smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COCCCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 2063424 IRLWDTJJJZPAQD-UHFFFAOYSA-N 298.295 1.378 5 50 CDBA COC[C@H]1CN(c2c(OC)cccc2[N+](=O)[O-])CCO1 328593437 JSWUCAVWVVLVDN-SNVBAGLBSA-N 282.296 1.455 5 50 CDBA NC(=O)[C@@H]1CCN(c2ccnc3c([N+](=O)[O-])cccc23)C1 432333509 BKWYOJXVRIQHNR-SECBINFHSA-N 286.291 1.455 5 50 CDBA O=[N+]([O-])c1cccc(OCCOCCN2CCOCC2)c1 20639407 NRTOSCDPJBDPRP-UHFFFAOYSA-N 296.323 1.322 5 50 CDBA O=[N+]([O-])c1ncc(N2CCC[C@H](CCO)C2)cc1O 952994605 RELXTGREMOVTEM-SECBINFHSA-N 267.285 1.294 5 50 CDBA C[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)[C@H](C(N)=O)C1 1615588187 YLTODGITGGNGHI-WPRPVWTQSA-N 264.285 1.080 5 50 CDBA COc1cc([N+](=O)[O-])cnc1N1CC[C@@H](O)CC(C)(C)C1 585133007 MKTIVYVIVGNSCA-LLVKDONJSA-N 295.339 1.986 5 50 CDBA Cc1cc(N[C@@H]2C[C@H](O)[C@H]2n2cccn2)ncc1[N+](=O)[O-] 596302192 QAJRXWLCHCXWLA-CDMKHQONSA-N 289.295 1.281 5 50 CDBA Cc1nn2cc(-c3n[nH]cc3[N+](=O)[O-])cnc2c1[N+](=O)[O-] 12849556 LWXWECRXCMLYDI-UHFFFAOYSA-N 289.211 1.244 5 50 CDBA O=C1C=CC[C@@H]2[C@@H]3CCC[N@+]4([O-])CCC[C@H](CN12)[C@H]34 253618088 QMGGMESMCJCABO-OOKGIHQLSA-N 262.353 1.660 5 50 CDBA biogenic CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@]2(CCOC2)C1 192775821 UMINPYWMYRLCNP-ZDUSSCGKSA-N 296.327 1.115 5 50 CDBA O=C1Nc2ccc([N+](=O)[O-])cc2[C@]1(O)N1CCCCCC1 5015559 IJKZPJDBFDPZMA-CQSZACIVSA-N 291.307 1.568 5 50 CDBA O=[N+]([O-])c1cc2c(cc1CN1CCSCC1)OCO2 55543936 RUSZYKGXJQIGDL-UHFFFAOYSA-N 282.321 1.872 5 50 CDBA Cc1n[nH]cc1Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O 170604913 WFIIBUVYTXKDTA-UHFFFAOYSA-N 296.308 1.773 5 50 CDBA COC[C@H](Nc1ccc([N+](=O)[O-])cn1)[C@H]1CCCO1 225714388 NBIGRCVIIPSXPU-WDEREUQCSA-N 267.285 1.596 5 50 CDBA CC12CN3CC(C)(CN(C1)C3c1ccc([N+](=O)[O-])o1)C2=O 19323187 DTWFWAJUJUJRBY-UHFFFAOYSA-N 291.307 1.413 5 50 CDBA biogenic O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccccn1 621041 NTDZBAAIAFDGKO-UHFFFAOYSA-N 287.275 1.685 5 50 CDBA C[C@H](O)CNCCNc1ccc([N+](=O)[O-])cc1Cl 4143281 DAVRYBDIZYBJOI-QMMMGPOBSA-N 273.720 1.631 5 50 CDBA CCOC(=O)C(=O)CC(=O)c1cc(C)cc([N+](=O)[O-])c1O 100008589 CTRVSQSUFVRCOP-UHFFFAOYSA-N 295.247 1.314 5 50 CDBA O=C1CCC[C@@H]2[C@H]3CCC[N@+]4([O-])CCC[C@@H](CN12)[C@@H]34 238809610 XVPBINOPNYFXID-JARXUMMXSA-N 264.369 1.884 5 50 CDBA biogenic,in-vitro O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@H]2C[C@@H]2C1 585124053 SZISOHKFNBJURH-NXEZZACHSA-N 261.281 1.485 5 50 CDBA Cc1cc(N[C@H](C)Cc2cn(C)nn2)ncc1[N+](=O)[O-] 952991942 FMFSILPSKCYCGA-SECBINFHSA-N 276.300 1.470 5 50 CDBA O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1O)C1CC1 35864430 AQKPAGBYVUJUNN-UHFFFAOYSA-N 281.293 1.523 5 50 CDBA Cc1nonc1COc1c([N+](=O)[O-])cnc(C)c1C 408522365 IAIWIXQBPXSADX-UHFFFAOYSA-N 264.241 1.877 5 50 CDBA COc1cc(OC)c(/C=C/[N+](=O)[O-])c([N+](=O)[O-])c1 1311100 HNZVLFSBTBGMPC-ONEGZZNKSA-N 254.198 1.859 5 50 CDBA O=[N+]([O-])c1ccc(N2CCCC2)c(OCCO)c1 3880441 BMTPLWMBLKGHBD-UHFFFAOYSA-N 252.270 1.566 5 50 CDBA O=C(O)[C@H]1CS[C@H](c2ccc([N+](=O)[O-])s2)N1 99234 WNEKIYRMXWCTGY-CLZZGJSISA-N 260.296 1.445 5 50 CDBA C[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)C[C@H](C2CC2)O1 408524588 VZRYRDJTRBUUJD-GZMMTYOYSA-N 278.312 1.576 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccccc1 462951 ZPUADKURLMAXJR-UHFFFAOYSA-N 260.253 1.738 5 50 CDBA Cc1ccnc(NC2CC(Cn3ccnn3)C2)c1[N+](=O)[O-] 1875289348 KUVLDDGIQSBVQG-UHFFFAOYSA-N 288.311 1.780 5 50 CDBA COC[C@H](C)NCc1cc2c(cc1[N+](=O)[O-])OCO2 4997335 PSFXBQOKVMDECA-QMMMGPOBSA-N 268.269 1.448 5 50 CDBA COc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c(C)c1 484289 HLKFAZUNROSOPL-UHFFFAOYSA-N 