cs1 96418730 NYXFMHLAMFQVLG-ZETCQYMHSA-N 308.367 2.720 5 40 DFBB Cc1nonc1O[C@H](C)CNc1ccc([N+](=O)[O-])cc1Cl 5361181 YLIPGQUOGQTXLI-SSDOTTSWSA-N 312.713 2.819 5 40 DFBB COc1cc(N[C@H](C)Cn2nc(C)cc2C)ccc1[N+](=O)[O-] 95403119 MWFBRKSYTSMWRC-LLVKDONJSA-N 304.350 2.917 5 40 DFBB CCCc1[nH]nc(C(=O)NCc2ccccc2Cl)c1[N+](=O)[O-] 68450910 VUGZTQSYPHWQSF-UHFFFAOYSA-N 322.752 2.854 5 40 DFBB CC(C)N1CCN(c2cc(N3CCCC3)ccc2[N+](=O)[O-])CC1 45221451 JCIDKXXZKIJFAS-UHFFFAOYSA-N 318.421 2.725 5 40 DFBB O=[N+]([O-])c1cnccc1NCCc1csc(N2CCCC2)n1 76063850 QEYHKDQIOBEDJV-UHFFFAOYSA-N 319.390 2.701 5 40 DFBB Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@@H]3C23CC3)cc1[N+](=O)[O-] 4322673 OJTCDNPDVDMLQF-NEBZKDRISA-N 324.336 2.605 5 40 DFBB Cc1cc(C)c(NC(=S)NC(=O)c2ccco2)c([N+](=O)[O-])c1 5361601 KHKFBKLAMHHMFL-UHFFFAOYSA-N 319.342 2.931 5 40 DFBB Cc1cc(C)nc(Sc2nc3sccn3c2[N+](=O)[O-])n1 8308424 RBVBPQDHXATOOE-UHFFFAOYSA-N 307.360 2.862 5 40 DFBB O=[N+]([O-])c1c(N2CCc3ccccc3C2)nc2sccn12 8308291 GPALHPDBAZKOCP-UHFFFAOYSA-N 300.343 2.867 5 40 DFBB CC(C)O[C@@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1(C)C 95944391 LPHHUWIWQRLEJS-LSDHHAIUSA-N 320.389 2.846 5 40 DFBB Cc1cc(C)n2nc(SCc3ccc([N+](=O)[O-])cc3)nc2n1 217153 DDCZFLUAIWHZKF-UHFFFAOYSA-N 315.358 2.942 5 40 DFBB COc1cccc(OC)c1C(=O)OCc1ccc([N+](=O)[O-])cc1 3274982 SEMSSEAXEMVRLA-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB Cc1nc(N2CCC3(CC2)OCC(C)(C)CO3)ccc1[N+](=O)[O-] 95414903 BNQSWGQDTOTRDW-UHFFFAOYSA-N 321.377 2.668 5 40 DFBB C[C@]1(CO)CCCN1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 97376690 WOYMHIAWTQPWKK-CYBMUJFWSA-N 313.741 2.627 5 40 DFBB N#CN(Cc1nnsc1Cl)c1ccc(F)c([N+](=O)[O-])c1 83093600 MKFPWDHSYKVBDC-UHFFFAOYSA-N 313.701 2.726 5 40 DFBB COc1ccc(C(=O)OCc2ccccc2[N+](=O)[O-])cc1OC 6470334 PJWHAVMHAOKRMC-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB O=C(NCCc1cccs1)c1n[nH]c2ccc([N+](=O)[O-])cc12 28063664 ABIDMRJLAVPOLM-UHFFFAOYSA-N 316.342 2.505 5 40 DFBB CCNc1c([N+](=O)[O-])cc2c3c(cccc13)C(=O)N(CC)C2=O 95470826 SORXDYVTFLADGA-UHFFFAOYSA-N 313.313 2.796 5 40 DFBB O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 12998827 HGADRHXPHVBDFY-AWEZNQCLSA-N 320.732 2.712 5 40 DFBB COc1cc([N+](=O)[O-])ccc1OC1CN(C(=O)OC(C)(C)C)C1 66339835 GEGYXNNTJRXWKF-UHFFFAOYSA-N 324.333 2.602 5 40 DFBB C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1 5966585 WMVYFALSUCDEBM-LLVKDONJSA-N 314.297 2.779 5 40 DFBB O=[N+]([O-])c1ccc2nc(NCCCO[C@@H]3CCOC3)ccc2c1 95410677 QYMFBJYWNNAABA-CQSZACIVSA-N 317.345 2.751 5 40 DFBB O=C(O)/C=C/c1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 314710463 SUEQRMNQLAYYBV-QPJJXVBHSA-N 302.242 2.538 5 40 DFBB O=C(NC[C@@H]1CCCO1)c1cccc2nc3ccccc3nc12 5444618 DDBOESJGMIPTQZ-LBPRGKRZSA-N 307.353 2.692 5 40 DFBB O=C(Nc1nnc(-c2ccco2)o1)c1ccc([N+](=O)[O-])s1 4107268 LBUKJOBZESCKJM-UHFFFAOYSA-N 306.259 2.552 5 40 DFBB CCN(C(=O)COC(=O)c1ccc([N+](=O)[O-])o1)C1CCCCC1 3252833 DLLRJRFKUNWNIX-UHFFFAOYSA-N 324.333 2.526 5 40 DFBB COc1ccc(C(C)=O)cc1COC(=O)c1ccc([N+](=O)[O-])o1 3571597 BFTFDVOSDQRWHP-UHFFFAOYSA-N 319.269 2.756 5 40 DFBB O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCCC[C@H]1C(=O)O 6557309 UMTZIGJKVNAMAJ-VHSXEESVSA-N 310.281 2.563 5 40 DFBB Nc1c(C(=O)OCc2ccc([N+](=O)[O-])cc2)ccnc1Cl 89787925 ZOQGAZADNQLJHA-UHFFFAOYSA-N 307.693 2.582 5 40 DFBB Cc1ccc([C@H](C)NCC(=O)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] 95985983 NJQKPPYZGDUPRL-JSGCOSHPSA-N 319.405 2.812 5 40 DFBB Cc1ccc(S(=O)(=O)CC(=O)c2ccc([N+](=O)[O-])cc2)cc1 85466 YJNHDLDVJDLJAO-UHFFFAOYSA-N 319.338 2.560 5 40 DFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(c2ccccn2)CC1 15403823 QOUDKTJKBLWWRW-AWEZNQCLSA-N 312.373 2.873 5 40 DFBB O=[N+]([O-])c1ccc(NCCCCN2CCCC2)c([N+](=O)[O-])c1 32934500 FFWWTURDXMFCPF-UHFFFAOYSA-N 308.338 2.791 5 40 DFBB Cc1csc(Nc2ccc(NC(=O)[C@H]3C[C@@H]3[N+](=O)[O-])cc2)n1 69896437 AXPURAYRSAHXRO-RYUDHWBXSA-N 318.358 2.799 5 40 DFBB Cc1nn([C@H](C)C(=O)N[C@H](C)[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1[N+](=O)[O-] 101617441 DQKCGZGIMIXYSB-FZGMBXNASA-N 320.393 2.602 5 40 DFBB COc1cc(C)c2c(oc(=O)c3c(OC)cc(O)cc32)c1O 1079927066 GAPZXDWMRQPOCF-UHFFFAOYSA-N 302.282 2.683 5 40 DFBB biogenic COc1ccc(C2=N/C(=C\c3cccc([N+](=O)[O-])c3)C(=O)O2)cc1 4589826 NUQAKBHOJXKLPT-GDNBJRDFSA-N 324.292 2.948 5 40 DFBB O=[N+]([O-])c1cnc(NOCc2ccccc2)nc1NC1CC1 69418122 ZNZZNZKCAVDMOI-UHFFFAOYSA-N 301.306 2.503 5 40 DFBB COc1cccc(NC(=O)CSc2ccc([N+](=O)[O-])cn2)c1 160117815 TVCFVFYWPMPTEM-UHFFFAOYSA-N 319.342 2.729 5 40 DFBB O=C(O[C@H]1CCOC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 78948239 XQWXJSXCCQBBBI-QMMMGPOBSA-N 305.208 2.559 5 40 DFBB CC(=O)Nc1cccc(C(=O)OCc2cccc([N+](=O)[O-])c2)c1 3461750 MEDXKIAQCPQRFP-UHFFFAOYSA-N 314.297 2.910 5 40 DFBB COC(=O)c1cc2c(=O)c3ccccc3oc2nc1/C=C/N(C)C 52533991 MKXQOKVWFCHMBW-CMDGGOBGSA-N 324.336 2.660 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H](CC4)[C@H]3C2=O)c([N+](=O)[O-])c1 4121669 BVUUQMPZCQAOIE-HGSJOUDDSA-N 312.325 2.605 5 40 DFBB COc1ccc(OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 4361121 ABTFHVOLVFEEGJ-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB O=C1c2ccccc2-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3nc21 4644919 YVIIDDRFSDNIFW-UHFFFAOYSA-N 322.236 2.658 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)NCc1ccccc1Cl 8211210 CMXLIRRVKWZDAN-UHFFFAOYSA-N 319.748 2.977 5 40 DFBB Cc1cnc(N[C@@H](c2nnc3n2CCC3)C(C)C)c([N+](=O)[O-])c1 95415006 UIINIINERZTKMV-CYBMUJFWSA-N 316.365 2.645 5 40 DFBB COc1cccc(NCc2cccc(N(C)C)n2)c1[N+](=O)[O-] 185630839 BNHBHPJQRZKCQA-UHFFFAOYSA-N 302.334 2.677 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N1CCC(Nc2ccc(F)cc2)CC1 49980277 FDKRONDWOSZJOW-UHFFFAOYSA-N 319.340 2.548 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1cnn(C)c1C 97145749 NUIWKNHTWIEUAG-UHFFFAOYSA-N 317.349 2.575 5 40 DFBB COc1ccc(/C=C2/N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1 346904 WOOALORAUNALDW-XNTDXEJSSA-N 324.292 2.948 5 40 DFBB Cc1ccc(C(=O)Nc2nnc(C3CC3)s2)cc1[N+](=O)[O-] 22738476 DAHAUKLLQRXDQS-UHFFFAOYSA-N 304.331 2.884 5 40 DFBB O=[N+]([O-])C[C@@H](OCCCCCCO)C(Cl)(Cl)Cl 2031760 BIMNXYOIXCLXHZ-MRVPVSSYSA-N 308.589 2.571 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC([C@H](O)c3ccccc3)CC2)nc1 22406230 HBOABQFYABPMNL-QGZVFWFLSA-N 313.357 2.940 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(-c2nnco2)c1 24743578 DQKHMJSFMOYLBC-UHFFFAOYSA-N 324.296 2.826 5 40 DFBB Cc1ccc([C@H](O)CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 31098436 HBOOUZUZSRSKHN-OAHLLOKOSA-N 315.329 2.758 5 40 DFBB Cc1cc([N+](=O)[O-])nc2c1NC(=O)c1cccnc1N2C1CC1 39026528 ILSADLPHOZPXCQ-UHFFFAOYSA-N 311.301 2.559 5 40 DFBB in-vitro NC(=O)Nc1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1 69348628 IBWXROCXEGIFAT-UHFFFAOYSA-N 304.281 2.837 5 40 DFBB Cc1ccc([N+](=O)[O-])c(N2CCO[C@@H](c3cccc(O)c3)C2)n1 89601906 IUVYXZUDHBJTOQ-OAHLLOKOSA-N 315.329 2.582 5 40 DFBB O=[N+]([O-])c1ccc(Br)cc1[C@@H](O)C(F)(F)F 1857793251 YAPTXGJGVFZMQJ-SSDOTTSWSA-N 300.030 2.953 5 40 DFBB O=C(NCC(=O)c1ccccc1)OCc1ccc([N+](=O)[O-])cc1 335942 CHRREKHXPJUTHV-UHFFFAOYSA-N 314.297 2.704 5 40 DFBB Cc1nc(NC(=O)Cc2ccc(F)cc2F)ccc1[N+](=O)[O-] 95417319 ZFIKGTLYIQQOJA-UHFFFAOYSA-N 307.256 2.758 5 40 DFBB CC(=O)N[C@@H](C)C1CCN(c2cccc(C)c2[N+](=O)[O-])CC1 225460336 CCZCCVPKQCYRAM-LBPRGKRZSA-N 305.378 2.644 5 40 DFBB CCO[C@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C12CCC2 96423442 ATBCIQKYYXHTSK-CABCVRRESA-N 318.373 2.601 5 40 DFBB O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccc(F)cc1 993539 FLMVARQXYYHCKO-UHFFFAOYSA-N 300.245 2.530 5 40 DFBB Cc1cnc(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)cn1 25829518 LVGHAUNBXRJBOO-LLVKDONJSA-N 300.318 2.526 5 40 DFBB CC(C)Cn1ccc2cc(NC(=O)[C@H]3C[C@H]3[N+](=O)[O-])ccc21 84575380 BMQRJUMQBRKSFM-DZGCQCFKSA-N 301.346 2.901 5 40 DFBB CCOC(=O)c1cc2ccc(=O)c3c(C)oc(C)c3c2oc1=O 12296829 NYNNOJKBOCZRFQ-UHFFFAOYSA-N 314.293 2.693 5 40 DFBB biogenic O=[N+]([O-])c1cc(NC(=S)NC[C@H]2CCCO2)ccc1Cl 7521344 GVNZJHSRROSZIL-SECBINFHSA-N 315.782 2.714 5 40 DFBB CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)c2ccccc2)c1 95974944 HHHFBPXCKKLCKG-HNNXBMFYSA-N 302.330 2.773 5 40 DFBB Cc1cc(NC(=O)NC[C@@H](O)c2ccsc2)ccc1[N+](=O)[O-] 97049337 IUKLERVQWGTWLL-CYBMUJFWSA-N 321.358 2.820 5 40 DFBB CC(=O)N1CC[C@@H](CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 97233691 YITRCDXXCWDSGP-HIFRSBDPSA-N 319.405 2.764 5 40 DFBB Cc1c(C(=O)NCCOCc2ccccc2)cccc1[N+](=O)[O-] 177075805 XPFMYVJRJIUJHL-UHFFFAOYSA-N 314.341 2.850 5 40 DFBB S=C(Nc1cc2ncccc2c2cccnc12)N1CCOCC1 6257785 NTGVJSDSCGMCQN-UHFFFAOYSA-N 324.409 2.812 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)NC2CCCCCC2)c1 22516459 OKVKUPPBXGEQMN-UHFFFAOYSA-N 312.391 2.737 5 40 DFBB Cc1cc(Nc2ccc(F)cc2)nc(-n2cc([N+](=O)[O-])cn2)n1 4942012 ABRHBJDNPCPTSG-UHFFFAOYSA-N 314.280 2.762 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1F)NC1CCCCC1 95450194 XCTNAQZGHIBLFV-UHFFFAOYSA-N 324.356 2.778 5 40 DFBB COc1ccccc1NC(=O)CNc1cccc([N+](=O)[O-])c1 7954326 LKTZVNXVIQYRMJ-UHFFFAOYSA-N 301.302 2.654 5 40 DFBB O=C(c1cnc2ccccc2n1)N1CCc2cc([N+](=O)[O-])ccc21 57836802 QSTVRAQXQMQDLY-UHFFFAOYSA-N 320.308 2.741 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccccc1Cl 2627328 RLGGPXRZRMBGHA-UHFFFAOYSA-N 324.676 2.637 5 40 DFBB O=C(Nc1cc2ccncc2c2ncccc12)N1CCOCC1 408976080 OZAIQTBLXZEAOO-UHFFFAOYSA-N 308.341 2.647 5 40 DFBB C[C@H](NC(=O)N[C@@H](C)C1CCOCC1)c1cccc([N+](=O)[O-])c1 97015968 PFNDYUFQIMNUIA-RYUDHWBXSA-N 321.377 2.770 5 40 DFBB COc1cccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)c1 430104 JXJTVENZALOBRF-GDNBJRDFSA-N 324.292 2.948 5 40 DFBB Cc1ccc(S(=O)(=O)[C@@H](C[N+](=O)[O-])c2ccccc2)cc1 1715494 LYHUVMDNSSMZFF-HNNXBMFYSA-N 305.355 2.787 5 40 DFBB C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OCC[N+](C)(C)C 4190271 OXFVCJADQQBIHC-ZDUSSCGKSA-O 304.414 2.531 5 40 DFBB O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1cccnc1 20238371 UWMHOENNRNIUOX-UHFFFAOYSA-N 303.343 2.862 5 40 DFBB Cc1cnc(Oc2ccc(C(=O)NC3CC3)cc2)c([N+](=O)[O-])c1 78632249 PNBPQZLMXKVGLD-UHFFFAOYSA-N 313.313 2.983 5 40 DFBB O=C1C=CC(=O)N1c1ccc2c(c1)Cc1cc([N+](=O)[O-])ccc1-2 1614576 MKUMBIWDLOVHJY-UHFFFAOYSA-N 306.277 2.595 5 40 DFBB CCc1cccc(C)c1NC(=O)Cn1cc([N+](=O)[O-])nc1C 65711693 WFAQOZCQIWFBTQ-UHFFFAOYSA-N 302.334 2.609 5 40 DFBB Cc1cccc(OCCNC(=O)Cc2ccccc2[N+](=O)[O-])c1 21785177 GABIGALJTKAVDM-UHFFFAOYSA-N 314.341 2.641 5 40 DFBB CCN(c1ccccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 225026988 UBYWATRDZGAALY-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB O=[N+]([O-])c1ccc([C@@H]2ON=C(c3ccccc3)[C@H]2[N+](=O)[O-])cc1 4016988 HLCKDFGBHDBICY-CABCVRRESA-N 313.269 2.716 5 40 DFBB COc1ccc(C(=O)COc2ccccc2[N+](=O)[O-])cc1OC 5109099 IXWROZBUOIGMBQ-UHFFFAOYSA-N 317.297 2.874 5 40 DFBB COc1ccc(CCNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 5925990 GSEZQWIWRJRAAR-UHFFFAOYSA-N 314.341 2.884 5 40 DFBB C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@H](c2ccccc2)O1 58282703 SUBDXADFZYXTFU-SMDDNHRTSA-N 316.313 2.790 5 40 DFBB CNc1ccc(CN2CCC[C@@H](c3cn[nH]c3)C2)cc1[N+](=O)[O-] 92809759 MSACGRBGMPGRLE-CYBMUJFWSA-N 315.377 2.739 5 40 DFBB Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CC(=O)N(C2CC2)C1 225545222 FRWKLUWCIWBZPR-SNVBAGLBSA-N 323.780 2.979 5 40 DFBB O=[N+]([O-])c1cnn(CCO)c1-c1ccc(Cl)cc1Cl 96527516 ICPDSRMVTNQRSE-UHFFFAOYSA-N 302.117 2.757 5 40 DFBB CO[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 56471878 OGWMHJHODNOBRH-INIZCTEOSA-N 314.341 2.641 5 40 DFBB Cc1cc(C(=O)NCCCN2CCCCC2)ccc1[N+](=O)[O-] 8278767 VVLJQPCJLCOXGO-UHFFFAOYSA-N 305.378 2.509 5 40 DFBB CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 20001377 RNWLRFBMGFEJFG-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB Cc1cc(NC(=O)N[C@@H](CO)c2ccccc2)ccc1[N+](=O)[O-] 97163045 RWCOFBDRRRYHAH-AWEZNQCLSA-N 315.329 2.758 5 40 DFBB CC(C)(C)OC(=O)N1CCC[C@@H](Oc2ccc([N+](=O)[O-])cn2)C1 40434894 IJLKUIAADAPLFZ-GFCCVEGCSA-N 323.349 2.768 5 40 DFBB COC(=O)c1ccc([N+](=O)[O-])c(OC(=O)c2ccc(C)cc2)c1 42303 NFJRQFGDQSWGDP-UHFFFAOYSA-N 315.281 2.909 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@H]2C[C@H]3[C@H]4C=C[C@@H]4[C@H]23)c([N+](=O)[O-])c1 104286406 SREHYKGRATYLGD-YLXLXVFQSA-N 302.286 2.840 5 40 DFBB CC1=C(C)C[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C(=O)O)C1 4651855 GILTVGMGRNATNP-ZIAGYGMSSA-N 318.329 2.981 5 40 DFBB O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[C@H]1c1ccco1 97080970 BEDOHSPCULMSLH-NSHDSACASA-N 302.290 2.952 5 40 DFBB O=[N+]([O-])c1cc(S(=O)(=O)NC2CCCCC2)ccc1Cl 5214259 OYBPFDOERQTRBC-UHFFFAOYSA-N 318.782 2.859 5 40 DFBB COc1ccc2oc3cc(NCCN(C)C)ccc3c(=O)c2c1 5487743 XPEPALZZESYTMY-UHFFFAOYSA-N 312.369 2.928 5 40 DFBB CC(C)(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCC(=O)O 22015594 AVCXWZHKYDVBIA-UHFFFAOYSA-N 308.334 2.587 5 40 DFBB O=[N+]([O-])c1ccc(C(N2CCCCO2)N2CCCCO2)cc1 3151844 MAXCRZFMYMTGTG-UHFFFAOYSA-N 307.350 2.648 5 40 DFBB CNc1ccc(CN2CCC[C@H](c3cn[nH]c3)C2)cc1[N+](=O)[O-] 92809758 MSACGRBGMPGRLE-ZDUSSCGKSA-N 315.377 2.739 5 40 DFBB O=[N+]([O-])c1cccc(CS(=O)(=O)Nc2cccc(F)c2)c1 20045839 VGXFJUDWAHZADY-UHFFFAOYSA-N 310.306 2.676 5 40 DFBB COc1ccc(C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 3850635 FGNNBMWPOQZIHL-UHFFFAOYSA-N 317.297 2.852 5 40 DFBB biogenic Cc1cc(NC(=O)N(C)CC2CCOCC2)ccc1[N+](=O)[O-] 97095994 DZPGDSHXWQXWTQ-UHFFFAOYSA-N 307.350 2.794 5 40 DFBB COc1ccc(NC(=O)CNc2ccc(F)cc2)c([N+](=O)[O-])c1 7971673 QYYFOKUWZZOQPC-UHFFFAOYSA-N 319.292 2.793 5 40 DFBB Cc1csc(CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)n1 56458368 VRMXDLHEPUCIJH-UHFFFAOYSA-N 316.342 2.771 5 40 DFBB O=[N+]([O-])c1ccccc1NC[C@H](O)COc1ccc(F)cc1 57149210 XQOVTFDLHPJYBB-LBPRGKRZSA-N 306.293 2.586 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1CCOc1ccc2ccccc2c1 48300125 ZTCOAGHETBXPES-UHFFFAOYSA-N 310.309 2.989 5 40 DFBB Cc1nc(NCc2ccco2)nc(N2CCCCC2)c1[N+](=O)[O-] 56905970 RNLPMAKELKJKNP-UHFFFAOYSA-N 317.349 2.889 5 40 DFBB Cn1ncc2c(Oc3ccc([N+](=O)[O-])cc3Cl)ncnc21 21962781 MGVLRSWPSGRQMD-UHFFFAOYSA-N 305.681 2.717 5 40 DFBB Cc1n[nH]c(SCC(=O)N[C@@H](C)c2ccccc2)c1[N+](=O)[O-] 4872876 KNEBWLGOFPXWFZ-VIFPVBQESA-N 320.374 2.596 5 40 DFBB O=C(Nc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1)C1CC1 24529029 MTUYWYOOKYEUJE-UHFFFAOYSA-N 312.329 2.950 5 40 DFBB COC(=O)c1ccc(OC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 5960726 HBYOVKAPJFPZGQ-UHFFFAOYSA-N 315.281 2.909 5 40 DFBB CN(C)C1(CNC(=O)c2ccccc2[N+](=O)[O-])CCCCC1 8673899 KKBWLSGLUJVUFH-UHFFFAOYSA-N 305.378 2.589 5 40 DFBB COc1ccc([N+](=O)[O-])cc1COC(=O)C1CCSCC1 69972010 GCWYTDNFWKPXJR-UHFFFAOYSA-N 311.359 2.790 5 40 DFBB CC[C@@]1(C)CN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CCO1 187881656 PUMCQCMLOBTTJV-WBMJQRKESA-N 321.377 2.866 5 40 DFBB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccccc1[N+](=O)[O-] 2637438 QJSWEBLAZJDSFF-NSHDSACASA-N 318.354 2.735 5 40 DFBB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccccc1[N+](=O)[O-] 2637439 QJSWEBLAZJDSFF-LLVKDONJSA-N 318.354 2.735 5 40 DFBB O=C(Nc1ccccc1)c1ccc([N+](=O)[O-])cc1SCCO 3618386 QGRYBRWQDCNSAZ-UHFFFAOYSA-N 318.354 2.932 5 40 DFBB C[C@@H](Nc1ncccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 15118867 LRKCSNAOQAYAEN-SNVBAGLBSA-N 321.358 2.566 5 40 DFBB O=[N+]([O-])c1ccc(N(Cc2ccco2)C[C@H]2CCCO2)nc1 95421585 GDUWMZMRTVUPRH-CQSZACIVSA-N 303.318 2.768 5 40 DFBB CC(C)=C1[C@H]2C=C[C@H]1[C@H]1C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]21 408726500 BYNDNQCFRFWSEO-XOUADPBQSA-N 324.336 2.853 5 40 DFBB C[C@H](OC(=O)[C@H]1C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] 245281180 ABEGTQJLWHFYNH-BPNCWPANSA-N 315.329 2.736 5 40 DFBB Cc1ccc(C)c(Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)c1 5453441 LKHCXSJDNVXFKC-UHFFFAOYSA-N 309.325 2.970 5 40 DFBB O=C(O)c1ccc(Cn2cc([N+](=O)[O-])c(C(F)(F)F)n2)cc1 2537847 NUZNEXWCYYQZTM-UHFFFAOYSA-N 315.207 2.557 5 40 DFBB CN(Cc1cccc(F)c1)C(=O)Cc1ccccc1[N+](=O)[O-] 14167376 SKMDHNBLDZDMLB-UHFFFAOYSA-N 302.305 2.935 5 40 DFBB O=C(NC1CC1)[C@@H](Oc1ccc([N+](=O)[O-])cc1)c1ccccc1 8291142 MWHYTVAVDBJIBQ-INIZCTEOSA-N 312.325 2.994 5 40 DFBB COCCNC(=O)c1ccc2[nH]c3nc4ccccc4nc3c2c1 408975461 KQMVTJKCPGGOIF-UHFFFAOYSA-N 320.352 2.641 5 40 DFBB COc1ccc(O[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)cc1 225126291 OPJXRZVJXQTCPB-HNNXBMFYSA-N 317.297 2.678 5 40 DFBB O=C(C[C@H](C(=O)O)[C@H](c1ccccc1)[N+](=O)[O-])c1ccccc1 1687174 OXISQRBRNJKOGQ-HOCLYGCPSA-N 313.309 2.978 5 40 DFBB O=[N+]([O-])c1ccc(F)cc1OCc1nc(-c2ccncc2)no1 1422052 DAVUGTJVJJWCNP-UHFFFAOYSA-N 316.248 2.758 5 40 DFBB CNc1ccc(C(=O)N2CCc3sccc3C2)cc1[N+](=O)[O-] 12214924 YFBHEPYFKITJCE-UHFFFAOYSA-N 317.370 2.897 5 40 DFBB C[C@H](CNc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1F 4687291 WXJKKJKZLQZYCA-LLVKDONJSA-N 317.320 2.964 5 40 DFBB CCS[C@@H]1CCCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 71899607 GBQHGLDDIUCWCA-GFCCVEGCSA-N 323.418 2.806 5 40 DFBB COc1ccc(-c2nc(N)c3c(=O)oc4ccccc4c3n2)cc1 5335459 GUASBJRXGBKEDO-UHFFFAOYSA-N 319.320 2.994 5 40 DFBB O=C(O)[C@@H](Cc1ccccc1)NSc1ccccc1[N+](=O)[O-] 28631502 JPFBMBJXDGJTDF-GFCCVEGCSA-N 318.354 2.887 5 40 DFBB Cc1ccc([C@@H](O)CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 31098434 HBOOUZUZSRSKHN-HNNXBMFYSA-N 315.329 2.758 5 40 DFBB CC[C@@H]1CCCCN1CCCNC(=O)c1cccc([N+](=O)[O-])c1 13670698 AKZZETJDPBWWOE-OAHLLOKOSA-N 319.405 2.979 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1ccccc1[N+](=O)[O-] 3502513 RPAZYTPWCSLXDN-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB CCCc1nnc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])o1 7605271 URGOQYDKMWJYLD-UHFFFAOYSA-N 310.291 2.990 5 40 DFBB O=C(CNc1cccc([N+](=O)[O-])c1)NCc1ccc(Cl)cc1 8211203 ICHKGLRVSRHJSD-UHFFFAOYSA-N 319.748 2.977 5 40 DFBB O=C(NC1CCCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc12 28027685 ZUJIITQRGHNNAG-UHFFFAOYSA-N 302.334 2.924 5 40 DFBB O=C(NCCOc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])o1 25190520 PJRGGWQZGJDAQQ-UHFFFAOYSA-N 310.693 2.650 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1)c1c(O)c2ccccc2oc1=O 100771487 NSVOQCVVOPNJJZ-UHFFFAOYSA-N 311.249 2.638 5 40 DFBB Cc1ccc(-c2nn3cnc4ccccc4c3nc2=O)cc1C 32824453 KNUCBFGCLQDYJU-UHFFFAOYSA-N 302.337 2.922 5 40 DFBB CC(C)CCNc1nc(N)c([N+](=O)[O-])c(N2CCC[C@@H](C)C2)n1 5164049 IXGLTKDEKSLSDZ-LLVKDONJSA-N 322.413 2.661 5 40 DFBB CCCCCCNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 4603949 DBRXTKCPKUBZPU-UHFFFAOYSA-N 308.334 2.692 5 40 DFBB NC(=O)c1ccc(-c2ccc(Br)cc2[N+](=O)[O-])o1 73640475 GXHMQARSOSAQRV-UHFFFAOYSA-N 311.091 2.716 5 40 DFBB CC1=C([N+](=O)[O-])[C@H](c2ccccc2C(F)(F)F)NC(=O)N1 40550 BDJSNQKPJFTJCV-VIFPVBQESA-N 301.224 2.568 5 40 DFBB CCC(=O)NC(=S)Nc1cc(Cl)c([N+](=O)[O-])cc1C 9140816 KZDDJMGEGMVWAH-UHFFFAOYSA-N 301.755 2.780 5 40 DFBB O=C(NCc1nc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])cc1 33538778 IJEUWNFVASGPDM-UHFFFAOYSA-N 324.296 2.575 5 40 DFBB C[C@@](O)(CNc1ccncc1[N+](=O)[O-])c1ccc(F)cc1F 79311314 ZKBCABJUBOSXRA-CQSZACIVSA-N 309.272 2.588 5 40 DFBB Cc1ccc(NC(=O)c2c(C)cc(=O)oc2C)cc1[N+](=O)[O-] 506139 RWAKJJTXSUEDOC-UHFFFAOYSA-N 302.286 2.726 5 40 DFBB CCn1c(=O)c([N+](=O)[O-])c(NC[C@H]2CCCO2)c2ccccc21 5573290 HBBBFUILSMIJBM-LLVKDONJSA-N 317.345 2.521 5 40 DFBB O=[N+]([O-])c1cc(Oc2ccc(F)cc2F)cc(-n2cnnn2)c1 12428527 CELPGQAYJJFIDS-UHFFFAOYSA-N 319.227 2.641 5 40 DFBB O=C1[C@H]2Nc3ccccc3N=C2O[C@H]1c1cccc([N+](=O)[O-])c1 104239958 ARUUAPLLTWATDF-HIFRSBDPSA-N 309.281 2.760 5 40 DFBB O=C(O)c1cccc(Cn2cc([N+](=O)[O-])c(C(F)(F)F)n2)c1 2537851 QLPYRINEACCJCJ-UHFFFAOYSA-N 315.207 2.557 5 40 DFBB O=C(C1CCCCC1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 48305809 QHTRMOUAJUEYIA-UHFFFAOYSA-N 317.389 2.824 5 40 DFBB CS[C@H]1CC[C@@H](NC(=O)c2cc(F)c([N+](=O)[O-])cc2F)C1 95990197 HIYQQSZQPANSQN-SFYZADRCSA-N 316.329 2.887 5 40 DFBB CC(=O)Nc1ccc(CCNCc2cccc([N+](=O)[O-])c2)cc1 78411703 KYIWLZGVRIUSOO-UHFFFAOYSA-N 313.357 2.886 5 40 DFBB C[C@H]1CCN(C(=O)c2c[nH]c(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C 96011247 MHHOKEODINYRFM-QWRGUYRKSA-N 314.345 2.855 5 40 DFBB C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1COc2ccccc21 95438294 IDBKDWGBSDZNGY-SMDDNHRTSA-N 312.325 2.889 5 40 DFBB CC(C)N(C)C(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 97085530 ZSXWCJFZTLVNHP-UHFFFAOYSA-N 320.267 2.859 5 40 DFBB CCc1ccccc1NC(=O)CNc1nccc(C)c1[N+](=O)[O-] 72286167 XOGODRVGMOGLBM-UHFFFAOYSA-N 314.345 2.911 5 40 DFBB CCN(c1ccc(F)cc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1 194771644 FTQITYROFARYKS-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB COc1ccc(C)nc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 96445656 KKXAKWMDLXKTLN-UHFFFAOYSA-N 301.302 2.868 5 40 DFBB O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 247349456 VTAPUJBSGAMKHF-GYBADROVSA-N 318.716 2.560 5 40 DFBB CN(Cc1ccco1)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] 8707312 DOFLRXJYYQPSPR-UHFFFAOYSA-N 315.329 2.716 5 40 DFBB CCC[C@H]1C[C@@H]1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 75373720 JDQUKFHBYWOWNB-NHYWBVRUSA-N 314.345 2.699 5 40 DFBB O=C1NC(S)=N/C1=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 47029 GPVFYSDCGZVELB-JXMROGBWSA-N 315.310 2.611 5 40 DFBB O=C(O)C[C@@H](NC(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1 5158118 DZXRFGNVEBDLQJ-CQSZACIVSA-N 314.297 2.541 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c([N+](=O)[O-])c1 13467736 UEXKHZZFXLMYOJ-MNOVXSKESA-N 304.302 2.509 5 40 DFBB Cc1ccc([C@@H](C)NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 13938176 DYMIIJNLLPBJBQ-GFCCVEGCSA-N 320.370 2.943 5 40 DFBB O=C(O)CCCCCO[C@H](C[N+](=O)[O-])C(Cl)(Cl)Cl 2031757 CKFBVZVFNWQUEM-SSDOTTSWSA-N 322.572 2.664 5 40 DFBB CN(C[C@@H](O)COc1ccc([N+](=O)[O-])cc1)C1CCCCC1 6001525 AHIOSJCLDVYQCM-OAHLLOKOSA-N 308.378 2.599 5 40 DFBB COc1ccc(NC(=O)c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 6145684 ZKKJMIJQMSMERK-UHFFFAOYSA-N 316.269 2.584 5 40 DFBB Cc1cc(N[C@@H](c2nnc3n2CCC3)C(C)C)ncc1[N+](=O)[O-] 