290.279 1.747 5 50 CDBA CC1(C)CN(c2ncccc2[N+](=O)[O-])[C@@H]2COC[C@H]2O1 585090434 MVTKNJCZCMOZMT-GHMZBOCLSA-N 279.296 1.372 5 50 CDBA O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCOCC1 224741 VLGUBPDISOXYSF-AATRIKPKSA-N 262.265 1.467 5 50 CDBA N=C1NC(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)S1 18191526 DKWXGSWXVDOMJH-YWEYNIOJSA-N 265.250 1.439 5 50 CDBA COC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(C)c1 456305 HSUUOKOYUOOBBJ-SECBINFHSA-N 252.270 1.668 5 50 CDBA O=C(CN1CCCC1)Nc1ccc(F)c([N+](=O)[O-])c1 8730080 KKZPSZXXEMMZPX-UHFFFAOYSA-N 267.260 1.768 5 50 CDBA CCCN(CCO)C(=O)c1cc(C)cc([N+](=O)[O-])c1N 170591753 AEBWNXJAGFQXPH-UHFFFAOYSA-N 281.312 1.330 5 50 CDBA C[C@H]1C[C@H](O)C[C@@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1 253369734 HNWOWMCAJDWGCQ-GNXNZQSNSA-N 292.335 1.898 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1NCC1(C(=O)OC)CC1 192794345 GVUQVXYRCDHJHM-UHFFFAOYSA-N 282.300 1.485 5 50 CDBA Cn1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 1110191 YVPRKDHGGFQIFR-UHFFFAOYSA-N 282.647 1.024 5 50 CDBA O=C(O)/C=C/C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4892957 JKDKGEBQSCKPJN-ONEGZZNKSA-N 270.628 1.828 5 50 CDBA Cc1ccnc(NC[C@H](O)c2cnc[nH]2)c1[N+](=O)[O-] 952883488 TZUFKHQTMYPFHJ-VIFPVBQESA-N 263.257 1.167 5 50 CDBA CCNC(=O)CNC(=O)c1cc(C)c(Cl)c([N+](=O)[O-])c1 1775989103 DCGPHOBKPWZSTA-UHFFFAOYSA-N 299.714 1.423 5 50 CDBA C[C@@H](C(=O)NCc1ccco1)n1cc([N+](=O)[O-])cn1 1424774 JZJBDEVURRMFIO-QMMMGPOBSA-N 264.241 1.262 5 50 CDBA CCOC(=O)c1cc(NCCO)c(F)cc1[N+](=O)[O-] 725261776 HHWIFSMFIVGMEG-UHFFFAOYSA-N 272.232 1.315 5 50 CDBA Cc1ccnc(N2CC[C@H](c3ncon3)C2)c1[N+](=O)[O-] 952880364 ALYHXMXGMAFVPM-VIFPVBQESA-N 275.268 1.675 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2cc3c(cc2Cl)OCO3)N1 89568 ISQNUCJEUYXRGA-UFBFGSQYSA-N 298.682 1.665 5 50 CDBA O=[N+]([O-])c1c[n+]([O-])n(-c2cccc(C(F)(F)F)c2)n1 2876082 OIAWBKFCTBNTLI-UHFFFAOYSA-N 274.158 1.433 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1C(=O)NOCC(C)(C)O 253432121 WNTMPJZWXHDOKI-UHFFFAOYSA-N 268.269 1.336 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@@H]1C1CC1 408230790 IWKICYDYFLAEGP-NSHDSACASA-N 278.312 1.589 5 50 CDBA Cc1ccnc(N2CC[C@H](n3ccnn3)C2)c1[N+](=O)[O-] 585092476 ZEXUUYLNFDNXPU-JTQLQIEISA-N 274.284 1.341 5 50 CDBA COC(=O)/C(=C/c1cc([N+](=O)[O-])ccc1Cl)NC(C)=O 169620372 QNBSXQPQXCHMEQ-WDZFZDKYSA-N 298.682 1.898 5 50 CDBA Cc1ccccc1/C=C/c1nc(O)[nH]c(=O)c1[N+](=O)[O-] 15009214 QQAIMOQCZAPEJO-VOTSOKGWSA-N 273.248 1.863 5 50 CDBA Cc1ccc(OCCCCNCCO)c([N+](=O)[O-])c1 3000710 RHPHOOLRWLENBB-UHFFFAOYSA-N 268.313 1.644 5 50 CDBA C[C@H](O)CNCCNc1c(Cl)cccc1[N+](=O)[O-] 4156887 RWYKAWYSJIOERS-QMMMGPOBSA-N 273.720 1.631 5 50 CDBA Nc1nnc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])o1 240707737 HQGZURMQKQKPQC-UHFFFAOYSA-N 280.200 1.080 5 50 CDBA Cn1nc(O)c2c1CN(Cc1ccc([N+](=O)[O-])cc1)CC2 585133225 BGEKAEWYCXFESJ-UHFFFAOYSA-N 288.307 1.592 5 50 CDBA CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 19404404 CPWZLBPJLKSCCN-UHFFFAOYSA-N 283.715 1.636 5 50 CDBA CCN(CC)S(=O)(=O)c1cccc([N+](=O)[O-])c1 4369366 HOGKOBQIINJDJM-UHFFFAOYSA-N 258.299 1.625 5 50 CDBA O=[N+]([O-])c1ccc([C@H](O)[C@@H](CO)N2CCCCC2)cc1 96027511 PJWKHFUUONPSEU-KGLIPLIRSA-N 280.324 1.475 5 50 CDBA Cc1ccc2c(Cn3cnc([N+](=O)[O-])n3)ccc(O)c2n1 225429549 PVOCKLRTNPBUQY-UHFFFAOYSA-N 285.263 1.797 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)NCc1ccccc1 371827 GAACHUDXWMCHMU-UHFFFAOYSA-N 260.253 1.108 5 50 CDBA CCOC(=O)c1nnn(-c2ccc([N+](=O)[O-])cc2)c1C 87652 MWCUXTSZLSCUIV-UHFFFAOYSA-N 276.252 1.661 5 50 CDBA CCn1ncc([N+](=O)[O-])c1C(=O)NC1CCCCC1 800684 YBZXYZDBBRNVPS-UHFFFAOYSA-N 