95415004 SNOGGUMGMZDHGS-CQSZACIVSA-N 316.365 2.645 5 40 DFBB CC[C@H](NC(=O)C=C1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 96012444 QEODTMWSSGUJFP-INIZCTEOSA-N 317.389 2.814 5 40 DFBB O=c1ccn(C2CC2)c(SCc2ccccc2[N+](=O)[O-])n1 69561293 HKKDQEBNKLWSLL-UHFFFAOYSA-N 303.343 2.779 5 40 DFBB O=c1c2ccc(F)cc2ncn1Cc1c(F)cccc1[N+](=O)[O-] 69773198 XQSBJACJTNQIFU-UHFFFAOYSA-N 317.251 2.631 5 40 DFBB COC(=O)COc1ccc(/C=C/c2onc(C)c2[N+](=O)[O-])cc1 33688999 INLIQVJKCVQQQW-VMPITWQZSA-N 318.285 2.613 5 40 DFBB Cc1ccc([C@H](C)OC(=O)c2ccn(C)c(=O)c2)cc1[N+](=O)[O-] 79057077 YEVSDNOJSPAGSJ-NSHDSACASA-N 316.313 2.520 5 40 DFBB O=C1NCCCC[C@@H]1Sc1nc2ccc([N+](=O)[O-])cc2s1 11075377 USCGGNIQELCAEV-JTQLQIEISA-N 323.399 2.965 5 40 DFBB O=C(Nc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 20496183 QOHZZMYZKMZNDU-UHFFFAOYSA-N 310.269 2.897 5 40 DFBB CCc1cccc(NC(=O)COc2cccnc2[N+](=O)[O-])c1 5970757 HDUWXXUCRGCKAO-UHFFFAOYSA-N 301.302 2.570 5 40 DFBB C[C@H]1CCC[C@H](C)N1C[C@H](O)COc1ccccc1[N+](=O)[O-] 8298346 PKJOQFCLAGSZLV-IHRRRGAJSA-N 308.378 2.597 5 40 DFBB O=C(c1ccc([N+](=O)[O-])s1)N1CCn2c1nc1ccccc12 12544300 TXHBOOMBOGUTOH-UHFFFAOYSA-N 314.326 2.666 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)COc1ccccc1 24946493 DDSVJFWBUBGOKM-UHFFFAOYSA-N 300.314 2.632 5 40 DFBB CCC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 8143736 FKFNZHIGMUDAIA-UHFFFAOYSA-N 305.256 2.552 5 40 DFBB Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC1(O)CCCC1 97145764 IWGUQQAKJKGMGV-UHFFFAOYSA-N 321.377 2.980 5 40 DFBB O=C(OCc1cccc([N+](=O)[O-])c1)c1ccnc(-n2ccnc2)c1 124997942 MOHRWEQXSPYRNX-UHFFFAOYSA-N 324.296 2.533 5 40 DFBB Cc1c(CNc2cccc(-n3nnnc3C)c2)cccc1[N+](=O)[O-] 96427428 IUVGLVABTVYXHF-UHFFFAOYSA-N 324.344 2.799 5 40 DFBB O=C(NCC1(CCO)CCCC1)Nc1ccc([N+](=O)[O-])cc1 96443636 SGJBZXIFDXRWDT-UHFFFAOYSA-N 307.350 2.659 5 40 DFBB O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC[C@H]2c2ccco2)cc1 15836419 UPKOAMSQQTYWOG-ZDUSSCGKSA-N 322.342 2.714 5 40 DFBB O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCc2ccccc21 28027376 BLSAXKXZAXZFMK-UHFFFAOYSA-N 308.297 2.674 5 40 DFBB CCc1nc(CCNC(=O)c2ccc([N+](=O)[O-])cc2)sc1C 69966923 NYYHKVIFVJVEMD-UHFFFAOYSA-N 319.386 2.895 5 40 DFBB O=C(NCc1cc2cc(F)ccc2s1)c1n[nH]cc1[N+](=O)[O-] 95978334 DHCQTQODUNZHNM-UHFFFAOYSA-N 320.305 2.602 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1O)N1CC2(CC2)c2ccccc21 89857852 HDUQPYTZEJLNQL-UHFFFAOYSA-N 310.309 2.992 5 40 DFBB Cc1cc(N)nc(SCCCOc2ccc([N+](=O)[O-])cc2)n1 48363856 IKSIKLMQBPNHAD-UHFFFAOYSA-N 320.374 2.837 5 40 DFBB Cc1ccc(C(=O)NCCOc2ccccc2)cc1[N+](=O)[O-] 16009323 PPRIGQFZCYOWJR-UHFFFAOYSA-N 300.314 2.712 5 40 DFBB Cc1ccc(S(=O)(=O)N2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 4844419 KBNDEGGNKFKUEN-VYRBHSGPSA-N 318.354 2.649 5 40 DFBB CC[N+](C)(CC)CCC[C@@H](C)N1C(=O)[C@H]2CCCC[C@H]2C1=O 104377565 YXUAYPZTVHXYSJ-OAGGEKHMSA-N 309.474 2.817 5 40 DFBB NC(=O)c1ccc(N2CC3C[C@H]4CC2C[C@@H](C3)C4)c([N+](=O)[O-])c1 65946851 HJVKEDPXWDBYFA-KCXRBIIJSA-N 315.373 2.709 5 40 DFBB O=C(CCOc1ccc([N+](=O)[O-])cc1)NCc1ccccc1 31553273 TZIGEIZCAQCZCO-UHFFFAOYSA-N 300.314 2.680 5 40 DFBB CC(=O)N[C@H]1CC2c3ccccc3C1([N+](=O)[O-])c1ccccc12 5124851 NFIAYESAWHZVDM-GMXGEUMGSA-N 308.337 2.561 5 40 DFBB CCCCN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1ccc([N+](=O)[O-])cc1 5596581 QIVUKYXJVZGOBR-HIFRSBDPSA-N 320.345 2.759 5 40 DFBB Cc1nc2ccc(NCCN(C)C)c3c(=O)c4ccccc4n1c23 5723877 WTFFYWWTDRXKDI-UHFFFAOYSA-N 320.396 2.721 5 40 DFBB in-vivo O=C(C[S@](=O)c1ccccc1[N+](=O)[O-])OC1CCCCC1 74952 ZKLQUAVOTDHGKM-OAQYLSRUSA-N 311.359 2.578 5 40 DFBB Cc1ccc(-n2c3nc(=O)[nH]c(=O)c-3cc3ccccc32)cc1C 520324 ZTVBHJSVQZLGQQ-UHFFFAOYSA-N 317.348 2.796 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)C[C@@H](C)C1 6409776 IDHCWKFTMSJFPY-VXGBXAGGSA-N 321.377 2.520 5 40 DFBB COc1ccc(NC(=O)c2ccccc2OC)c([N+](=O)[O-])c1 4576906 REWHQZQUMNUVOH-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CCO[C@H]1C[C@@H](O)C12CCN(c1ccc(C)cc1[N+](=O)[O-])CC2 84800922 QGSYNLALEKHAHC-CVEARBPZSA-N 320.389 2.660 5 40 DFBB Cc1cc(N[C@H]2CCC[C@H]2C(N)=O)c2cccc([N+](=O)[O-])c2n1 95463622 YNAKUYOHZRALFL-NEPJUHHUSA-N 314.345 2.517 5 40 DFBB C[C@H]1CCc2ccccc2N1C(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1 180504256 HHZOWXONHLHTEY-NWDGAFQWSA-N 314.345 2.720 5 40 DFBB Cc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)cc1[N+](=O)[O-] 100522369 FUMNLCOHMGSPJE-LWWSYDQCSA-N 312.325 2.605 5 40 DFBB O=[N+]([O-])c1ccc(NCCNCc2ccc3c(c2)OCO3)cc1 8418996 ZSWWQRUJHSKOLM-UHFFFAOYSA-N 315.329 2.525 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1NC[C@@H]([C@H]1CCOC1)N1CCCC1 44976808 APHADQOHQAZUCW-LRDDRELGSA-N 323.368 2.647 5 40 DFBB O=C(NC1CCN(C2CC2)CC1)c1ccc(Cl)cc1[N+](=O)[O-] 29091654 SICIFJZRFKSXLC-UHFFFAOYSA-N 323.780 2.605 5 40 DFBB O=C(O[C@@H]1[C@H]2CC[C@@H]2[C@H]2C[C@H]12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 103936012 DDDKPZKIQUKROA-DGBSFBLISA-N 318.285 2.704 5 40 DFBB C[C@@H](OCCCNc1ncc([N+](=O)[O-])cn1)c1ccccc1 96011480 QMBJJYUGDQRWHR-GFCCVEGCSA-N 302.334 2.965 5 40 DFBB Cc1nonc1O[C@@H](C)CNc1ccc(Cl)cc1[N+](=O)[O-] 4695994 AHYNAWVBDOVMFE-ZETCQYMHSA-N 312.713 2.819 5 40 DFBB Cc1cnc(OCc2cc3ccccc3c(=O)[nH]2)c([N+](=O)[O-])c1 97096261 FOWNKAVHIWFUDT-UHFFFAOYSA-N 311.297 2.719 5 40 DFBB Cc1nnc(S/C(=C\c2ccc([N+](=O)[O-])cc2)C(=O)O)o1 211536398 OHLLXZPQBNOIDH-POHAHGRESA-N 307.287 2.504 5 40 DFBB O=[N+]([O-])c1ncn(Cc2ncc(-c3ccccc3Cl)o2)n1 96424876 FUHCAZUMOIGMOK-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1 5971276 WESRWUYTGHMHMN-SECBINFHSA-N 305.265 2.535 5 40 DFBB Cc1cc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)o1 4931700 HUNBBSPGLJNPHS-UHFFFAOYSA-N 318.285 2.600 5 40 DFBB CC(C)[C@@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 8747219 NYCBHQUKBIYTEY-CYBMUJFWSA-N 319.405 2.972 5 40 DFBB CC(=O)N[C@H]1CCCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 96453575 YSZWGMPKVFUAKC-NSHDSACASA-N 311.769 2.662 5 40 DFBB COc1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1 346909 WOOALORAUNALDW-GDNBJRDFSA-N 324.292 2.948 5 40 DFBB O=C(Cc1ccc2c(c1)OCCO2)Nc1ccc([N+](=O)[O-])cc1 19161367 SBLCGYUWTUZIBC-UHFFFAOYSA-N 314.297 2.547 5 40 DFBB CCOC(=O)c1ccnc(N2Cc3ccccc3C2)c1[N+](=O)[O-] 77965003 JTVCVDNYVQISSF-UHFFFAOYSA-N 313.313 2.687 5 40 DFBB Cc1ccc(CN(C)CC(=O)Nc2cccc([N+](=O)[O-])c2)o1 3422204 NMECLYPGNNJSKO-UHFFFAOYSA-N 303.318 2.567 5 40 DFBB Cn1cnc([N+](=O)[O-])c1Nc1cccc(OC[C@@H]2CCCO2)c1 36397186 DIRUTBZHGTXKSB-ZDUSSCGKSA-N 318.333 2.630 5 40 DFBB COCCN(CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 71900735 OOSGZEMWJITADI-UHFFFAOYSA-N 321.255 2.637 5 40 DFBB CCN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H](C)c1cccnc1 96406933 CFUPUAQETSHOJI-NSHDSACASA-N 315.329 2.919 5 40 DFBB CN(Cc1cc(Cl)cn1C)C(=O)Nc1ccncc1[N+](=O)[O-] 97237292 GWRGLZIGOJZQGJ-UHFFFAOYSA-N 323.740 2.646 5 40 DFBB Cc1ccc(CNC(=O)CCOc2cccc([N+](=O)[O-])c2)cc1 31491479 ARKPNFXBQSYTCP-UHFFFAOYSA-N 314.341 2.989 5 40 DFBB O=[N+]([O-])c1ccc(-c2nnc3n2N[C@@H](c2ccco2)S3)cc1 3843221 JESZIPPBUBXUPT-GFCCVEGCSA-N 315.314 2.794 5 40 DFBB biogenic CN1CCN(c2c([N+](=O)[O-])c(Cl)nc3ccccc23)CC1 96193725 WYDOLNXUXPKMPE-UHFFFAOYSA-N 306.753 2.548 5 40 DFBB CC[C@@]1(C)COCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 390833638 KRTIBDKVMGOFGI-AWEZNQCLSA-N 312.753 2.889 5 40 DFBB O=[N+]([O-])c1cc(CN2CCN(c3ccc(O)cc3)CC2)cs1 47264485 RCUADYKRXFXFRS-UHFFFAOYSA-N 319.386 2.684 5 40 DFBB CCCCCNC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O 521394664 NUZZLWFATKNDGI-UHFFFAOYSA-N 311.313 2.612 5 40 DFBB C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3195320 JUCIBDRBUQHWIF-NXEZZACHSA-N 307.306 2.906 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccnc1Cl 3564369 ZJWIJWIUGXPVKQ-UHFFFAOYSA-N 307.693 2.661 5 40 DFBB C[C@@H](O)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 97163469 PDIJRMFMGZKVQN-SSDOTTSWSA-N 321.255 2.506 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)c1cc([N+](=O)[O-])ccc1n2CCO 28294433 JFYAFTURSFTFEA-UHFFFAOYSA-N 301.258 2.603 5 40 DFBB Cc1ccccc1N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 39156965 VXVJLLCDQNIWLC-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H](C)CC(C)C 46034301 LJFJOEMYGHBWNC-GFCCVEGCSA-N 314.407 2.958 5 40 DFBB COc1cc(C(=O)O)cc([N+](=O)[O-])c1OCc1ccccc1 43827457 SHVWMGUFVKSAAO-UHFFFAOYSA-N 303.270 2.881 5 40 DFBB O=C1O/C(=C(\c2ccc([N+](=O)[O-])cc2)[N+](=O)[O-])c2ccccc21 59382550 PHXKRHMKQWRISR-BUHFOSPRSA-N 312.237 2.868 5 40 DFBB CN(CCOc1ccccc1)C(=O)c1ccc([N+](=O)[O-])s1 6560046 NVCZRNBEKAWSIW-UHFFFAOYSA-N 306.343 2.807 5 40 DFBB O=c1nc(Nc2ccc([N+](=O)[O-])cc2)sc2ncccc12 4623708 PBJQTZNVRZPVEU-UHFFFAOYSA-N 300.299 2.703 5 40 DFBB O=C(O)[C@H]1CS[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])o2)N1 5772188 CXEPVJPUZWVNTN-NOZJJQNGSA-N 320.326 2.643 5 40 DFBB CC[S@](=O)[C@H]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2C)C1 267409418 RKACEZLURLGEQM-ZZPLEAIBSA-N 311.407 2.790 5 40 DFBB Cn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(C)(C)C)c2O)n1 274797934 JFIZNPWHEQUGCB-UHFFFAOYSA-N 318.333 2.584 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)s1 16401142 NVNPHQQTASPPAO-UHFFFAOYSA-N 318.354 2.724 5 40 DFBB CN(Cc1cccs1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] 30582394 GMHWQCKOKQTTCF-UHFFFAOYSA-N 316.342 2.529 5 40 DFBB COc1ccccc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] 40509266 CAQKITGINHQDRF-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB O=C(OCc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 3065206 TYBIUYDQPJQQGT-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB Cc1ccc(S(=O)(=O)N(C)c2ccccc2F)cc1[N+](=O)[O-] 119952220 NZZRFMYPYXABCI-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB CC(C)C(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 18042636 AFNXTPVAEYOTQQ-UHFFFAOYSA-N 311.769 2.553 5 40 DFBB N[C@@H](c1ccc(F)cc1)c1nc(-c2ccccc2[N+](=O)[O-])n[nH]1 95533257 PBPHUUGBZHVFIM-ZDUSSCGKSA-N 313.292 2.567 5 40 DFBB CSc1ccccc1NC(=O)CCCn1cc([N+](=O)[O-])cn1 4784909 HDELXDDMDYCAQD-UHFFFAOYSA-N 320.374 2.932 5 40 DFBB COC(=O)c1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1 5511475 ZAYDUJAXDVHQDX-UHFFFAOYSA-N 300.270 2.634 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(F)cc1 4299680 UJAIDCDEIHAWCA-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB O=C(CSc1ncccc1[N+](=O)[O-])Nc1cccnc1Cl 65693265 BTZVSDUMLULSKM-UHFFFAOYSA-N 324.749 2.769 5 40 DFBB CNC(=O)Nc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 32903309 OUAHZJVNVRSZDD-UHFFFAOYSA-N 314.301 2.598 5 40 DFBB NC1=NN(c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccc(F)cc2)C1 222548474 JTPZZJWNUHVCRW-CQSZACIVSA-N 300.293 2.958 5 40 DFBB O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccccc1[N+](=O)[O-] 1595991 KJUUWRYIMNTSLH-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB COc1ccc(C)cc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 7952364 BMWXFCXYSLTPTG-UHFFFAOYSA-N 301.302 2.746 5 40 DFBB