266.301 1.874 5 50 CDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccccc1[N+](=O)[O-] 239174000 PBVHTBPFNZTURL-RBJBARPLSA-N 284.271 1.906 5 50 CDBA O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 407999927 WOSTXSXFKBYHFD-LGIWVTCOSA-N 290.319 1.502 5 50 CDBA Nc1cc(CC(=O)NC[C@@H]2CCCO2)ccc1[N+](=O)[O-] 408515234 MEHXFUDFVDRJNP-JTQLQIEISA-N 279.296 1.015 5 50 CDBA O=C1C=CC[C@H]2[C@@H]3CCC[N@@+]4([O-])CCC[C@H](CN12)[C@H]34 255261145 QMGGMESMCJCABO-KTHACSRUSA-N 262.353 1.660 5 50 CDBA O=C1CCC(=O)N1c1ccc(Cl)c([N+](=O)[O-])c1 2571689 RHPYGFLAYVWEKI-UHFFFAOYSA-N 254.629 1.902 5 50 CDBA Cc1c(Cl)cccc1NC(=O)Cn1cnc([N+](=O)[O-])n1 2918832 UHSBLAXSIHWVHJ-UHFFFAOYSA-N 295.686 1.787 5 50 CDBA CN1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 4868846 MZWDLVGMOCMFGR-UHFFFAOYSA-N 265.313 1.221 5 50 CDBA CN1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 55075582 YTGIZLGBCMZERO-QPJJXVBHSA-N 275.308 1.382 5 50 CDBA Cc1cc(=O)n2c(=O)c3ccccc3[nH]c2c1C#N 169240749 LZPSCFKWYOPTAC-UHFFFAOYSA-N 251.245 1.321 5 50 CDBA O=[N+]([O-])c1cccnc1NCCN=S1(=O)CCCC1 585092393 UNCBKYCMWPVRIT-UHFFFAOYSA-N 284.341 1.664 5 50 CDBA O=[N+]([O-])c1ccccc1-n1nc2ccc3nonc3c2n1 439716 RVRKGSNQWADFMP-UHFFFAOYSA-N 282.219 1.865 5 50 CDBA O=C(O)c1c(N2CCNCC2)ccc([N+](=O)[O-])c1Cl 536955722 ZCVZPZCDGQMTLL-UHFFFAOYSA-N 285.687 1.356 5 50 CDBA COc1c(C(=O)O)cc([N+](=O)[O-])c(Cl)c1[N+](=O)[O-] 616568058 CDUXIFUXXYHOFW-UHFFFAOYSA-N 276.588 1.863 5 50 CDBA O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCCC1 123888 WOKWRYTUBLKUIA-UHFFFAOYSA-N 264.281 1.986 5 50 CDBA Cc1cc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)no1 457572 HXCPGRRATPLKDL-UHFFFAOYSA-N 273.204 1.692 5 50 CDBA O=[N+]([O-])c1cc(Br)[n+]([O-])cc1Br 2023576 WBVMRZUZKQBXGD-UHFFFAOYSA-N 297.890 1.753 5 50 CDBA CC[C@H](COC)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 119025314 VTZMZZVGJNTEPR-SECBINFHSA-N 268.269 1.455 5 50 CDBA CN(C)[C@H]1COC(=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1 217041275 JVHRFDUBKQWSDL-WDEREUQCSA-N 266.253 1.733 5 50 CDBA C[C@]1(C(N)=O)CCCCN1Cc1cccc([N+](=O)[O-])c1 185894750 DYJRIJUUJPBEQU-CQSZACIVSA-N 277.324 1.825 5 50 CDBA Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 17004263 GKTKCGAOXFHFTD-UHFFFAOYSA-N 285.306 1.466 5 50 CDBA in-vitro COC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 3894108 HPZLCXOOZSLFPW-UHFFFAOYSA-N 266.253 1.218 5 50 CDBA O=[N+]([O-])c1cc(I)c2nccn2c1 95836410 LVOLPEBGFGQBIE-UHFFFAOYSA-N 289.032 1.847 5 50 CDBA O=[N+]([O-])c1cc(F)cc(CO)c1Br 259431649 RIXUPXLYMCWLTF-UHFFFAOYSA-N 250.023 1.989 5 50 CDBA Cc1cc/c(=N/S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[nH]c1 183993 GSASPEJNWFVWQK-UHFFFAOYSA-N 293.304 1.521 5 50 CDBA O=C1NN(c2ccc([N+](=O)[O-])cc2)C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@@H]12 169684983 KSKYUERSKUVUJX-NGERZBJRSA-N 299.286 1.411 5 50 CDBA C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1CCOC1 170005551 WBWSDNIYWQGRFV-WPRPVWTQSA-N 280.280 1.455 5 50 CDBA C[C@H]1CCC(C)(C)N1C(=O)Cn1cc([N+](=O)[O-])cn1 408520306 LGUJCEUTLPTYBI-VIFPVBQESA-N 266.301 1.581 5 50 CDBA COc1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 16675646 SVUWWFRUKSMTMN-AOOOYVTPSA-N 294.307 1.853 5 50 CDBA CCOC(=O)C(Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC 1600209 DDENYKBUELXLAQ-UHFFFAOYSA-N 295.291 1.880 5 50 CDBA O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)n1ccnc1 2890736 KQZBTQJXJLFYGN-UHFFFAOYSA-N 285.215 1.586 5 50 CDBA O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 21508381 XNMYLMZWZVVLTE-JTQLQIEISA-N 279.252 1.676 5 50 CDBA N[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)C1CC1 236297180 URQYODJTKSOZCP-VIFPVBQESA-N 256.693 1.792 5 50 CDBA CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@@H]1CCCO1 152533810 XTIQBODKKHSVEP-PWSUYJOCSA-N 294.307 1.988 5 50 CDBA C[Si](C)(C)CCOC(=O)n1cnc([N+](=O)[O-])n1 197210193 BHTJYIDOVYPNKR-UHFFFAOYSA-N 258.310 1.509 5 50 CDBA in-vitro Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)C[S@@](C)=O 162478942 ZKTNFKCDIVVVTL-LXGOIASLSA-N 299.352 1.792 5 50 CDBA O=[N+]([O-])c1cc(CN2CCSCC2)ccc1O 213794 BIXRCGUZVASSAG-UHFFFAOYSA-N 254.311 1.849 5 50 CDBA COCCOC(=O)CC(=O)c1ccc([N+](=O)[O-])cc1 2164959 JXIQXWIUZSSGAS-UHFFFAOYSA-N 267.237 1.357 5 50 CDBA O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@H]2C[C@H]2C1 585124052 SZISOHKFNBJURH-AOOOYVTPSA-N 261.281 1.485 5 50 CDBA CC[N+](C)(CC)C[C@H]1CO[C@@H](C[N+](C)(CC)CC)CO1 225652 FROPDBPURWDMRD-HOTGVXAUSA-N 288.476 1.743 5 50 CDBA Cc1ccc(NC(=O)c2cnccn2)c([N+](=O)[O-])c1 3898128 WIEXDIBMLMNRBX-UHFFFAOYSA-N 258.237 1.946 5 50 CDBA CN(C)CCN(C)Cc1ccc(O)c([N+](=O)[O-])c1 4986174 ALEQYSMVRPJRLF-UHFFFAOYSA-N 253.302 1.294 5 50 CDBA Cc1ccc(NC(=O)NCCCC(=O)O)c([N+](=O)[O-])c1 1775971207 PGBAYKFJRHKBRG-UHFFFAOYSA-N 281.268 1.890 5 50 CDBA CC(=O)N1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 19633163 SVWPSEYYTWCYKL-UHFFFAOYSA-N 297.742 1.912 5 50 CDBA Cc1cncc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)c1 170599357 VGNWGZKQICYARA-UHFFFAOYSA-N 287.275 1.934 5 50 CDBA O=C(O)CC1=NN(c2cccc([N+](=O)[O-])c2)C(=O)C1 19228624 WIHOQKASMGMBJC-UHFFFAOYSA-N 263.209 1.162 5 50 CDBA CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 19606666 ZPZXZRXLVFNFIR-UHFFFAOYSA-N 283.715 1.636 5 50 CDBA Cc1cccnc1NC(=O)Cn1nc([N+](=O)[O-])cc1C 1068908 VUEKFOYWKADNSY-UHFFFAOYSA-N 275.268 1.442 5 50 CDBA CC1=NCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1 20109879 NZWGDGTUBZQGCY-UHFFFAOYSA-N 269.282 1.018 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]([C@H]2CCOC2)C1 408426510 UMRJEIOLAUHUNK-ZJUUUORDSA-N 266.301 1.191 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)n1ccnc1 51872 MCLKNNKGKAKBNG-UHFFFAOYSA-N 267.266 1.337 5 50 CDBA CCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1nnn[nH]1 136624138 MATWCGSBOJEBMG-ZCFIWIBFSA-N 296.312 1.441 5 50 CDBA C[C@@H]1CCCN([C@]2(O)C(=O)Nc3ccc([N+](=O)[O-])cc32)C1 239038538 DJSFIGARWKRMBO-YMTOWFKASA-N 291.307 1.424 5 50 CDBA Cc1cnc(N2CCc3c(O)n[nH]c3C2)c([N+](=O)[O-])c1 585136664 OTJVOWUCMBDFCB-UHFFFAOYSA-N 275.268 1.290 5 50 CDBA Cc1nc2nnc3c(=O)oc4ccccc4c3n2n1 1848442869 MLEGUJZOMXPDOB-UHFFFAOYSA-N 253.221 1.087 5 50 CDBA N=C1NC(=O)[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S1 18137554 VJSSGAAKNJWHBT-QMMMGPOBSA-N 294.292 1.090 5 50 CDBA CC1(C)CO[C@H](c2ccc([N+](=O)[O-])cc2)NC1=O 253478038 IWLGIVWLJIQLTQ-SNVBAGLBSA-N 250.254 1.766 5 50 CDBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)O1 2819786 HHMVWMCEDGWZPS-HTQZYQBOSA-N 254.242 1.437 5 50 CDBA Cc1cc([N+](=O)[O-])cc2c1NC(=O)C21OCCO1 4110681 IOHLEXKNRQQQQK-UHFFFAOYSA-N 250.210 1.055 5 50 CDBA C[C@@H]1CC(=O)NN=C1c1ccc(N(C)C)c([N+](=O)[O-])c1 4178764 FBZBPTAIJMWJJO-MRVPVSSYSA-N 276.296 1.521 5 50 CDBA O=[N+]([O-])c1c(N2CCN3CCC[C@H]3C2)nc2ccccn12 247309103 HZIKEQWYTKADBL-NSHDSACASA-N 287.323 1.527 5 50 CDBA CC(=O)NC[C@@H]1CN(c2cccc(C)c2[N+](=O)[O-])CCO1 170602859 IHWXKZKOHCUZKX-GFCCVEGCSA-N 293.323 1.245 5 50 CDBA CCOC(=O)C(=Cc1ccc([N+](=O)[O-])o1)C(=O)OCC 2187392 HZCMOCLXXIOKRG-UHFFFAOYSA-N 283.236 1.697 5 50 CDBA O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCCC1 1604732 KWCQSDOXGBBUPE-UHFFFAOYSA-N 265.225 1.739 5 50 CDBA C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 366264314 DIUFJAYKTWCHIX-IUODEOHRSA-N 292.335 1.975 5 50 CDBA COc1ccc(NC(=O)/C=C\C(=O)O)c([N+](=O)[O-])c1 