O=C([C@@H]1CCOC1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 76017938 UGEMDIJZYYLQCA-GFCCVEGCSA-N 304.346 2.907 5 40 DFBB CS[C@@H]1CC[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1 110646170 NVQPWSXWWAWYOC-VXGBXAGGSA-N 323.418 2.749 5 40 DFBB CCC(C)(C)[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 97135446 HNIOVDDQIIUKDG-GFCCVEGCSA-N 306.366 2.613 5 40 DFBB COC(=O)c1cc(OC)ccc1Oc1ccc([N+](=O)[O-])cn1 20031346 CIPNAZQBKFDWSJ-UHFFFAOYSA-N 304.258 2.577 5 40 DFBB COc1ccc(CNCCNc2ccc([N+](=O)[O-])cc2)cc1 7275472 VDYKPRFZYAPTLE-UHFFFAOYSA-N 301.346 2.805 5 40 DFBB Cn1ncc([N+](=O)[O-])c1C(=O)Nc1nc(CC(C)(C)C)cs1 96494460 HCXHNPPMTQYLNK-UHFFFAOYSA-N 323.378 2.626 5 40 DFBB Cc1nn(-c2ccc(C(=O)OC(C)C)cc2)c(C)c1[N+](=O)[O-] 5002344 FTCACQCCPPCRFJ-UHFFFAOYSA-N 303.318 2.963 5 40 DFBB C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[C@H]2CC[C@H]1C2 104094319 HSQVKSGLOXCONI-BLFANLJRSA-N 303.362 2.732 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3ccccc3O)CC2)s1 54389451 SBSWEKMFMQVPHN-UHFFFAOYSA-N 305.359 2.689 5 40 DFBB O=C(OCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 6609141 BBXCTZBRVSNIMY-UHFFFAOYSA-N 301.254 2.681 5 40 DFBB CC1=C(C)C[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2C1 102409674 KVTACZCBHWDAQC-ZIAGYGMSSA-N 300.314 2.831 5 40 DFBB CCSCCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 72304838 SQFCVGBVWIXCHH-UHFFFAOYSA-N 309.435 2.860 5 40 DFBB Cc1ccnc(NCCCNC(=O)c2ccccc2)c1[N+](=O)[O-] 96406522 BGHHMVCWQFMEHO-UHFFFAOYSA-N 314.345 2.530 5 40 DFBB CCOC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 66727 HOXNNRGCUXQKJL-UHFFFAOYSA-N 304.258 2.617 5 40 DFBB CCc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 3059061 WSOCIHYVCYXLBE-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCc2ccccc21 3147843 ONAXCCAQGGRGFY-UHFFFAOYSA-N 313.269 2.706 5 40 DFBB C[C@H]1CCc2cc(F)ccc2N1c1ncnc(N)c1[N+](=O)[O-] 3912664 XRUKMLGEDPRAHX-QMMMGPOBSA-N 303.297 2.579 5 40 DFBB Cc1cnc(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 25829523 LVGHAUNBXRJBOO-NSHDSACASA-N 300.318 2.526 5 40 DFBB CCn1nc(C)c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1C 2762570 AFSKDMOIQQQUPL-UHFFFAOYSA-N 302.334 2.609 5 40 DFBB O=C(O)[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 3864755 OCAPOQDIRKGNKV-MRVPVSSYSA-N 318.251 2.915 5 40 DFBB COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 9338524 ILNIBNBRSDEANQ-SNVBAGLBSA-N 301.302 2.950 5 40 DFBB C[C@@H](CNc1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1F 4687290 WXJKKJKZLQZYCA-NSHDSACASA-N 317.320 2.964 5 40 DFBB Cc1c(NC(=O)c2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-] 95389791 IPSAWAUFGKFFFE-UHFFFAOYSA-N 300.270 2.854 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ccccn1 4624124 BUFVBNRYQGSRCO-UHFFFAOYSA-N 319.342 2.729 5 40 DFBB O=c1nc2n(-c3ccc(Cl)cc3)c3ccccc3cc-2c(=O)[nH]1 521553 HEXIOXBJNRLYOZ-UHFFFAOYSA-N 323.739 2.832 5 40 DFBB Cc1cc2ncn(-c3ccc(C(N)=O)cc3[N+](=O)[O-])c2cc1C 3444200 PQWWLYGXXOJPBQ-UHFFFAOYSA-N 310.313 2.649 5 40 DFBB Cc1cc(C)n2nc(SCc3cccc([N+](=O)[O-])c3)nc2n1 3467206 ZOMGUJKQMVMKRZ-UHFFFAOYSA-N 315.358 2.942 5 40 DFBB Cc1nc(Nc2ccccn2)nc(Nc2ccccn2)c1[N+](=O)[O-] 5360814 RETONTNZTSMTNZ-UHFFFAOYSA-N 323.316 2.970 5 40 DFBB C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 7309562 FPJXHLLENDCVQR-LBPRGKRZSA-N 320.370 2.677 5 40 DFBB CCN(CC)CCOC(=O)CSc1ccccc1[N+](=O)[O-] 1795134 PUFFMAUNBRGWIW-UHFFFAOYSA-N 312.391 2.572 5 40 DFBB O=[N+]([O-])c1cc(O)cc(S(=O)(=O)c2ccc(Cl)cc2)c1 2549461 CSMIFYAGNVYZHC-UHFFFAOYSA-N 313.718 2.787 5 40 DFBB C[C@H](Oc1cccnc1[N+](=O)[O-])c1nc(-c2ccco2)no1 29739018 SYOMPMBGXOMVHC-QMMMGPOBSA-N 302.246 2.773 5 40 DFBB CC(C)O[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1(C)C 95944406 KATSGQSXKOUDBX-KGLIPLIRSA-N 306.362 2.917 5 40 DFBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Oc1ccc2c(c1)OCO2 6213004 RYBSMMGNFSXDQF-FPYGCLRLSA-N 313.265 2.942 5 40 DFBB Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1CCCCCCC1 65736248 DYTWYQWFOLNERQ-UHFFFAOYSA-N 308.382 2.576 5 40 DFBB COc1ccc(NC(=O)CCCc2ccccn2)c([N+](=O)[O-])c1 71903325 UNMFLEDCBIPJSW-UHFFFAOYSA-N 315.329 2.960 5 40 DFBB COCCN(Cc1ccco1)C(=O)c1ccc([N+](=O)[O-])c(C)c1 25094854 KCMHCXGNSPUJRZ-UHFFFAOYSA-N 318.329 2.785 5 40 DFBB COc1cc([N+](=O)[O-])ccc1Sc1nnc(C(F)F)[nH]1 216903561 UWFXWANZLPOBLF-UHFFFAOYSA-N 302.262 2.810 5 40 DFBB C[C@@H](c1ccccn1)N(C)C(=O)c1ccc(O)c([N+](=O)[O-])c1 164408398 GRWYOFZRONNDJA-JTQLQIEISA-N 301.302 2.529 5 40 DFBB Cc1nccc(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)n1 71185151 WNBRSBLIVPZSGH-SNVBAGLBSA-N 300.318 2.526 5 40 DFBB CC(=O)c1ccc(NCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 5700246 WFBVGBBRKLAQKS-UHFFFAOYSA-N 313.313 2.848 5 40 DFBB COc1ccccc1NS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 216346714 LHYZSRISWMYGPB-UHFFFAOYSA-N 322.342 2.545 5 40 DFBB Cc1sc(C(=O)NC[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] 89536648 ACTPIHIMDSQFRP-LBPRGKRZSA-N 324.333 2.567 5 40 DFBB Cc1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1[N+](=O)[O-] 13091852 DOIDDUOZUNCCEV-UHFFFAOYSA-N 314.297 2.531 5 40 DFBB COc1ccc(Cn2cc(Br)c([N+](=O)[O-])n2)cc1 103552501 MCJOXOMZBKASGN-UHFFFAOYSA-N 312.123 2.611 5 40 DFBB CCN(CC)CCC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1 3093079 HPRQGRIUUURMDP-ZDUSSCGKSA-N 307.394 2.835 5 40 DFBB C[C@H](c1ccco1)N(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 89910088 YYDXDINGXKUKTH-LLVKDONJSA-N 324.358 2.711 5 40 DFBB C[C@@H](c1ccncc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 67715510 VJPXCBBVNIGFHB-AWEZNQCLSA-N 312.373 2.873 5 40 DFBB O=c1[nH]c(/C=C\c2cccc3ccccc23)nc(O)c1[N+](=O)[O-] 16526166 JPSASVOXDJPDAT-HJWRWDBZSA-N 309.281 2.707 5 40 DFBB CCCCn1ncc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)c1C 97374950 KOGGHCWWXSXTQI-UHFFFAOYSA-N 318.333 2.858 5 40 DFBB Cc1ccc(O[C@@H](C)C(=O)N(C)c2ccccc2)c([N+](=O)[O-])n1 4892066 NGBYHJTWATUFBA-LBPRGKRZSA-N 315.329 2.729 5 40 DFBB C[C@H](c1cccc([N+](=O)[O-])c1)n1nnc(-c2cccc(F)c2)n1 48324729 KNVABKCMIARTSF-SNVBAGLBSA-N 313.292 2.997 5 40 DFBB CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(NCc2ccccc2)n1 5053764 UPSHNCKTSIXXLO-JTQLQIEISA-N 316.365 2.790 5 40 DFBB Cc1nn(Cc2cc(Cl)c3c(c2)OCO3)c(C)c1[N+](=O)[O-] 13984757 XRLBCVKAWDDCIV-UHFFFAOYSA-N 309.709 2.839 5 40 DFBB CC(C)NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 9339311 IVJWTCVQNHKOGI-UHFFFAOYSA-N 319.283 2.940 5 40 DFBB Cc1c(NC(=O)N2CC(C(F)(F)F)C2)cccc1[N+](=O)[O-] 585140821 LFWJZLZFYKIGKP-UHFFFAOYSA-N 303.240 2.929 5 40 DFBB Cc1cc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)no1 84147835 SMUKGWMTWOVSMZ-UHFFFAOYSA-N 304.306 2.830 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccc(Cl)c([N+](=O)[O-])c1 5390759 TYKFQKVGQJDDID-UHFFFAOYSA-N 322.664 2.804 5 40 DFBB Cc1c(C(=O)NC[C@H](c2ccco2)N(C)C)cccc1[N+](=O)[O-] 10328277 SYNCMCABFZRXTM-CQSZACIVSA-N 317.345 2.529 5 40 DFBB COc1ccc([C@@H](O)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 226292274 YRNNNJUXFSXYTE-INIZCTEOSA-N 319.313 2.702 5 40 DFBB CC(C)c1nnc(SCC(=O)Nc2cccc([N+](=O)[O-])c2)o1 12815348 RGRWRAZQGMDNHL-UHFFFAOYSA-N 322.346 2.832 5 40 DFBB CC(C)(C)c1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)s1 18142666 FTHBOQWEJRWTTI-UHFFFAOYSA-N 306.347 2.996 5 40 DFBB Cc1ccccc1NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 8720237 FWDAWTQBPJHEOR-UHFFFAOYSA-N 310.306 2.843 5 40 DFBB Cc1cc(CN(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])no1 31658542 IFIDDWBYCSDAGX-UHFFFAOYSA-N 309.709 2.817 5 40 DFBB CN(CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 53268324 VWXBGXVDQRJOMC-UHFFFAOYSA-N 303.293 2.809 5 40 DFBB CN1CCCC12CCN(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CC2 95460527 GYHYSAIBKPAMLF-UHFFFAOYSA-N 320.349 2.568 5 40 DFBB COc1cc(-c2nc(-c3cccc([N+](=O)[O-])c3)n[nH]2)ccc1O 85384266 BICYUPILNSIVEM-UHFFFAOYSA-N 312.285 2.761 5 40 DFBB Cc1cc(Sc2cccc[n+]2[O-])c([N+](=O)[O-])cc1[N+](=O)[O-] 5212243 GEXFSIPGFGBENE-UHFFFAOYSA-N 307.287 2.596 5 40 DFBB Cc1ccc(Oc2c(C(N)=O)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 2072460 ZPGORZVSLKOOOH-UHFFFAOYSA-N 317.257 2.703 5 40 DFBB Cc1cccc(C)c1NC(=O)COC(=O)c1ccc([N+](=O)[O-])o1 3263603 KUCGIUUNNMUQSL-UHFFFAOYSA-N 318.285 2.600 5 40 DFBB CN(C)c1ccc(-c2n[nH]c(=O)c3ccccc23)cc1[N+](=O)[O-] 4299881 ZYPOHWIILXUBAJ-UHFFFAOYSA-N 310.313 2.564 5 40 DFBB CCS[C@@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 225541864 ZNDLUCAXAYJAGN-MWLCHTKSSA-N 309.391 2.581 5 40 DFBB Cc1cccc(N2CCC(OC[C@H]3CCOC3)CC2)c1[N+](=O)[O-] 225459934 HETJWCKYTPZXPU-AWEZNQCLSA-N 320.389 2.925 5 40 DFBB COc1ccccc1CNc1ccc([N+](=O)[O-])cc1C(=O)O 314133691 OAIMCMMEHQVQBG-UHFFFAOYSA-N 302.286 2.914 5 40 DFBB Cc1cc(C(=O)NCCOc2ccc(F)cc2)ccc1[N+](=O)[O-] 23142405 ZXKAOILOEPBQPX-UHFFFAOYSA-N 318.304 2.851 5 40 DFBB C[C@H](O)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] 8177634 HEZJPPGWIGGQIT-NSHDSACASA-N 300.314 2.619 5 40 DFBB CCOc1ncccc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 9154117 FUEDTQILKXZIJF-UHFFFAOYSA-N 313.313 2.591 5 40 DFBB C[C@H](Nc1ncccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 15118869 LRKCSNAOQAYAEN-JTQLQIEISA-N 321.358 2.566 5 40 DFBB CCn1cc([N+](=O)[O-])c(C(=O)N(C(C)C)C2CCCCC2)n1 191587001 QOSCHAVIDDVRRE-UHFFFAOYSA-N 308.382 2.995 5 40 DFBB C/C=C1\C[N+]2(C)CC[C@]34c5ccccc5N[C@H]3[C@@H](CO)[C@H]1C[C@H]42 100765290 LKZQOCJBJKPRFV-ZLYNLFOKSA-N 311.449 2.526 5 40 DFBB C[C@@H](C(=O)N[C@H]1CCCc2ccccc21)n1cc([N+](=O)[O-])cn1 2747980 KLADXPKSQWKQFK-NHYWBVRUSA-N 314.345 2.546 5 40 DFBB O=C(Oc1cccc([N+](=O)[O-])c1)c1cc(=O)[nH]c2ccccc12 14136634 GOGMWCFNTRDTJR-UHFFFAOYSA-N 310.265 2.656 5 40 DFBB CCOc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 13647927 QUHUYNRAZHKLMA-UHFFFAOYSA-N 314.341 2.852 5 40 DFBB CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 16084527 AIXZBVDOABQCHC-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc([N+](=O)[O-])s1 3224998 IWYAOOVEIHPMFH-UHFFFAOYSA-N 323.286 2.825 5 40 DFBB COc1ccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)O)cc1 45499867 AGYPOLYEHZFWKZ-QPJJXVBHSA-N 300.270 2.867 5 40 DFBB Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc(C(=O)O)c1O 20140885 VPSHFCKMAXZTKP-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB 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O=c1c(Cl)c(Cl)cnn1Cc1ccc([N+](=O)[O-])cc1 2629835 BJVOCFDIYFGLPP-UHFFFAOYSA-N 300.101 2.507 5 40 DFBB Cc1c(C(=O)Nc2ccc(O)c(C(=O)O)c2)cccc1[N+](=O)[O-] 20141012 HXHRQQYDNGTMNM-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB CN(Cc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)cc1 6510836 SHZJSGZGINOBDA-UHFFFAOYSA-N 324.333 2.555 5 40 DFBB C[C@@H]1CCCC[C@H]1OCc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 69439973 YOHVVIWOMFPTTI-QMTHXVAHSA-N 317.345 2.927 5 40 DFBB Cc1cc(C)c(C)c(S(=O)(=O)n2c([N+](=O)[O-])cnc2C)c1C 19943335 SWXNNSUSRWNCNU-UHFFFAOYSA-N 323.374 2.570 5 40 DFBB C[C@H](c1ccccc1)N(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 24686353 UXBHBWHUSSWBGK-GFCCVEGCSA-N 