30831098 ZKDLZLOZDAKBIO-PLNGDYQASA-N 266.209 1.183 5 50 CDBA CNc1c([N+](=O)[O-])cnc2c1c(=N)nc1ccccn12 5073549 WGSIQQYDYGTEAY-UHFFFAOYSA-N 270.252 1.312 5 50 CDBA CC(=O)c1ccc(NC2CN(C(C)=O)C2)c([N+](=O)[O-])c1 408523854 NZADZSRJPFNQTL-UHFFFAOYSA-N 277.280 1.440 5 50 CDBA CCCCCNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 5060540 CPTCHVDNRUQKDL-UHFFFAOYSA-N 279.296 1.840 5 50 CDBA O=[N+]([O-])c1cc(Cl)ccc1NCCNCCO 4599020 JJNARJRYRLCABJ-UHFFFAOYSA-N 259.693 1.242 5 50 CDBA O=C(O)[C@@H]1CS[C@H](c2ccc([N+](=O)[O-])s2)N1 99238 WNEKIYRMXWCTGY-MHTLYPKNSA-N 260.296 1.445 5 50 CDBA Nc1cc(O)c([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCCO1 170597848 OIFLOLHJUYMZTP-QMMMGPOBSA-N 295.295 1.182 5 50 CDBA CCN1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1 54992638 PKFLBUOTMDPGEA-VOTSOKGWSA-N 289.335 1.772 5 50 CDBA Cn1nnnc1Sc1ccc([N+](=O)[O-])c2cccnc12 220134670 YLNJRGFQMVWVDO-UHFFFAOYSA-N 288.292 1.818 5 50 CDBA NC(=O)[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 55292037 QQDZWCIDUGRUIJ-NSHDSACASA-N 263.297 1.292 5 50 CDBA O=C1CC(N2CCCC2)=NN1c1ccc([N+](=O)[O-])cc1 4014821 GMXRVALYFNKUTQ-UHFFFAOYSA-N 274.280 1.741 5 50 CDBA NC(=O)C1=NO[C@@H](CNc2ccc(Cl)cc2[N+](=O)[O-])C1 276637730 XFAGNAPMYIZYJJ-SSDOTTSWSA-N 298.686 1.290 5 50 CDBA COCCn1cc(-c2cnc(C)c([N+](=O)[O-])c2)cn1 596645881 OKCZOWWYLDAMHS-UHFFFAOYSA-N 262.269 1.808 5 50 CDBA CS(=O)(=O)Nc1cccc(Br)c1[N+](=O)[O-] 1772572483 USUQXKDYDOPQRP-UHFFFAOYSA-N 295.114 1.729 5 50 CDBA O=[N+]([O-])c1ccccc1N1CCC[C@@H](CO)[C@H]1CO 709858366 DLDATPPHMUAXRE-GXFFZTMASA-N 266.297 1.164 5 50 CDBA O=[N+]([O-])c1ccc(N2CCCCC2)cc1NCCO 4003289 CVINEFNKSWMWMP-UHFFFAOYSA-N 265.313 1.989 5 50 CDBA CCNc1ccc(S(=O)(=O)NCC)cc1[N+](=O)[O-] 5194807 WPRCPDDNBSVKDA-UHFFFAOYSA-N 273.314 1.325 5 50 CDBA CC[C@H](C)[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1 4899770 NCCAUSZFESISCS-KWQFWETISA-N 251.286 1.907 5 50 CDBA in-vitro COCc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1 476935 MOHWQCUYVRPUPC-UHFFFAOYSA-N 294.292 1.845 5 50 CDBA COC(=O)C(C(=O)OC)c1c([N+](=O)[O-])ccc(F)c1F 95494747 YABKWQZPQCSBNX-UHFFFAOYSA-N 289.190 1.303 5 50 CDBA COc1cc(CN2CCC[C@H](O)C2)c([N+](=O)[O-])cc1OC 16310493 YAIJYIGMLNESNY-NSHDSACASA-N 296.323 1.569 5 50 CDBA O=C(C[C@H]1SC(=O)NC1=O)Nc1ccc([N+](=O)[O-])cc1 4151754 SYLMFFPTCCRYRW-MRVPVSSYSA-N 295.276 1.275 5 50 CDBA Cc1c([N+](=O)[O-])cc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-] 4558200 LBAJJURTSAUERA-UHFFFAOYSA-N 289.269 1.062 5 50 CDBA O=C(O)c1cc(Br)c(O)c([N+](=O)[O-])c1 85224939 MSUNRULZELFVQE-UHFFFAOYSA-N 262.015 1.761 5 50 CDBA in-vitro Cc1cc(N2CCc3nn(C)c(N)c3C2)ccc1[N+](=O)[O-] 1615552547 WCQORTYVKLJLHG-UHFFFAOYSA-N 287.323 1.782 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3nnn[nH]3)C2)c1 161009021 VFABJXIHORRKJP-SNVBAGLBSA-N 288.311 1.800 5 50 CDBA COc1ccc2c([N+](=O)[O-])c(N3CCOCC3)[nH]c2c1 4352525 SIPSCPIIEXUWEC-UHFFFAOYSA-N 277.280 1.921 5 50 CDBA CC1(C)COC(=O)[C@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 34385707 MKJHFKPUKIGUQC-SNVBAGLBSA-N 279.248 1.703 5 50 CDBA C[C@@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC(C)(C)O1 160129610 FLBLLDILGWCYMU-SECBINFHSA-N 294.307 1.940 5 50 CDBA CN(Cc1ccc(O)cc1)c1ccc2ncc([N+](=O)[O-])n2n1 170088087 PCDQDRINBXFQRA-UHFFFAOYSA-N 299.290 1.980 5 50 CDBA C/C=C/C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3880226 ALNSWDRXQPQJGB-NSCUHMNNSA-N 275.308 1.820 5 50 CDBA CCC[C@@H](N)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 124893514 YPTJWENIOWLSKT-SECBINFHSA-N 287.341 1.001 5 50 CDBA CNC(=O)CSc1ncc(Cl)cc1[N+](=O)[O-] 281679892 MGLNIAFZWARJIO-UHFFFAOYSA-N 261.690 1.481 5 50 CDBA O=[N+]([O-])c1ccccc1CN1CCN(c2ncccn2)CC1 19537024 QXHQZPDDDQUEJH-UHFFFAOYSA-N 299.334 1.707 5 50 CDBA CN(C)Cc1ccc(OC(=O)N(C)C)c([N+](=O)[O-])c1 187897 UKFQFXXEDHLNRJ-UHFFFAOYSA-N 267.285 1.717 5 50 CDBA Nc1c(Br)cc(C(=O)O)cc1[N+](=O)[O-] 74937729 JCSIZMVUEBODFZ-UHFFFAOYSA-N 261.031 1.638 5 50 CDBA in-vitro Cc1nn([C@H](C)C(=O)N2CCCCC2)c(C)c1[N+](=O)[O-] 1068591 CWESNDCEBMDVQG-LLVKDONJSA-N 280.328 1.982 5 50 CDBA Cc1cnc(NCc2nc(CO)cs2)c([N+](=O)[O-])c1 225713101 KOLZHUGCALTFBW-UHFFFAOYSA-N 280.309 1.859 5 50 CDBA COC[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 113435624 DETKWRJPNPQDRP-SNVBAGLBSA-N 294.307 1.799 5 50 CDBA C[C@H]1OC[C@H]2[C@H](CO1)ON(C)[C@H]2c1ccc([N+](=O)[O-])cc1 247996986 DJCIBOAHTWGRGS-HBEIAFGSSA-N 294.307 1.891 5 50 CDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC2(CCC2)C1 119437019 XKTPSDDMPHUDHR-UHFFFAOYSA-N 292.291 1.696 5 50 CDBA C[C@H](CCCO)N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 239782576 CPKDXGJMVXIOES-NXEZZACHSA-N 267.329 1.989 5 50 CDBA O=C(O)CCC(=O)NCc1cccc([N+](=O)[O-])c1 12404746 VLNBCFNZFJFZFM-UHFFFAOYSA-N 252.226 1.076 5 50 CDBA CC(=O)Nc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])cc1 4117091 PROXTNAOTPKFFY-UHFFFAOYSA-N 288.267 1.669 5 50 CDBA CCn1c(=O)c([N+](=O)[O-])c(NCCOC)c2ccccc21 4264101 DWWNZSMRQGISPE-UHFFFAOYSA-N 291.307 1.988 5 50 CDBA NC(=O)[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 55292078 QHVKVJIMPMTVOI-LLVKDONJSA-N 263.297 1.292 5 50 CDBA Cc1ncc(I)cc1[N+](=O)[O-] 35570471 QLXUGOYUTFGIFY-UHFFFAOYSA-N 264.022 1.903 5 50 CDBA O=C(N[C@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 3085977 OHNCQODQPDYKMG-RYUDHWBXSA-N 264.281 1.628 5 50 CDBA CN(CCC(=O)O)Cc1cc(O)ccc1[N+](=O)[O-] 593288837 PGRXHONDUUWHCD-UHFFFAOYSA-N 254.242 1.207 5 50 CDBA Cn1ccnc1SCC(=O)Nc1ncc([N+](=O)[O-])s1 5062236 PCXQYQBVDNCXSH-UHFFFAOYSA-N 299.337 1.516 5 50 CDBA C[C@H](O)C[C@H]1COCCN1c1ccccc1[N+](=O)[O-] 130037579 YRNJSECPAHPKBI-QWRGUYRKSA-N 266.297 1.571 5 50 CDBA Nn1cnn(Cc2ccc([N+](=O)[O-])cc2)c1=S 33603 DCLUXEMUZYQZQE-UHFFFAOYSA-N 251.271 1.084 5 50 CDBA Nc1nnc(CNc2ncc(Cl)cc2[N+](=O)[O-])o1 253431051 STLKMVWXCDJWTC-UHFFFAOYSA-N 270.636 1.221 5 50 CDBA CON(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 218115549 KGXGWVIKULLBRL-WDEREUQCSA-N 250.254 1.718 5 50 CDBA CC(C)CC(=O)OCOc1cccnc1[N+](=O)[O-] 585119046 NUXLYRJOMGRUDU-UHFFFAOYSA-N 254.242 1.915 5 50 CDBA COc1ccc(C(=O)NCc2ccncc2)cc1[N+](=O)[O-] 288048 NEMGNNYADPNHDC-UHFFFAOYSA-N 287.275 1.928 5 50 CDBA COc1cc(CSC(=N)N)c([N+](=O)[O-])cc1OC 4543517 IWLYVQXXOSWGCJ-UHFFFAOYSA-N 271.298 1.739 5 50 CDBA CCCN(C(=O)Cn1cnnn1)c1cccc([N+](=O)[O-])c1 194122972 KNCVBPIQHYMVOD-UHFFFAOYSA-N 290.283 1.025 5 50 CDBA Cc1ccnc(NCCNc2ncccn2)c1[N+](=O)[O-] 584906924 LWYZGMXQRFZUOY-UHFFFAOYSA-N 274.284 1.612 5 50 CDBA CCCCS(=O)(=O)Oc1ccc(N)c([N+](=O)[O-])c1 5159035 ZDQRJSJDPIQWDX-UHFFFAOYSA-N 274.298 1.686 5 50 CDBA O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cccc2ccccc12 312552 OBOGIKSAGOBCSI-UHFFFAOYSA-N 297.274 1.978 5 50 CDBA Cc1cc([N+](=O)[O-])c(N2CCN(C)CC2)cc1N 4104320 HIAMVFVLQSGMHZ-UHFFFAOYSA-N 250.302 1.237 5 50 CDBA CCN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C 4701826 SAHXJTYMSFFSAD-UHFFFAOYSA-N 272.326 1.934 5 50 CDBA O=C(COc1ccc([N+](=O)[O-])cc1)NCc1cccnc1 452589 POHPXLUXQMWXRB-UHFFFAOYSA-N 287.275 1.685 5 50 CDBA CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 37247247 YWNKGZWXPKMDTH-UHFFFAOYSA-N 259.059 1.717 5 50 CDBA in-vitro C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 366264318 DIUFJAYKTWCHIX-WFASDCNBSA-N 292.335 1.975 5 50 CDBA C[N+](C)(C)CCn1nc(-c2ccccc2)ccc1=O 95918180 LSRKECFKQWRICW-UHFFFAOYSA-N 258.345 1.617 5 50 CDBA CCOC(=O)c1ccc(-n2cccn2)cc1[N+](=O)[O-] 