313.357 2.887 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)Cc1ccoc1C 57011029 VERPMSNFTPYPRH-UHFFFAOYSA-N 324.358 2.625 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc(F)cc(F)c1 28794328 SAEPQAQBCCWCAK-UHFFFAOYSA-N 314.269 2.674 5 40 DFBB Cc1ccc(NC(=O)[C@@H](C)Cn2cc([N+](=O)[O-])cn2)cc1F 6923955 NMBVSLJVYWNMNQ-JTQLQIEISA-N 306.297 2.514 5 40 DFBB Cn1c(=O)oc2ccc(NCc3csc([N+](=O)[O-])c3)cc21 84310989 VFPFOANBTJEERT-UHFFFAOYSA-N 305.315 2.713 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NCc1nnc(C(C)(C)C)o1 86187999 AFVMABUMNSQVNL-UHFFFAOYSA-N 306.322 2.896 5 40 DFBB COCc1noc([C@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)n1 97085689 UZUILKFENNJLHI-ZETCQYMHSA-N 313.697 2.918 5 40 DFBB O=C(C[C@@H]1OC(=O)c2ccccc21)c1cc([N+](=O)[O-])ccc1O 16740872 JTNHXVBVDMACIT-HNNXBMFYSA-N 313.265 2.785 5 40 DFBB O=C(O)c1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 1312733 VIXSKCZNSAEUGB-UHFFFAOYSA-N 304.214 2.994 5 40 DFBB O=[N+]([O-])c1ccc(CNCCNc2ccc([N+](=O)[O-])cc2)cc1 8418789 SAFLHXQNLMPXEB-UHFFFAOYSA-N 316.317 2.705 5 40 DFBB COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)cc1 12765516 PTBHUGFYDHSZQC-OAHLLOKOSA-N 316.361 2.713 5 40 DFBB CN(C)C1(CNC(=O)c2cccc([N+](=O)[O-])c2)CCCCCC1 13013593 MPNWBYHPXGRREA-UHFFFAOYSA-N 319.405 2.979 5 40 DFBB C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NC1CCCCC1 6062694 HBAOYLLWRMMORD-LLVKDONJSA-N 320.345 2.589 5 40 DFBB O=C(N=c1[nH]c2ccccc2[nH]1)c1cc(Cl)ccc1[N+](=O)[O-] 5387679 OWQQXCQHJMNQFR-UHFFFAOYSA-N 316.704 2.799 5 40 DFBB CS[C@H]1CCC[C@@H]1N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] 72896623 OWZLWCLNRNUOOF-KBPBESRZSA-N 323.418 2.749 5 40 DFBB Cc1ccc([N+](=O)[O-])c(C)c1OCC(=O)N1CCC(C)CC1 31459139 QCQUAODZYAODCH-UHFFFAOYSA-N 306.362 2.849 5 40 DFBB O=C(O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 15443078 LUJIWJDGWCJVKC-QMMMGPOBSA-N 318.251 2.915 5 40 DFBB O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)NC1CCCCC1 7916543 XKJHNJZACDSOFY-VOTSOKGWSA-N 318.329 2.786 5 40 DFBB O=[N+]([O-])c1ccc(NC[C@@H](O)C(F)(F)F)cc1OC(F)F 96429285 YCGFVMRPWXXUBN-MRVPVSSYSA-N 316.182 2.531 5 40 DFBB Cc1[nH]nc(C(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c1[N+](=O)[O-] 75388519 ITHFAMVPANDFBE-GXSJLCMTSA-N 318.333 2.833 5 40 DFBB O=[N+]([O-])c1ccc(Cc2cc[n+](Cc3ccccn3)cc2)cc1 28250 ULBCDJLVTZYMGP-UHFFFAOYSA-N 306.345 2.916 5 40 DFBB Cc1cc(N2CC[C@H](N3CC=CC3)C2)c2cc([N+](=O)[O-])ccc2n1 102095942 CJGCHVLJWAHYAT-HNNXBMFYSA-N 324.384 2.902 5 40 DFBB CCC(C)(C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 32967727 WBJHKXVMYVKVBR-UHFFFAOYSA-N 302.334 2.699 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@@H]2C[C@@H]3[C@H]4[C@H]5C[C@@H]5[C@@H]4[C@H]23)c([N+](=O)[O-])c1 104286456 WGFAANRNHZIUTQ-UOUFGGHOSA-N 316.313 2.920 5 40 DFBB Nc1nc(N2CCCCC2)nc(Nc2ccccc2)c1[N+](=O)[O-] 6276915 GEHRCAXVDMGTHA-UHFFFAOYSA-N 314.349 2.701 5 40 DFBB COC(=O)CSc1c(C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3851313 CWZYSBSDAKPCPG-UHFFFAOYSA-N 314.319 2.892 5 40 DFBB biogenic C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1 5971274 WESRWUYTGHMHMN-VIFPVBQESA-N 305.265 2.535 5 40 DFBB COc1ccc(C(=O)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 5003086 YFQVPQSRDROTBS-UHFFFAOYSA-N 314.297 2.815 5 40 DFBB O=[N+]([O-])c1cccnc1N1CCN(c2ccccc2Cl)CC1 23702302 KPPRUQVGQGYADG-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB O=C(Cn1ncc2cc([N+](=O)[O-])ccc21)N1CCc2ccccc21 3321994 ONDLZTYAUSSFOQ-UHFFFAOYSA-N 322.324 2.534 5 40 DFBB N=c1oc2ccc([N+](=O)[O-])cc2cc1C(=O)Nc1nccs1 4837381 LGAVIJIMNJOEEX-UHFFFAOYSA-N 316.298 2.529 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(-c2nc[nH]n2)cc1 72277611 FFDIXGXEWRVITL-UHFFFAOYSA-N 323.312 2.941 5 40 DFBB O=C(OCc1ccc(-n2ccnc2)nc1)c1ccc([N+](=O)[O-])cc1 78426435 ZZOLXJWNWMHJRP-UHFFFAOYSA-N 324.296 2.533 5 40 DFBB O=C(O)[C@H]1CS[C@@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 83237257 JQYLQCWCUUOGKX-MFKMUULPSA-N 320.326 2.643 5 40 DFBB CCCCCN1N=C(C)[C@@H](C(=O)c2cccc([N+](=O)[O-])c2)C1=O 100128232 NUKDHPCCANWWTC-AWEZNQCLSA-N 317.345 2.802 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc(N3CCCCC3)s2)nc1 58166398 BYZJPHRQBRPJMB-UHFFFAOYSA-N 323.403 2.983 5 40 DFBB Nc1nnc(SCc2ccc([N+](=O)[O-])cc2Cl)s1 49963997 AZTWJJAZVVLGDH-UHFFFAOYSA-N 302.768 2.974 5 40 DFBB Cc1cc2ccccn2c1C(=O)c1ccc(NN)c([N+](=O)[O-])c1 5578140 OVNOHJNMSCYNTD-UHFFFAOYSA-N 310.313 2.673 5 40 DFBB COc1ccccc1NCC(=O)Nc1cc([N+](=O)[O-])ccc1C 9609102 OMZHGMVFKNBZGJ-UHFFFAOYSA-N 315.329 2.962 5 40 DFBB O=[N+]([O-])c1cccc(F)c1Cn1cc(Br)cn1 78440784 KLZHWELZASXBQL-UHFFFAOYSA-N 300.087 2.741 5 40 DFBB CCCCC(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 5755775 HTVRXIMBIFGAFL-SNVBAGLBSA-N 324.333 2.664 5 40 DFBB Cn1cc([N+](=O)[O-])cc1C(=O)OCC(=O)c1ccc(Cl)cc1 21839849 AZGYVTFOBYYTCP-UHFFFAOYSA-N 322.704 2.626 5 40 DFBB COc1ccccc1NC(=O)COc1cccc([N+](=O)[O-])c1 6061632 RGACRLFVQORKAU-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB CC[C@@H]1CC[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 95459187 OUHRAFJVCABUIK-GXSJLCMTSA-N 307.306 2.906 5 40 DFBB O=C(O)c1cc([N+](=O)[O-])c(OCc2cccc(F)c2)cc1O 216933450 YRCAAZYQCBKSLD-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB C[C@@H]1C[C@@H](C)CN(c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 227156616 KBRICLGMIFKYHM-RKDXNWHRSA-N 324.293 2.894 5 40 DFBB O=c1oc2ccc([N+](=O)[O-])cc2c(N2CCCCC2)c1[N+](=O)[O-] 5770026 VXRJJZFQDOWLSJ-UHFFFAOYSA-N 319.273 2.600 5 40 DFBB C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)n1nnc2ccccc21 411601 FMMUQJZBEPIKRG-SNVBAGLBSA-N 311.301 2.539 5 40 DFBB C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 3093788 XFWYJHXQWVZEBO-SNVBAGLBSA-N 315.285 2.994 5 40 DFBB CCCN1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 12740653 BQPGXAAMTHBTHI-UHFFFAOYSA-N 300.362 2.675 5 40 DFBB Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCc1cnn(C)c1 72288224 VVHYPWYKPAYOFW-UHFFFAOYSA-N 322.752 2.861 5 40 DFBB O=[N+]([O-])c1ccc(N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)c(F)c1 84351176 MBLDFBMYTQUXQP-KBPBESRZSA-N 324.352 2.898 5 40 DFBB CC(=O)NC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 85346798 NJLYKNAXJPPESP-UHFFFAOYSA-N 308.677 2.785 5 40 DFBB COc1cc(N2CC[C@@H](CSC)C2)c([N+](=O)[O-])cc1F 95412076 ABXXQNYCLIQKJS-SECBINFHSA-N 300.355 2.932 5 40 DFBB O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCC1CC1 97085583 LHPSDBAPJSYRKH-UHFFFAOYSA-N 300.767 2.867 5 40 DFBB O=C1[C@@H]2[C@@H](C(=O)N1c1ccc([N+](=O)[O-])cc1Cl)[C@H]1C=C[C@H]2C1 100936994 VTAPUJBSGAMKHF-XMUKKISLSA-N 318.716 2.560 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@H]2C[C@@H]3[C@@H]2[C@H]2[C@H]4C[C@@H]4[C@H]32)c([N+](=O)[O-])c1 104286451 WGFAANRNHZIUTQ-OZMULNTGSA-N 316.313 2.920 5 40 DFBB COCc1cccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 192760140 FMXBUPFYOXYDAV-UHFFFAOYSA-N 322.342 2.542 5 40 DFBB O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 100556099 ZNGVWFJIYHCABA-QQXRRDQMSA-N 318.716 2.560 5 40 DFBB O=[N+]([O-])c1ccc2c(c1)N=C1O[C@H](c3ccccn3)C(O)=C1N2 104240085 LOLLCOQCARJMEZ-CQSZACIVSA-N 310.269 2.986 5 40 DFBB O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)c1ccncc1Cl 89421017 XPPWZVFRHKVFMA-UHFFFAOYSA-N 317.692 2.772 5 40 DFBB O=C(c1ccc([N+](=O)[O-])s1)N(Cc1ccccn1)C1CC1 61510930 CPNKYPHRGMTODN-UHFFFAOYSA-N 303.343 2.856 5 40 DFBB O=[N+]([O-])c1cn(C[C@@H](O)C2CCCCC2)nc1-c1ccncc1 191350306 WFIMKSUIHKLMAC-OAHLLOKOSA-N 316.361 2.795 5 40 DFBB CCCc1[nH]nc(C(=O)N(CC)Cc2ccoc2)c1[N+](=O)[O-] 96414391 NPCNMQZGZSWDKK-UHFFFAOYSA-N 306.322 2.526 5 40 DFBB CC1=N/C(=C\c2ccc(Br)c([N+](=O)[O-])c2)C(=O)O1 5396895 FWMWWTKHJVLCQF-WTKPLQERSA-N 311.091 2.673 5 40 DFBB O=C(O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 40566563 MDLFKEHLYDIDFI-QMMMGPOBSA-N 318.251 2.915 5 40 DFBB in-vitro O=C(Sc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccnc1 6694555 WSPWYAZJAISGNK-UHFFFAOYSA-N 300.299 2.799 5 40 DFBB O=C(OCc1cc2ccccc2[nH]c1=O)c1ccc([N+](=O)[O-])cc1 5218687 DIKBDJCGVNGGQZ-UHFFFAOYSA-N 324.292 2.793 5 40 DFBB Cn1ccnc1CN(C(=O)Nc1cccc([N+](=O)[O-])c1)C1CC1 40139365 YPQIIGKOHHZSAH-UHFFFAOYSA-N 315.333 2.525 5 40 DFBB O=[N+]([O-])c1ccc(F)cc1OCc1cnn(-c2ccccc2)n1 40116336 PXEOKAYSIICSQG-UHFFFAOYSA-N 314.276 2.894 5 40 DFBB C[C@H]1CCCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 32770564 KROSHVUWLVSNKS-VIFPVBQESA-N 318.782 2.811 5 40 DFBB CS[C@@H]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1 78940764 ZIVMPCYPHJDROD-WCQYABFASA-N 309.391 2.678 5 40 DFBB COc1cc(N)c(OCCOc2ccccc2)cc1[N+](=O)[O-] 79110481 BHYJGQGIIIZSPA-UHFFFAOYSA-N 304.302 2.643 5 40 DFBB O=[N+]([O-])c1cn(Cc2noc(-c3ccc(Cl)cc3)n2)cn1 26124771 NBEIGXJFRZXWRL-UHFFFAOYSA-N 305.681 2.543 5 40 DFBB C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1COc2ccccc2O1 36093460 AVLGWDQMJOYJQR-YVEFUNNKSA-N 314.341 2.913 5 40 DFBB CC1(C)[C@]2(C)CC[C@]1(C(=O)Nc1ccccc1[N+](=O)[O-])OC2=O 100261098 XXWHHFVELSAZAJ-HZPDHXFCSA-N 318.329 2.655 5 40 DFBB CN(C)C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 7007309 NYSZLHYTOWTUAO-UHFFFAOYSA-N 313.313 2.549 5 40 DFBB CCCCC(=O)Nc1ccc([N+](=O)[O-])cc1N1CCOCC1 20611760 QZFZNBPMINOFCV-UHFFFAOYSA-N 307.350 2.560 5 40 DFBB O=C(Nc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])o1 24289563 RPXDRODXIPVZSU-UHFFFAOYSA-N 315.285 2.567 5 40 DFBB Cn1c(=O)c([N+](=O)[O-])c(-n2cnc3ccccc32)c2ccccc21 250976 SLLKJHBUGBFIIC-UHFFFAOYSA-N 320.308 2.786 5 40 DFBB COC(=O)C=Cc1cc(Br)c(F)cc1[N+](=O)[O-] 1857793034 OKHZHBDJOZFECU-UHFFFAOYSA-N 304.071 2.683 5 40 DFBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)N(C)C1CCCCC1 325682 YHOKXLUDWVKHCX-UHFFFAOYSA-N 314.773 2.544 5 40 DFBB O=C(O)c1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(F)c1 360316 ZTEQFQFDGOXKRV-UHFFFAOYSA-N 304.233 2.684 5 40 DFBB CN(C)CCc1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1 1615717 UFFNKVFOKCMFHD-UHFFFAOYSA-N 314.341 2.918 5 40 DFBB CCCCNC(=O)COc1ccc2[nH]c3ccccc3c(=O)c2c1 12522165 YPIXOTHTHOHFFE-UHFFFAOYSA-N 324.380 2.976 5 40 DFBB C[C@@H](C[C@H](O)c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 95412739 BAVFUGIFHPWPSB-LRDDRELGSA-N 314.341 2.837 5 40 DFBB COc1ccccc1[C@@H](C)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] 9884255 GNBYDIQBMUMJNQ-SNVBAGLBSA-N 315.329 2.875 5 40 DFBB O=c1c([N+](=O)[O-])cccn1Cc1csc(C2CCCC2)n1 78979192 KJKBUSRVAGBWHR-UHFFFAOYSA-N 305.359 2.919 5 40 DFBB C[C@H](C1CC1)n1nccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 96424990 VDSUYPCCBICYQU-LLVKDONJSA-N 314.345 2.944 5 40 DFBB O=C1[C@@H]2CCCC[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Cl 16385797 PLGBIBWHXBHNKT-NXEZZACHSA-N 308.721 2.928 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)OCO2 6948609 DZIMPYXATKUENE-UHFFFAOYSA-N 301.258 2.968 5 40 DFBB CCONC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 32848255 PQDOBBDWXSZXDR-LLVKDONJSA-N 307.350 2.512 5 40 DFBB O=C(NCc1ccc(-c2ccc(Cl)cc2)o1)[C@@H]1C[C@@H]1[N+](=O)[O-] 32932523 XKRKXCPGEHMFKC-OLZOCXBDSA-N 320.732 2.881 5 40 DFBB Cc1ccccc1OCCNC(=O)Cc1ccccc1[N+](=O)[O-] 55954624 LHVOEILULOUSNV-UHFFFAOYSA-N 314.341 2.641 5 40 DFBB O=C(Nc1ccc(Cl)c(C(=O)O)c1)c1ccc([N+](=O)[O-])o1 20139725 JKQGMJIRIJNYIU-UHFFFAOYSA-N 310.649 2.792 5 40 DFBB O=C(O)[C@H]1CS[C@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 83237254 JQYLQCWCUUOGKX-ZWNOBZJWSA-N 320.326 2.643 5 40 DFBB C[C@H](CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccsc1 97237116 OATGUMLDTVUJSX-SECBINFHSA-N 306.343 2.895 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)c1cccc(F)c1 150743710 OEAQDOSTDDZRSB-UHFFFAOYSA-N 324.333 2.867 5 40 DFBB Cc1ccc(C)c(OCCCn2cc([N+](=O)[O-])ccc2=O)c1 31672305 RNZYZZYMNXHWJF-UHFFFAOYSA-N 302.330 2.842 5 40 DFBB CNC(=O)c1ccc(Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 2751466 GSOBEWODNVVTKE-UHFFFAOYSA-N 317.257 2.655 5 40 DFBB Cc1ccc(Nc2c(C(N)=O)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 4014420 BHVTVVWHCVAKMH-UHFFFAOYSA-N 316.273 2.654 5 40 DFBB O=[N+]([O-])c1ccc(N[C@@H]2CCN3CCCC[C@H]23)c([N+](=O)[O-])c1 36389624 OJHNUMDCGWTBNO-CHWSQXEVSA-N 306.322 2.542 5 40 DFBB CCO[C@@H]1C[C@@H](O)C12CCN(c1ccc(C)cc1[N+](=O)[O-])CC2 84800918 QGSYNLALEKHAHC-HZPDHXFCSA-N 320.389 2.660 5 40 DFBB O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 4703580 UARBQPNAKASOHF-UHFFFAOYSA-N 303.293 2.576 5 40 DFBB COc1ccc([N+](=O)[O-])c(NC2CCN(C(=O)C(C)C)CC2)c1 71893822 BYFYTSLGZVKSGA-UHFFFAOYSA-N 321.377 2.662 5 40 DFBB CC(=O)N1N=C(c2ccccc2)O[C@H]1c1ccc([N+](=O)[O-])s1 2497587 UUSQVTZBPLYRHV-AWEZNQCLSA-N 317.326 2.895 5 40 DFBB CCNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 8725919 VVCPKFSKIACMLA-UHFFFAOYSA-N 305.256 2.552 5 40 DFBB Cc1ccc([C@@H](C)NCC(=O)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] 95985982 NJQKPPYZGDUPRL-GXTWGEPZSA-N 319.405 2.812 5 40 DFBB Cc1cn2nc(N(C)Cc3ccccc3[N+](=O)[O-])sc2n1 25495852 MTOPSEHMECKXGM-UHFFFAOYSA-N 303.347 2.644 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCOC1 96007648 RHABJYJXIGVMDH-MRVPVSSYSA-N 318.251 2.979 5 40 DFBB O=C(Cn1cccc([N+](=O)[O-])c1=O)C12CC3CC(CC(C3)C1)C2 58357548 XAPYIRBEWDEGGB-UHFFFAOYSA-N 316.357 2.542 5 40 DFBB O=C(Cc1ccccc1[N+](=O)[O-])NCCCOc1ccccc1 8884309 NVKMISIPJXLUGJ-UHFFFAOYSA-N 314.341 2.723 5 40 DFBB C[N+](C)(C)C[C@H](O)COCC(c1ccccc1)c1ccccc1 41690046 CBAPXHGMERVCQO-IBGZPJMESA-N 314.449 2.902 5 40 DFBB Cc1ccc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 1644313 LERDDYBGAMSYLV-UHFFFAOYSA-N 306.343 2.728 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1)c1ccc(C2OCCO2)s1 43210415 WLXAGRDLMUQXMH-UHFFFAOYSA-N 305.311 2.933 5 40 DFBB O=C(O)c1ccc(C[S@](=O)c2ccccc2)c([N+](=O)[O-])c1 4641480 OLUMHCPDVGQCAR-OAQYLSRUSA-N 305.311 2.601 5 40 DFBB COc1cccc(CCCNC(=O)c2cccc([N+](=O)[O-])c2)c1 10542408 BAMNMRVOZSLHDY-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB COC(=O)c1ccc(Oc2nc3sccn3c2[N+](=O)[O-])cc1 8308835 OXPPRHPVRWGXIZ-UHFFFAOYSA-N 319.298 2.883 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1NC(=O)Cn1ccnc1C(C)C 97053459 BIPIERZPLQSISL-UHFFFAOYSA-N 302.334 2.862 5 40 DFBB Cc1cc(OCc2nc(-c3ccncc3)no2)ccc1[N+](=O)[O-] 1426784 DLSAPCPHQNSMOE-UHFFFAOYSA-N 312.285 2.927 5 40 DFBB Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1C(=O)Nc1ccccc1 504202 ZWHPUJKLSFCTBS-UHFFFAOYSA-N 302.334 2.878 5 40 DFBB COc1ccc(CC(=O)Nc2cccc([N+](=O)[O-])c2)cc1OC 121804 MDAXUNMTDLXPKB-UHFFFAOYSA-N 316.313 2.793 5 40 DFBB CC[C@@H]1CCCCN1CCCNC(=O)c1ccc([N+](=O)[O-])cc1 10543015 PJGARXUKAVHRKO-OAHLLOKOSA-N 319.405 2.979 5 40 DFBB CC(=O)N(C)CCc1nc(-c2cccc([N+](=O)[O-])c2)cs1 95435839 NPWZOZKCHMFTFJ-UHFFFAOYSA-N 305.359 2.739 5 40 DFBB O=C(Cc1ccc([N+](=O)[O-])cc1)n1cc(CO)c2ccccc21 216952363 FMMULHVAQSHSPA-UHFFFAOYSA-N 310.309 2.925 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N2CCC(C)CC2)cc1OC 45957564 FOBVZGJWFZMDHX-UHFFFAOYSA-N 308.334 2.626 5 40 DFBB COc1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)c1OC 4479370 XSSJITYEGYUWLT-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CC(C)[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1Cl 5118543 NWYJZAPGGDQWLD-VIFPVBQESA-N 300.742 2.788 5 40 DFBB CCc1nnc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])s1 14018659 NFFYJFBJZFBKNM-UHFFFAOYSA-N 324.387 2.983 5 40 DFBB O=C(NCCCNc1ccc([N+](=O)[O-])cc1)c1cccs1 4718794 FLHWQWZNWKZXHI-UHFFFAOYSA-N 305.359 2.888 5 40 DFBB Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CN1CCCCCC1 192540602 HUNVRRYKRUPNFJ-AWEZNQCLSA-N 319.405 2.898 5 40 DFBB CS[C@H]1CC[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1 96443518 NVQPWSXWWAWYOC-NEPJUHHUSA-N 323.418 2.749 5 40 DFBB O=[N+]([O-])c1cc(CNc2ccc(F)cc2OCCO)cs1 96427469 HFQATXFRFBIUQA-UHFFFAOYSA-N 312.322 2.779 5 40 DFBB Cc1cc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)ccc1[N+](=O)[O-] 96402856 MCWPAFYSVHKMIW-CYBMUJFWSA-N 314.345 2.646 5 40 DFBB O=C(COc1ccc([N+](=O)[O-])cc1F)NC1CCCCCC1 47355241 QHPFDYYHPKLRGJ-UHFFFAOYSA-N 310.325 2.952 5 40 DFBB C[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCC[N+](C)(C)C 4190275 OXFVCJADQQBIHC-CYBMUJFWSA-O 304.414 2.531 5 40 DFBB CC(C)N1C(=O)S/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C1=O 408962086 GJIFIFDFZALCJX-WDZFZDKYSA-N 308.315 2.745 5 40 DFBB O=C(NCCCc1nccs1)Nc1cccc([N+](=O)[O-])c1 72285586 CPKVIIQNZYQYJX-UHFFFAOYSA-N 306.347 2.806 5 40 DFBB CC1(C)CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4974795 IXLULKUYBKWOIA-UHFFFAOYSA-N 308.294 2.909 5 40 DFBB CC(=O)c1ccc(N[C@H]2CCN3CCCC[C@H]23)c([N+](=O)[O-])c1 47272570 IYLJZXLNWPPNOL-LSDHHAIUSA-N 303.362 2.836 5 40 DFBB Cc1c(C(=O)NCCN(C)c2ccccc2)cccc1[N+](=O)[O-] 12611800 LMCZODXDPLUWED-UHFFFAOYSA-N 313.357 2.769 5 40 DFBB Cc1ccc(OCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c([N+](=O)[O-])n1 21685804 KDJZMDIWLKLBRR-CYZMBNFOSA-N 321.377 2.618 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nc3ncccn3n2)c(Cl)c1 8746188 QJHVHVSZMBFSCO-UHFFFAOYSA-N 307.722 2.837 5 40 DFBB CC(=O)N[C@@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 108463574 YIYHXOAYERGIJG-TZMCWYRMSA-N 305.378 2.565 5 40 DFBB C[C@@H]1CN(c2cccc(Br)c2[N+](=O)[O-])CCCO1 521394487 VXXJNAREXONZNW-SECBINFHSA-N 315.167 2.973 5 40 DFBB Cc1cccc(C(=O)NCCN(C)c2ccccc2)c1[N+](=O)[O-] 12596915 HCMXERSXFAXQRH-UHFFFAOYSA-N 313.357 2.769 5 40 DFBB CC[C@@H](Oc1ccc([N+](=O)[O-])c(C)c1)C(=O)Nc1cc(C)on1 14186408 DOGSDIFOSQRDQE-CYBMUJFWSA-N 319.317 2.996 5 40 DFBB C[C@@H](NC(=O)N[C@H](C)C1CCOCC1)c1cccc([N+](=O)[O-])c1 97015977 PFNDYUFQIMNUIA-VXGBXAGGSA-N 321.377 2.770 5 40 DFBB CC[N+]1(C[C@@H](O)COC23CC4CC(CC(C4)C2)C3)CCCC1 17316926 HCYKKJUJBVRMGF-GSBYPIHSSA-N 308.486 2.963 5 40 DFBB Cc1ccc(C(=O)N2CCC[C@@]2(C)CCCO)cc1[N+](=O)[O-] 95456611 SQCGWDOXRCNAFD-INIZCTEOSA-N 306.362 2.670 5 40 DFBB O=[N+]([O-])c1ccc(N/C=C/c2nnnn2-c2ccccc2)cc1 100989923 ATOHBCVCOGIGJY-ZHACJKMWSA-N 308.301 2.653 5 40 DFBB O=C(Nc1cccnc1N1CCCC1)c1cccc([N+](=O)[O-])c1 47225534 JFISSZULGNZDLM-UHFFFAOYSA-N 312.329 2.842 5 40 DFBB COC(=O)c1c(C)nc(C)c2c(=O)oc3c(OC)cccc3c12 518145 MHUAAXMOBGDFNE-UHFFFAOYSA-N 313.309 2.753 5 40 DFBB biogenic COC(=O)c1ccc(Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 34349089 HAGMMNXCYAVUPJ-UHFFFAOYSA-N 311.297 2.779 5 40 DFBB COc1ncc(C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F 78971428 BWBWUHDBYWNURX-UHFFFAOYSA-N 305.265 2.698 5 40 DFBB Cn1ccnc1Sc1ncc([N+](=O)[O-])cc1Br 79015450 MZCWPRAYGUAHDD-UHFFFAOYSA-N 315.152 2.637 5 40 DFBB CCOc1ccc(Nc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 5688014 DTBBQXDZZJHGKX-UHFFFAOYSA-N 301.302 2.836 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)NCc1c(C)noc1C 97096153 DMESJRJFEUFEFO-UHFFFAOYSA-N 304.306 2.830 5 40 DFBB O=[N+]([O-])c1cc(-n2cnnn2)ccc1Sc1ccc(F)cc1 32826086 HCEDKUHCMBVOFK-UHFFFAOYSA-N 317.305 2.861 5 40 DFBB CNc1ccc(C(=O)Nc2nc3c(s2)CCC3)cc1[N+](=O)[O-] 25767719 VRVOUQHDLMQHRC-UHFFFAOYSA-N 318.358 2.834 5 40 DFBB CC(C)(C)c1ncc(NC(=O)c2cccc([N+](=O)[O-])c2)cn1 58412288 KVEVSUPIOWNVHB-UHFFFAOYSA-N 300.318 2.935 5 40 DFBB O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@H](C(F)(F)F)C1 36385436 APLQPWVHVHFXTQ-VIFPVBQESA-N 318.251 2.715 5 40 DFBB O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)c1c[nH]c2ccccc12 9356035 DTJJTWGXHBLENU-UHFFFAOYSA-N 309.281 2.898 5 40 DFBB CCOC(=O)Nc1ccc(Oc2c([N+](=O)[O-])ncn2C)cc1 69567248 JAIWLHGJGYVLQH-UHFFFAOYSA-N 306.278 2.689 5 40 DFBB C[C@H](OC(=O)[C@H]1C[C@@H]1[N+](=O)[O-])c1ccc(OC(F)F)cc1 71830278 HMDWLQHPEJXKDE-SWPVVBRQSA-N 301.245 2.557 5 40 DFBB Cc1noc(/C=C\c2ccccc2OCC(=O)O)c1[N+](=O)[O-] 408540970 AEMIABCTPPTFIY-SREVYHEPSA-N 304.258 2.525 5 40 DFBB COC(=O)Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 21002924 MJIZGKSUAACAOX-UHFFFAOYSA-N 314.297 2.563 5 40 DFBB CCC(=O)Nc1ccc(Nc2c([N+](=O)[O-])c(C)nn2C)cc1 79353723 GWTMHGMJUCTIHH-UHFFFAOYSA-N 303.322 2.729 5 40 DFBB O=C(c1ccccc1[N+](=O)[O-])N1CCOC[C@@H]1c1ccccc1 72541122 QQFRSNSQULIRMS-MRXNPFEDSA-N 312.325 2.809 5 40 DFBB CC[S@](=O)[C@H]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2C)C1 267409408 RKACEZLURLGEQM-KDKPCJNHSA-N 311.407 2.790 5 40 DFBB O=[N+]([O-])c1ccccc1Sn1cnc2c(S)ncnc21 5584321 NKYQMJOSFUUYAF-UHFFFAOYSA-N 305.344 2.579 5 40 DFBB COc1ccc(CCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 13672282 AJLAAPDSYGQELW-UHFFFAOYSA-N 314.341 2.966 5 40 DFBB COc1ccc(CCNc2ncccc2[N+](=O)[O-])cc1OC 33014469 GXAHRBQCRUDWQE-UHFFFAOYSA-N 303.318 2.662 5 40 DFBB Cc1ccccc1NC(=O)COC(=O)c1ccccc1[N+](=O)[O-] 1960537 MWEFVLPHKYSANF-UHFFFAOYSA-N 314.297 2.699 5 40 DFBB COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(C)n1 13728875 MHIBIJRWGSRNGG-UHFFFAOYSA-N 307.331 2.550 5 40 DFBB COc1ccc([N+](=O)[O-])cc1C(=O)OCc1scnc1C 65594408 OKXHMDZHBQILJJ-UHFFFAOYSA-N 308.315 2.725 5 40 DFBB O=[N+]([O-])c1ccc(N2CCN(c3ccccn3)CC2)c(Cl)c1 5688429 ALERHQZDTZAZKN-UHFFFAOYSA-N 318.764 2.970 5 40 DFBB C[C@@H]1Cc2ccccc2N1CC(=O)Nc1ccc([N+](=O)[O-])cc1 6790736 ZZAKJBQCQLJPCD-GFCCVEGCSA-N 311.341 2.985 5 40 DFBB CN(CCc1ccccn1)C(=O)Nc1cccc([N+](=O)[O-])c1 8703850 YJZJBKVVPKMOJT-UHFFFAOYSA-N 300.318 2.696 5 40 DFBB COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(C)n(C)c1C 408677445 QTEQWUMGIAVPEK-UHFFFAOYSA-N 303.318 2.811 5 40 DFBB O=C(NCCc1ccc([N+](=O)[O-])cc1)C1=Cc2ccccc2OC1 64777050 XFEDJNCIVFJLAX-UHFFFAOYSA-N 324.336 2.730 5 40 DFBB O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]2CC[C@H]1C2 104860311 QTGLGMYKENMJQX-AVGNSLFASA-N 303.362 2.559 5 40 DFBB COc1ccc(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2)cc1 6267909 ZHBBTJDAIXJRPT-UHFFFAOYSA-N 300.314 2.876 5 40 DFBB COc1ccc(NC(=O)CNc2ccc(F)c([N+](=O)[O-])c2)cc1 3285295 PKXXVWTWTRWQKD-UHFFFAOYSA-N 319.292 2.793 5 40 DFBB Cc1ccc(OCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)c([N+](=O)[O-])n1 5970484 KDJZMDIWLKLBRR-KGYLQXTDSA-N 321.377 2.618 5 40 DFBB O=C1OC(c2ccc([N+](=O)[O-])cc2)=N/C1=C\c1ccc(O)cc1 1735815 MUXRKJVUDYSSFT-ZROIWOOFSA-N 310.265 2.645 5 40 DFBB C[C@H](OCCCNc1ncc([N+](=O)[O-])cn1)c1ccccc1 96011479 QMBJJYUGDQRWHR-LBPRGKRZSA-N 302.334 2.965 5 40 DFBB O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc2nsnc2c1 57313743 DWOYQJKMJAGSJX-UHFFFAOYSA-N 