90470748 GLXZTAMHMOVJEM-UHFFFAOYSA-N 261.237 1.957 5 50 CDBA in-vitro O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)c(F)c1 408463052 AZMHICIIVWCVIT-PVKJVXODSA-N 279.271 1.334 5 50 CDBA CN(C)c1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])nc1 170617940 WZVOQWAPYCTBSK-UHFFFAOYSA-N 276.256 1.031 5 50 CDBA O=[N+]([O-])C[C@@H](O)c1c(F)c(F)c(F)c(F)c1F 5380689 JATSBNOGFCYNOT-UWTATZPHSA-N 257.114 1.692 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1cccnc1 356171 HQKVGHDSCGTCKW-UHFFFAOYSA-N 269.216 1.790 5 50 CDBA CS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1F 97756688 CVLVOGWQQDPYGE-UHFFFAOYSA-N 253.638 1.791 5 50 CDBA COc1ccccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1427942 IKEQJKLYEPDXRI-UHFFFAOYSA-N 276.252 1.439 5 50 CDBA CCn1cc([N+](=O)[O-])c(C(=O)N2CCCCCC2)n1 371679 JFKFRTBHXPYXHA-UHFFFAOYSA-N 266.301 1.827 5 50 CDBA Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(N3CCCCC3)cc21 4003454 HEIHBTGMQBQOHX-UHFFFAOYSA-N 290.323 1.776 5 50 CDBA CC[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@@H]1CCCO1 119371749 HYCGMXIDGBSXIK-MFKMUULPSA-N 294.307 1.988 5 50 CDBA CC(=O)OC(OC(C)=O)c1ccc([N+](=O)[O-])cc1 122416 WGESNIARHZFDHQ-UHFFFAOYSA-N 253.210 1.720 5 50 CDBA in-vitro CC(CO)(CO)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4045608 RACUXTNSZMBMPM-UHFFFAOYSA-N 294.229 1.769 5 50 CDBA CO[C@H]1CCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1O 160573548 PQMFYKCBFMUTTC-ONGXEEELSA-N 280.280 1.598 5 50 CDBA C[S@@](=O)CCCNc1cc(F)ccc1[N+](=O)[O-] 229295297 OYPXLDNGKRRMTJ-QGZVFWFLSA-N 260.290 1.914 5 50 CDBA Cc1ccnc(NC[C@H]2CCC(=O)O2)c1[N+](=O)[O-] 585092920 UJELESTWNLUKCE-MRVPVSSYSA-N 251.242 1.416 5 50 CDBA CN1CCN(c2cc(N)c([N+](=O)[O-])cc2F)CC1 5065172 IQGRLFTWIPYMON-UHFFFAOYSA-N 254.265 1.068 5 50 CDBA CCOC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 12413593 IZHXXTQPSBEDRL-UHFFFAOYSA-N 254.198 1.892 5 50 CDBA Cc1cc(N2CC(NC3CCOCC3)C2)ncc1[N+](=O)[O-] 952994997 ZSAYDLFCHLDHPN-UHFFFAOYSA-N 292.339 1.255 5 50 CDBA COC(=O)CSc1ccc(C(=O)OC)cc1[N+](=O)[O-] 167437 LSIHUAFAGCYMQM-UHFFFAOYSA-N 285.277 1.647 5 50 CDBA O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccncc1 184068 XCEZZGKIVCCCAU-UHFFFAOYSA-N 271.276 1.849 5 50 CDBA C[C@@H]1OC[C@@H]2ON(C)[C@H](c3ccc([N+](=O)[O-])cc3)[C@@H]2CO1 230051887 DJCIBOAHTWGRGS-GSVCSZOMSA-N 294.307 1.891 5 50 CDBA CC(=O)c1c(C)n(O)c2cc([N+](=O)[O-])ccc2[n+]1=O 135925913 IBMSRVMXTXSLIT-UHFFFAOYSA-N 264.217 1.212 5 50 CDBA Cn1cncc1[C@@H](CO)Nc1ccc(F)cc1[N+](=O)[O-] 952963375 HZBFDUWQXFQDOM-SNVBAGLBSA-N 280.259 1.613 5 50 CDBA O=C(N[C@@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 3085978 OHNCQODQPDYKMG-NEPJUHHUSA-N 264.281 1.628 5 50 CDBA COC[C@@H]1CN(c2cccc(C)c2[N+](=O)[O-])CCO1 188384091 YPKXZTATQJPJEA-NSHDSACASA-N 266.297 1.755 5 50 CDBA COC(=O)c1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 103423 UVXBSXLPWBAFPP-PWSUYJOCSA-N 278.264 1.070 5 50 CDBA COC(=O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 95495943 XGOSQZCCMOJEEQ-QMMMGPOBSA-N 264.237 1.121 5 50 CDBA NS(=O)(=O)c1cc(Cl)c(Cl)c([N+](=O)[O-])c1 263623768 KOOAVALRHBNIIL-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA Cc1cc(N2CCC([C@H](F)C(N)=O)CC2)ccc1[N+](=O)[O-] 585132669 KLQNDLCKJCGJOO-ZDUSSCGKSA-N 295.314 1.943 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1N1CCOCC1 3877923 JHXWNZPLYVFBSY-UHFFFAOYSA-N 293.323 1.268 5 50 CDBA in-vitro CNC(=O)[C@@H]1CCCCN1c1ccc([N+](=O)[O-])cc1F 952992648 QRJLHKDKTNVVSX-LBPRGKRZSA-N 281.287 1.839 5 50 CDBA Cc1cc(C)n(C(=O)c2c([N+](=O)[O-])c(C)nn2C)n1 376121 VSBWMBVDBVSDIQ-UHFFFAOYSA-N 263.257 1.139 5 50 CDBA Cc1nn([C@H](C)C(=O)NC[C@@H]2CCCO2)c(C)c1[N+](=O)[O-] 