300.299 2.852 5 40 DFBB CCC[C@H](C)N1Cc2cccc(NC(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])c2C1 69898170 SKNUYERSJJXHNK-GHJWDPDVSA-N 317.389 2.795 5 40 DFBB C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 95438292 IDBKDWGBSDZNGY-FZMZJTMJSA-N 312.325 2.889 5 40 DFBB CCN(c1ccccc1F)S(=O)(=O)c1ccccc1[N+](=O)[O-] 224749168 UUAVPYJPWOKKOW-UHFFFAOYSA-N 324.333 2.949 5 40 DFBB O=C(NCCCOCC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1 32809038 UTWSJADTPKBABN-UHFFFAOYSA-N 321.255 2.685 5 40 DFBB O=C(O)COc1ccc(-c2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 12548253 LNQKQFLMHMXRCC-UHFFFAOYSA-N 313.269 2.602 5 40 DFBB CCn1nc(C)c([N+](=O)[O-])c1C(=O)Nc1ccc(O)c(Cl)c1 97060406 VWGKGGNPPVIYSR-UHFFFAOYSA-N 324.724 2.731 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCc1ccnc(-n2ccnc2C)c1 69743191 INMCVWZJGOOHPO-UHFFFAOYSA-N 324.344 2.799 5 40 DFBB Cc1nn([C@H](C)C(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)cc1[N+](=O)[O-] 102599078 DQKCGZGIMIXYSB-SWTDPAGASA-N 320.393 2.602 5 40 DFBB O=[N+]([O-])c1cccnc1Nc1ccn(CCc2ccccn2)n1 58218296 MMNDPDBNIXZXBU-UHFFFAOYSA-N 310.317 2.568 5 40 DFBB O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CCCc2occc21 12952518 WXECGQJNRHPAOQ-NSHDSACASA-N 322.342 2.544 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 5786501 VRNLPPIGDIYAEJ-GWCFXTLKSA-N 312.391 2.760 5 40 DFBB COc1ccc(CCNc2ccc([N+](=O)[O-])cc2C(=O)O)cc1 38781896 LJFXLCFFWRLBRJ-UHFFFAOYSA-N 316.313 2.956 5 40 DFBB O=[N+]([O-])c1ccc(Cl)cc1-c1noc(C2CCNCC2)n1 199783705 SPKFHRCXGMERFS-UHFFFAOYSA-N 308.725 2.765 5 40 DFBB O=C(c1ccc(Cl)c([N+](=O)[O-])c1)n1nnc2ccccc21 3104138 YKQINDAMOOSYPJ-UHFFFAOYSA-N 302.677 2.681 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 276965 OMSBTWCJBZUCMQ-UHFFFAOYSA-N 303.245 2.774 5 40 DFBB COc1cc(N)c(OCc2cnc(Cl)s2)cc1[N+](=O)[O-] 95444810 BABMQEXPZSLKIY-UHFFFAOYSA-N 315.738 2.875 5 40 DFBB CC1(C)CCCN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 20485257 KRZAYZUEECGJHZ-UHFFFAOYSA-N 312.391 2.547 5 40 DFBB Cc1ccc(NC(=O)c2c[nH]c3ccccc3c2=O)cc1[N+](=O)[O-] 43504 GYFRUKCMFMWFFZ-UHFFFAOYSA-N 323.308 2.997 5 40 DFBB O=C(Nc1ccncc1[N+](=O)[O-])N1CCCc2ccccc2C1 97080931 ASPONOUAZCXBAD-UHFFFAOYSA-N 312.329 2.970 5 40 DFBB O=[N+]([O-])c1ccc(N2CC[C@H](CCO)C2)cc1C(F)(F)F 89769710 SSZZOJJUVHDNQT-SECBINFHSA-N 304.268 2.822 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](CCC(N)=O)C1 195553333 QSEVNJDWCBMFIJ-KGLIPLIRSA-N 319.405 2.942 5 40 DFBB Cc1cccc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 223737381 OIYKJJQTQUKWLD-UHFFFAOYSA-N 320.370 2.724 5 40 DFBB COc1cc(CN(C)Cc2ccoc2C)cc([N+](=O)[O-])c1O 92438413 KPKGHFLDXJQDHF-UHFFFAOYSA-N 306.318 2.842 5 40 DFBB CC(=O)Nc1nc(C)c(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)s1 5095378 GNAFZLDRSCWZFK-UHFFFAOYSA-N 317.330 2.861 5 40 DFBB C[C@H]1CCCC[C@@H]1NC(=O)NCCNc1ccccc1[N+](=O)[O-] 12642040 SSXCYYNRGIPZMF-STQMWFEESA-N 320.393 2.885 5 40 DFBB Cc1sc(C(=O)NC[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] 48380418 RXKDTCTUIKWXOM-LLVKDONJSA-N 323.374 2.590 5 40 DFBB Cc1c(C(=O)N2CCCC[C@@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 5678164 YVQDPEFTDCGICW-VIFPVBQESA-N 307.306 2.826 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1CCOc1ccc(F)cc1Cl 123454660 WTDMLIZOOIUKMX-UHFFFAOYSA-N 312.684 2.628 5 40 DFBB COC(=O)c1cc([N+](=O)[O-])c(N)c(F)c1Nc1ccccc1F 95080559 NOGALSZXSQWRDJ-UHFFFAOYSA-N 323.255 2.985 5 40 DFBB C[C@@H](OC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1 5723130 PPTUBSSINJWZBK-DDTOSNHZSA-N 319.313 2.866 5 40 DFBB CCc1nc(NC(=O)COc2ccc([N+](=O)[O-])cc2)sc1C 40123094 WVQQFKSCNZLJGW-UHFFFAOYSA-N 321.358 2.940 5 40 DFBB Cc1nn(C)c(C(=O)Nc2ccc(Cl)cc2F)c1[N+](=O)[O-] 2763659 HXDPRIKNEBIENU-UHFFFAOYSA-N 312.688 2.682 5 40 DFBB O=C(COc1ccccc1[N+](=O)[O-])Nc1nc2c(s1)CCC2 15636380 AMPMTNHEVCCHDM-UHFFFAOYSA-N 319.342 2.558 5 40 DFBB COc1cccc(O[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)c1 225126196 BVBZJBUYQRHYEY-HNNXBMFYSA-N 317.297 2.678 5 40 DFBB Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C 510885 CKBCKNLPCLYTON-UHFFFAOYSA-N 319.342 2.624 5 40 DFBB O=C(OCc1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] 6592013 ZJKOSPOQMCKOCO-UHFFFAOYSA-N 302.242 2.860 5 40 DFBB O=[N+]([O-])c1cccc(N/C=C\c2nnnn2-c2ccccc2)c1 100989925 JIFVSOGBKJPYLN-KTKRTIGZSA-N 308.301 2.653 5 40 DFBB Cn1cnc([N+](=O)[O-])c1NCc1cccnc1OC1CCCC1 29626449 ZPBRNRGFNKVIMZ-UHFFFAOYSA-N 317.349 2.657 5 40 DFBB COc1ccc([N+](=O)[O-])cc1[C@@H](C)NC(=O)[C@H](C)OCC1CC1 71830669 KCIHECUTHOOUNT-MNOVXSKESA-N 322.361 2.596 5 40 DFBB C[C@H]1C[C@@H](C)N(C(=O)c2ccc(F)cc2[N+](=O)[O-])c2ccnn21 97227650 OGKXDPCBZLZPLI-ZJUUUORDSA-N 318.308 2.930 5 40 DFBB O=[N+]([O-])c1cc(Cl)c(N2CCOCC2)c(Br)c1 45885840 FTJBOQMHXCIQEX-UHFFFAOYSA-N 321.558 2.847 5 40 DFBB O=C(c1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 100498300 GOQBKPXZXDTRJY-UHFFFAOYSA-N 317.213 2.642 5 40 DFBB CN(c1ccccc1F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 119953382 OVNJUEJARXOTJV-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB Cc1cc(OCC(=O)N(C)Cc2ccco2)ccc1[N+](=O)[O-] 24521007 GNVLCTSZIUMIBW-UHFFFAOYSA-N 304.302 2.534 5 40 DFBB CN(c1nc2sccn2c1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 71920853 ZAZZYDDPKKWKEV-BBBLOLIVSA-N 322.390 2.554 5 40 DFBB C[C@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(C(N)=O)cc1 32851038 AJEQCSSQAWWYGM-GFCCVEGCSA-N 313.357 2.887 5 40 DFBB CC(C)C[C@@](C)(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4824534 NTLWYDBVHFPHOF-CYBMUJFWSA-N 311.294 2.804 5 40 DFBB O=[N+]([O-])c1ncccc1OCc1nc(-c2ccsc2)no1 7202985 GJOLMPUGBLMBLJ-UHFFFAOYSA-N 304.287 2.680 5 40 DFBB Cn1cnc([N+](=O)[O-])c1Nc1cc(Cl)c(N)c(Cl)c1 8317747 PPNMPLMLOSMADZ-UHFFFAOYSA-N 302.121 2.961 5 40 DFBB C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@H](c2ccccc2)O1 58282702 SUBDXADFZYXTFU-BXUZGUMPSA-N 316.313 2.790 5 40 DFBB COc1ccc(OCCCNc2ccc([N+](=O)[O-])cn2)cc1 57148997 UCXRXHLDUFKMMR-UHFFFAOYSA-N 303.318 2.879 5 40 DFBB CC1(C)O[C@]2(C)CC[C@@H]1[C@@H]1[C@@H]2N1C(=O)c1ccc([N+](=O)[O-])cc1 103872638 WKHNLBMOCOAPPQ-AFYOPQESSA-N 316.357 2.765 5 40 DFBB CC(C)N1CCC(N(C)C(=O)c2ccccc2[N+](=O)[O-])CC1 65553220 ZIVFFPJGQSTNHV-UHFFFAOYSA-N 305.378 2.540 5 40 DFBB O=C(O)c1cc(OCc2ccccc2F)cc([N+](=O)[O-])c1O 216846226 UHMSXAQYYRAGQY-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB COc1ccc(O[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)O)cc1 225126328 OPJXRZVJXQTCPB-OAHLLOKOSA-N 317.297 2.678 5 40 DFBB O=[N+]([O-])c1cccc(S(=O)(=O)n2ccc3ccccc32)c1 49785747 QLIJJWSVXNTHDW-UHFFFAOYSA-N 302.311 2.787 5 40 DFBB O=[N+]([O-])c1ccc([S@@](=O)Cc2ccccc2)c([N+](=O)[O-])c1 5048902 LKWVQGBAQZESOK-OAQYLSRUSA-N 306.299 2.811 5 40 DFBB Cc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c([N+](=O)[O-])c1 13467738 UEXKHZZFXLMYOJ-GHMZBOCLSA-N 304.302 2.509 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1Cc1nc2ccccc2n1C(F)F 31672475 ZZTLQTMDCDZPRZ-UHFFFAOYSA-N 320.255 2.550 5 40 DFBB Cc1ccc(Cn2c(C)nc3ccc([N+](=O)[O-])cc3c2=O)cc1 930665 SQFPGDJAOQXCST-UHFFFAOYSA-N 309.325 2.970 5 40 DFBB Cc1cnc(NCCC(=O)Nc2ccccc2)c([N+](=O)[O-])c1 78663341 VYAWGTPESNHRFH-UHFFFAOYSA-N 300.318 2.739 5 40 DFBB O=[N+]([O-])c1ccc(COc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 100496494 PVMDRJAKEWWMHR-UHFFFAOYSA-N 319.229 2.990 5 40 DFBB S=C(Nc1cc2cccnc2c2cccnc12)N1CCOCC1 4739764 UEQHNHSZSGQYDO-UHFFFAOYSA-N 324.409 2.812 5 40 DFBB Cc1ccn2cc(C(=O)OCc3ccc([N+](=O)[O-])cc3)nc2c1 17183358 ILBUOVBAYLAAAJ-UHFFFAOYSA-N 311.297 2.908 5 40 DFBB COc1cc(NC(=O)CN2CCC(C)CC2)c(C)cc1[N+](=O)[O-] 8684994 YJWBZLURWOJQER-UHFFFAOYSA-N 321.377 2.582 5 40 DFBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCn2c1nc1ccccc12 520025 IOFOVUBOJCVNKZ-UHFFFAOYSA-N 308.297 2.605 5 40 DFBB Cc1cccc2nc(Cn3c(=O)oc4cc([N+](=O)[O-])ccc43)cn12 75140906 OCFUGDHQQUSOSJ-UHFFFAOYSA-N 324.296 2.507 5 40 DFBB C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 9909267 QUKFRNYZDZSGLJ-NSHDSACASA-N 318.304 2.990 5 40 DFBB O=[N+]([O-])c1ccc(Sc2nnc(N3CCCC3)s2)nc1 48894043 MIMVKJVHYPRPMR-UHFFFAOYSA-N 309.376 2.593 5 40 DFBB O=C(O)[C@H](Cc1ccccc1)NSc1ccccc1[N+](=O)[O-] 28631505 JPFBMBJXDGJTDF-LBPRGKRZSA-N 318.354 2.887 5 40 DFBB CCCN1C(=O)S/C(=C\Nc2cccc([N+](=O)[O-])c2)C1=O 36636196 DHUKGGNLVGDUCF-FLIBITNWSA-N 307.331 2.954 5 40 DFBB Cc1cnc(OCc2nnc(-c3cccs3)o2)c([N+](=O)[O-])c1 96455741 BQUIFWVGZJIPRB-UHFFFAOYSA-N 318.314 2.989 5 40 DFBB Cc1nnc(SCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])s1 16363445 CJFCREUMPHBDHJ-UHFFFAOYSA-N 312.332 2.955 5 40 DFBB O=C1CN(c2ccccc2)C(=O)N1Cc1ccccc1[N+](=O)[O-] 54271849 XDBHQTSJJDCUCW-UHFFFAOYSA-N 311.297 2.564 5 40 DFBB COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cn2)c1 54967423 CTIVJPFRQHXZGT-UHFFFAOYSA-N 307.693 2.904 5 40 DFBB NC(=O)c1ccc(NCCc2c[nH]c3ccccc23)c([N+](=O)[O-])c1 5688422 KVRLHTIQQYEHEA-UHFFFAOYSA-N 324.340 2.830 5 40 DFBB O=C(O)c1cc(OCc2cccc(F)c2)cc([N+](=O)[O-])c1O 216846180 CQUFEGLNTINLSC-UHFFFAOYSA-N 307.233 2.717 5 40 DFBB CCS[C@H]1CCC[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1 96450538 WHEOKYDBGOPOKL-KGLIPLIRSA-N 308.403 2.928 5 40 DFBB O=c1ccc([N+](=O)[O-])cn1Cc1csc(-c2ccccc2)n1 9314781 KSRPBJBYBUGMBV-UHFFFAOYSA-N 313.338 2.928 5 40 DFBB CCc1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 258582 TYRYZRCQWQFBOP-UHFFFAOYSA-N 306.343 2.958 5 40 DFBB C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)NCC(F)(F)F 32795384 CPDBJQNWVQOOEV-QMMMGPOBSA-N 305.256 2.860 5 40 DFBB COc1ccc(NC(=O)c2ccccc2C(=O)O)c([N+](=O)[O-])c1 4016697 PYQNBXWTSZRABA-UHFFFAOYSA-N 316.269 2.554 5 40 DFBB Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1COc2ccccc2O1 5009666 YJJGIJRGIQKMNJ-OAHLLOKOSA-N 314.297 2.682 5 40 DFBB Cc1cc([N+](=O)[O-])cnc1NCc1ccc(Cn2cncn2)cc1 96453317 YARLJFOZZBOKHE-UHFFFAOYSA-N 324.344 2.550 5 40 DFBB NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 5672437 KKGNLIYEFKWUEM-UHFFFAOYSA-N 319.704 2.599 5 40 DFBB C[C@@H]1CCN(C(=O)CCn2cnc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]12 40090673 HQSAKDAJSYPHDI-MGPQQGTHSA-N 320.393 2.609 5 40 DFBB CCCCN(CCO)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 65610320 FDFYKKHTBTUYKT-UHFFFAOYSA-N 315.757 2.875 5 40 DFBB CC(=O)c1ccc(N[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1 69349189 QJMPOOGCWWZFKV-HNNXBMFYSA-N 314.341 2.813 5 40 DFBB O=[N+]([O-])c1c(N[C@H]2COc3ccccc32)nc2sccn12 70198989 CUHNWOVNKSFKLN-VIFPVBQESA-N 302.315 2.850 5 40 DFBB O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1cccs1 69512399 LEUYOTHXUZXYDX-UHFFFAOYSA-N 315.314 2.694 5 40 DFBB COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(OC)c1 5513279 BWGMXCDIUVZTTI-UHFFFAOYSA-N 302.286 2.864 5 40 DFBB CCn1c(=N)n(CC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 19855185 CRNBYYYJSRLMRP-UHFFFAOYSA-N 324.340 2.733 5 40 DFBB O=[N+]([O-])c1cc([N+](=O)[O-])c2nonc2c1NCc1ccccc1 5376941 CENLWOSPXCVHJO-UHFFFAOYSA-N 315.245 2.651 5 40 DFBB CCC(=O)Nc1c2c(nn1-c1ccc([N+](=O)[O-])cc1)CSC2 190314 AWMHVGGRTORWQU-UHFFFAOYSA-N 318.358 2.876 5 40 DFBB O=[N+]([O-])c1ccc(N[C@@H]2c3ccccc3C[C@@H]2O)c([N+](=O)[O-])c1 53602071 DXXBYLUQBUERSB-LSDHHAIUSA-N 315.285 2.573 5 40 DFBB COc1cc(OCC(=O)Nc2cccc(F)c2)ccc1[N+](=O)[O-] 22259394 XYUVWFNPHASESI-UHFFFAOYSA-N 320.276 2.760 5 40 DFBB COC(=O)c1ccc(C)c(NC(=O)c2ccccc2[N+](=O)[O-])c1 5609777 JFZXZGUGUNDEIK-UHFFFAOYSA-N 314.297 2.942 5 40 DFBB CN(c1ccccc1F)S(=O)(=O)c1cccc([N+](=O)[O-])c1 171807494 GCLGCHMYOIZKIA-UHFFFAOYSA-N 310.306 2.559 5 40 DFBB COc1cc(CNc2ccc3[nH]ncc3c2)cc([N+](=O)[O-])c1O 95440153 XOTCLTIQFNSIDV-UHFFFAOYSA-N 314.301 2.797 5 40 DFBB CC[C@@H]1C[N@+]2(C)CCc3cc(OC)c(OC)cc3[C@@H]2CC1=O 247694117 YQACESCIPWFYQC-YFROIQMUSA-N 304.410 2.747 5 40 DFBB CCN(CC)C(=O)[C@@H]1CCCN(c2ccccc2[N+](=O)[O-])C1 4182321 UDVDKLWQHCSBQO-CYBMUJFWSA-N 305.378 2.680 5 40 DFBB Fc1ccc(Cn2c3ccccc3c3nn4cnnc4nc32)cc1 160038 UYYAGDCZLYYTLV-UHFFFAOYSA-N 318.315 2.815 5 40 DFBB O=C(COC(=O)c1ccc([N+](=O)[O-])s1)Nc1ccc(F)cc1 3496547 SRDYJLLFOUJHOY-UHFFFAOYSA-N 324.289 2.591 5 40 DFBB CCOc1cc(C(=O)Nc2nccs2)c([N+](=O)[O-])cc1OC 7918999 ZJNHWJKYKRKTQV-UHFFFAOYSA-N 323.330 2.711 5 40 DFBB CC[C@@H](Oc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(C)on1 9499502 JODGQLKIKDLCQN-LLVKDONJSA-N 305.290 2.687 5 40 DFBB CCn1c(Cn2c([N+](=O)[O-])cnc2C)nc2cc(F)ccc21 72296511 ZRAPGVFTVPAHNM-UHFFFAOYSA-N 303.297 2.657 5 40 DFBB CN(C)c1nc2cc(NC(=O)c3ccc([N+](=O)[O-])o3)ccc2o1 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309.366 2.598 5 40 DFBB Cc1c[nH]/c(=N/C(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)[nH]1 97376053 BBMRQAPUEAFKOY-UHFFFAOYSA-N 320.374 2.801 5 40 DFBB COc1ccc(Cn2cnc([N+](=O)[O-])c2)cc1Br 179290 PZALNEJRDKECSQ-UHFFFAOYSA-N 312.123 2.611 5 40 DFBB NC(=O)c1ccc(COc2cc([N+](=O)[O-])ccc2Cl)cc1 78989906 DFWMPLCLDHGSPQ-UHFFFAOYSA-N 306.705 2.926 5 40 DFBB C[C@H]1CCCC[C@@H]1Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 6250577 SIKWGBPEFHHJMJ-JQWIXIFHSA-N 312.391 2.989 5 40 DFBB O=c1c([N+](=O)[O-])cccn1Cc1ccc(Br)cc1 72280381 UCWAMNFQPSLFOR-UHFFFAOYSA-N 309.119 2.567 5 40 DFBB CCS[C@H]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 225541889 ZNDLUCAXAYJAGN-KOLCDFICSA-N 309.391 2.581 5 40 DFBB O=[N+]([O-])c1cccnc1N(C[C@H](O)c1ccc(F)cc1)C1CC1 75109720 QSFDXOQJQMOFBT-HNNXBMFYSA-N 317.320 2.831 5 40 DFBB Cc1ccc(OCC(=O)N[C@H]2CCC[C@H](C)[C@@H]2C)c([N+](=O)[O-])n1 5970482 KDJZMDIWLKLBRR-DRZSPHRISA-N 321.377 2.618 5 40 DFBB O=C(CCC(=O)c1ccccc1)NCc1ccccc1[N+](=O)[O-] 53857718 FCYWFCPNXRWXTC-UHFFFAOYSA-N 312.325 2.874 5 40 DFBB O=C(O)C[C@@H](NC(=O)c1cccs1)c1cccc([N+](=O)[O-])c1 4581130 UTZPECYTFKUDQW-LLVKDONJSA-N 320.326 2.602 5 40 DFBB O=C(NC1=NCCS1)c1ccc(-c2cccc([N+](=O)[O-])c2)o1 6321746 IYBHVGIUMHWSFQ-UHFFFAOYSA-N 317.326 2.687 5 40 DFBB CCO[C@@H](C)c1noc(COc2ccc(C)cc2[N+](=O)[O-])n1 71914710 FHICPTXIIFYVRD-JTQLQIEISA-N 307.306 2.963 5 40 DFBB COc1cc(C(=O)NCc2cncc(C)c2)cc([N+](=O)[O-])c1C 195579898 ZZMAGZZGQKVUIT-UHFFFAOYSA-N 315.329 2.545 5 40 DFBB Cc1ccc(C2=N/C(=C\c3cccc([N+](=O)[O-])c3)C(=O)N2)cc1 4610928 NMCVAJWNPQEWJU-GDNBJRDFSA-N 307.309 2.821 5 40 DFBB Cn1cnc([N+](=O)[O-])c1N[C@H](CN1CCCC1)c1ccccc1 40497161 HUIKEADQPJYFKM-CQSZACIVSA-N 315.377 2.577 5 40 DFBB Cc1cc(C(=O)NCc2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] 851087 LTUBNGPEGJAFPB-UHFFFAOYSA-N 314.297 2.562 5 40 DFBB COc1ccc(NC(=O)COc2ccccc2C)cc1[N+](=O)[O-] 9141577 HFHKZVAYYVPXLL-UHFFFAOYSA-N 316.313 2.929 5 40 DFBB CC[N+](C)(C)C[C@@H]1C(=O)O[C@@]23[C@H]1CC[C@@H](C)[C@H]2CC[C@@]1(C)O[C@H]13 9329323 BGJJAOTZPPPJJJ-DVLKJIGXSA-N 322.469 2.608 5 40 DFBB O=c1c([N+](=O)[O-])c(NCCCC2CCCC2)nc2ccccn12 29526932 FIRXQRLGHKKZGV-UHFFFAOYSA-N 316.361 2.985 5 40 DFBB O=[N+]([O-])c1ccc(N2CCC[C@@H]2Cn2cncn2)c(Cl)c1 95351530 ZKVACMIANOOHNE-LLVKDONJSA-N 307.741 2.509 5 40 DFBB CC(=O)c1ccc(N2CCN(CCC(C)C)CC2)c([N+](=O)[O-])c1 32932680 IMAPVAIYFBFHCF-UHFFFAOYSA-N 319.405 2.966 5 40 DFBB Cc1cc(OCC(=O)Nc2ncccc2Cl)ccc1[N+](=O)[O-] 390835069 CAWYZVTVLUHCKN-UHFFFAOYSA-N 321.720 2.969 5 40 DFBB Cn1/c(=N\C(=O)c2ccc([N+](=O)[O-])o2)sc2cc(F)ccc21 11853025 BMJWVTJUVYHZFI-FYWRMAATSA-N 321.289 2.621 5 40 DFBB CC(C)(COC(=O)COc1ccc(Cl)cc1Cl)[N+](=O)[O-] 1661510 NTYBHPLIXLPXSI-UHFFFAOYSA-N 322.144 2.971 5 40 DFBB O=C(O)c1cccnc1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 6925885 QEUFXJYDDDPFRG-UHFFFAOYSA-N 321.270 2.747 5 40 DFBB Cc1ccc(O[C@@H](C(=O)N(C)C)c2ccccc2)c([N+](=O)[O-])n1 6976096 YMVFEPYUXLYQLS-CQSZACIVSA-N 315.329 2.507 5 40 DFBB O=C(NC1CC1)[C@H](Oc1cccc([N+](=O)[O-])c1)c1ccccc1 7544363 CUYRTVITTLIKIH-MRXNPFEDSA-N 312.325 2.994 5 40 DFBB NC(=O)Cc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1 46484890 FJWJEYUVXMKASE-UHFFFAOYSA-N 322.324 2.914 5 40 DFBB O=C(CNc1sccc1[N+](=O)[O-])N1CCc2sccc2C1 95986641 ORUMIULBPZMOOI-UHFFFAOYSA-N 323.399 2.715 5 40 DFBB CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1c(C)noc1C 97097557 TWVWWCNIBJUJRT-LBPRGKRZSA-N 319.317 2.786 5 40 DFBB COc1cc(CO)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 8119767 ZZPOHWJBICSULQ-UHFFFAOYSA-N 320.257 2.796 5 40 DFBB in-vitro CCOc1ccccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] 20452592 GORAVKFREWKARW-UHFFFAOYSA-N 314.341 2.852 5 40 DFBB O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc2ccccc2c1 5039039 CADCBTJXZKLAJI-UHFFFAOYSA-N 323.308 2.548 5 40 DFBB CC1=C(C)C[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C(=O)O)C1 4651857 GILTVGMGRNATNP-KBPBESRZSA-N 318.329 2.981 5 40 DFBB O=[N+]([O-])c1cc(F)ccc1N1CCN(c2ccc(O)cc2)CC1 8147022 YEVXMATYCVHPML-UHFFFAOYSA-N 317.320 2.766 5 40 DFBB O=C(NC1CC1)[C@H](Oc1ccc([N+](=O)[O-])cc1)c1ccccc1 8291144 MWHYTVAVDBJIBQ-MRXNPFEDSA-N 312.325 2.994 5 40 DFBB COCCCCC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1O 95992848 QPMOSNMKIQGEEX-UHFFFAOYSA-N 302.714 2.709 5 40 DFBB CSc1ccccc1NC(=O)c1n[nH]c([N+](=O)[O-])c1Cl 6787017 MHZYFVXBSUMXTB-UHFFFAOYSA-N 312.738 2.946 5 40 DFBB COc1cccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 39745366 NUMACNDESROOHD-UHFFFAOYSA-N 302.286 2.621 5 40 DFBB O=C1NC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C\c1ccco1 342797 MZYPCJSATNAINC-XFFZJAGNSA-N 317.688 2.759 5 40 DFBB Cc1oc(-c2cccc([N+](=O)[O-])c2)cc1C(=O)N1CCOCC1 5032287 AEYQWWNDHMNPJC-UHFFFAOYSA-N 316.313 2.636 5 40 DFBB Cc1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 7738073 LFLIAWPWTKLQPY-SSDOTTSWSA-N 324.387 2.874 5 40 DFBB CC[C@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2)CCS1 76086173 UFJADZZUDHXJBU-ZDUSSCGKSA-N 309.391 2.632 5 40 DFBB O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1ccc([N+](=O)[O-])cc1 225452334 SBNNMMXSGSEUOV-SNPRPXQTSA-N 304.346 2.813 5 40 DFBB O=C(Nc1ncccc1O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 22262535 BPJRBLNUWZXVSO-UHFFFAOYSA-N 314.301 2.522 5 40 DFBB CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](O)(C(C)(C)C)C1 335226 SIFCEASPNSHDOW-HNNXBMFYSA-N 305.334 2.551 5 40 DFBB O=C(CCc1ccccc1)OCC(=O)c1cccc([N+](=O)[O-])c1 3097058 KIIHMNKVDGLRQO-UHFFFAOYSA-N 313.309 2.954 5 40 DFBB CCS[C@H]1CCCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 71899608 GBQHGLDDIUCWCA-LBPRGKRZSA-N 323.418 2.806 5 40 DFBB Cc1ccc([C@@H](N)c2n[nH]c(-c3ccc([N+](=O)[O-])cc3)n2)cc1 95534095 KPBQEOHRVCJOKY-CQSZACIVSA-N 309.329 2.736 5 40 DFBB COc1ccc(OCc2nc(C(C)(C)C)no2)c([N+](=O)[O-])c1 12913050 FCRNCFOYARCSPC-UHFFFAOYSA-N 307.306 2.863 5 40 DFBB COc1ccc(C2=N/C(=C\c3ccccc3[N+](=O)[O-])C(=O)O2)cc1 5003517 UHQCMCZDHGTDBI-UVTDQMKNSA-N 324.292 2.948 5 40 DFBB CC(C)N(C(=O)COc1cccnc1[N+](=O)[O-])c1ccccc1 5971385 PJLDJRNBQXFXAD-UHFFFAOYSA-N 315.329 2.810 5 40 DFBB CCN(C(=O)COc1cccnc1[N+](=O)[O-])c1ccc(F)cc1 7220722 XOTYUUATCABILG-UHFFFAOYSA-N 319.292 2.561 5 40 DFBB CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1C[C@H]2CCCC[C@H]2C1 195576748 IUPDFKSMGCABIG-TXEJJXNPSA-N 324.402 2.625 5 40 DFBB COc1cc(N[C@@H](C)C(=O)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] 96429378 SKXDHPKFSAAPPX-NEPJUHHUSA-N 321.377 2.805 5 40 DFBB CCc1cnc(CCNC(=O)Cc2ccccc2[N+](=O)[O-])s1 96431783 YALTVAMXDQENDJ-UHFFFAOYSA-N 319.386 2.515 5 40 DFBB COc1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2)cc1OC 3249205 PTGWYNQXILJJIM-UHFFFAOYSA-N 317.297 2.969 5 40 DFBB Cc1nn([C@H](C)C(=O)N(C)c2ccccc2)c(C)c1[N+](=O)[O-] 3352119 RULFBJYBXWCLLR-GFCCVEGCSA-N 302.334 2.632 5 40 DFBB CCNc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-] 4797225 WVEFPLJZWAMMFH-UHFFFAOYSA-N 321.358 2.827 5 40 DFBB O=C(Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC=CC[C@H]1C(=O)O 6828723 RJVVQUURVYDMTH-VHSXEESVSA-N 324.720 2.854 5 40 DFBB CCn1cc(C(=O)Cn2c([N+](=O)[O-])cnc2C)c2ccccc21 10006520 OHCZNIQTWBQTKZ-UHFFFAOYSA-N 312.329 2.957 5 40 DFBB COc1ccc(-c2nc(Cn3cnc([N+](=O)[O-])c3)cs2)cc1 24769937 ISTJXEFOXLCKKG-UHFFFAOYSA-N 316.342 2.972 5 40 DFBB COc1ccccc1N(C)CC(=O)Nc1ccccc1[N+](=O)[O-] 53266299 VAJQZBFQJIPLTH-UHFFFAOYSA-N 315.329 2.678 5 40 DFBB CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1c(F)cccc1F 58156918 RZBMOUGHZDQLSE-UHFFFAOYSA-N 321.283 2.608 5 40 DFBB Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H](CC3)[C@@H]2C1=O 169703827 BPBSXZMLLWDWFB-FIXIBIHLSA-N 312.325 2.605 5 40 DFBB Cc1ccc(COc2cc(C(=O)O)c(O)c([N+](=O)[O-])c2)cc1 216753433 SURSGQJXNKAHKX-UHFFFAOYSA-N 303.270 2.886 5 40 DFBB CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](O)(C(C)(C)C)C1 335230 SIFCEASPNSHDOW-OAHLLOKOSA-N 305.334 2.551 5 40 DFBB O=C(O[C@H]1[C@H]2CC[C@@H]2[C@H]2C[C@H]12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 103936015 DDDKPZKIQUKROA-LXTQYOMGSA-N 318.285 2.704 5 40 DFBB Cc1ccc(C(=O)Nc2ccc(C(=O)O)c(O)c2)cc1[N+](=O)[O-] 20140971 SHWOJSQTUMDMRH-UHFFFAOYSA-N 316.269 2.559 5 40 DFBB O=[N+]([O-])c1c(NC[C@H]2Cc3ccccc3O2)nc2sccn12 46483803 PFCNVIJKDHEXER-SNVBAGLBSA-N 316.342 2.720 5 40 DFBB O=C(Nc1ccccc1)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cn1 12984364 IJPUWNDPOMHSEB-AWEZNQCLSA-N 312.329 2.597 5 40 DFBB O=c1nc2c3ccccc3nc(S)n2nc1-c1ccc(F)cc1 71924271 LLDNWGSBPQBVBS-UHFFFAOYSA-N 324.340 2.733 5 40 DFBB Cc1[nH]nc(C(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)c1[N+](=O)[O-] 77141360 OOMSRYAINCACDC-WDEREUQCSA-N 320.736 2.566 5 40 DFBB COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)c1ccccc1C 78556396 CDRUOTAFXMOYTG-UHFFFAOYSA-N 321.354 2.886 5 40 DFBB C[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 6007939 ORQAQFGKAGHHCD-HIFRSBDPSA-N 316.357 2.685 5 40 DFBB Cc1ccc(N2CCCN(C3CCOCC3)CC2)c([N+](=O)[O-])c1 80645851 QNGGORKHJHLERO-UHFFFAOYSA-N 319.405 2.594 5 40 DFBB Cc1cc([N+](=O)[O-])cc2c(Br)c(C(=O)O)cnc12 85386552 JONIVENXUIRKAN-UHFFFAOYSA-N 311.091 2.912 5 40 DFBB Cc1ccc(CNC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cc1 6218468 PZTDZIXHRAFAGK-UHFFFAOYSA-N 313.357 2.899 5 40 DFBB Cc1nn([C@@H](C)C(=O)Nc2ccc(F)cc2)c(C)c1[N+](=O)[O-] 2640287 SXJNSKKDJHHOEU-JTQLQIEISA-N 306.297 2.747 5 40 DFBB CCCN1C(=O)N/C(=C/c2ccc(Cl)c([N+](=O)[O-])c2)C1=O 409240016 PFLNCOCFWUBZPK-UXBLZVDNSA-N 309.709 2.551 5 40 DFBB O=[N+]([O-])c1ccc(CO[C@H]2C[C@@H]3[C@H]4C=C[C@@H]4[C@H]23)c([N+](=O)[O-])c1 45070874 SREHYKGRATYLGD-QIRZIZBZSA-N 302.286 2.840 5 40 DFBB