1071182 ZBVIZKKEENXYKH-MNOVXSKESA-N 296.327 1.264 5 50 CDBA CCOC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(C)=O 3137024 DOLPBEHZXPSELP-WQLSENKSSA-N 278.264 1.635 5 50 CDBA CN1C=C(C(=O)NCCCC[N+](C)(C)C)C=C/C1=C\N=O 137176258 UQYQIAQAVIGJHM-SDNWHVSQSA-O 293.391 1.582 5 50 CDBA Cc1nn([C@H](C)C(=O)N[C@@H](C)[C@H]2CCCO2)cc1[N+](=O)[O-] 245226345 RXLIUSMZLKZTSX-HOSYDEDBSA-N 296.327 1.344 5 50 CDBA C[C@](CN)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CC1 133755070 OGLIBIKTAPZFKH-GFCCVEGCSA-N 299.352 1.001 5 50 CDBA CN1CCN(CCCOc2cccc([N+](=O)[O-])c2)CC1 4842713 HBGQDRDKPLOSOW-UHFFFAOYSA-N 279.340 1.611 5 50 CDBA CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 4989038 JGDZLXJNCQPGMT-GQCTYLIASA-N 261.325 1.855 5 50 CDBA O=[N+]([O-])c1cnc2[nH]nc(I)c2c1 95910938 WXGXNCHNODEFEM-UHFFFAOYSA-N 290.020 1.471 5 50 CDBA Nc1ncnc(NCCc2ccccc2)c1[N+](=O)[O-] 3912531 SIARGSJQSRUOFI-UHFFFAOYSA-N 259.269 1.622 5 50 CDBA O=[N+]([O-])c1ccccc1OCCN1CCOCC1 19638414 JWHLEBUFMSMLLB-UHFFFAOYSA-N 252.270 1.306 5 50 CDBA O=[N+]([O-])c1ccc2n[nH]cc2c1NC[C@H]1CCOC1 1775999169 OWJWFRWINYOVNH-MRVPVSSYSA-N 262.269 1.920 5 50 CDBA O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 407999925 WOSTXSXFKBYHFD-DOEPTHPASA-N 290.319 1.502 5 50 CDBA Cc1cc(N2CCN(C[C@@H](C)O)C[C@@H]2C)ncc1[N+](=O)[O-] 170601964 RRKMGSZRNLSUQH-NWDGAFQWSA-N 294.355 1.190 5 50 CDBA CCN(c1ncc([N+](=O)[O-])cn1)[C@H](C)C(=O)OC(C)(C)C 585098915 QAKGUNNHANDLNX-SECBINFHSA-N 296.327 1.941 5 50 CDBA O=c1[nH]c(/C=C\c2c[nH]c3ccccc23)c([N+](=O)[O-])c(=O)[nH]1 13616843 NNYBAUSTLGTEJW-WAYWQWQTSA-N 298.258 1.623 5 50 CDBA NC1(c2noc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 261842744 SDUDZXZWUNNAGM-UHFFFAOYSA-N 260.253 1.983 5 50 CDBA CC[C@@H](O)[C@@H]1CC(c2ccc([N+](=O)[O-])cc2)=NO1 4576758 MFUIMKPWEBKXMS-NEPJUHHUSA-N 250.254 1.859 5 50 CDBA CC(=O)N1[C@H](C[N+](=O)[O-])C[C@H](C)N1c1ccccc1 4603362 DCQAFYPIDRLVIK-GWCFXTLKSA-N 263.297 1.694 5 50 CDBA O=C(Cn1ccnc1[N+](=O)[O-])NCc1ccccc1 56949 CULUWZNBISUWAS-UHFFFAOYSA-N 260.253 1.108 5 50 CDBA biogenic,world CN1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 19733323 OYEGVKNQWXGFFZ-UHFFFAOYSA-N 283.715 1.636 5 50 CDBA COC(=O)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] 137207 YBOOBLNSFSZGGE-UHFFFAOYSA-N 255.226 1.328 5 50 CDBA CC(=O)c1cccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)c1 197142 YPMMTJVUXRNTJY-UHFFFAOYSA-N 289.251 1.028 5 50 CDBA C[C@H]1CC(NC(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@H](C)C1 286441576 LVCTYBZCDNAZPQ-HTQZYQBOSA-N 266.301 1.872 5 50 CDBA Cc1ccsc1/C=C\c1nc(O)c([N+](=O)[O-])c(=O)[nH]1 16361818 ZFBXTQNLVXVOPZ-IHWYPQMZSA-N 279.277 1.924 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)NC2CCCCC2)n1 6645744 FUVYDDCQFVJAOL-UHFFFAOYSA-N 252.274 1.391 5 50 CDBA COc1ccccc1[C@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 90844 XLHBDHDXTFIGJA-BXKDBHETSA-N 250.254 1.292 5 50 CDBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](C)(O)C1 276558 QCBVVHZUPZGHPN-GFCCVEGCSA-N 263.253 1.525 5 50 CDBA CO[C@H](C)CS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 472817 ISARYKZZXVDQHZ-SECBINFHSA-N 273.310 1.712 5 50 CDBA CCOC(=O)C[C@@H](NC(C)=O)c1ccc([N+](=O)[O-])cc1 1807006 YSMCYVXIUHWNHI-GFCCVEGCSA-N 280.280 1.725 5 50 CDBA Cc1c(NC(=O)NN2CCCCC2=O)cccc1[N+](=O)[O-] 585119673 PCSNTWLEIGVGTK-UHFFFAOYSA-N 292.295 1.952 5 50 CDBA C[C@H](O)CNCCNc1ccc(Cl)cc1[N+](=O)[O-] 4156876 SFBLWALWAIFDJS-QMMMGPOBSA-N 273.720 1.631 5 50 CDBA CC1=C[C@H](C)[C@@H]2C(=O)N(CCC[N+](C)(C)C)C(=O)[C@H]2C1 239306216 GOEBHGSAJXXUNJ-IHRRRGAJSA-N 279.404 1.670 5 50 CDBA CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1N(C)C 95494801 KRKNFTHOESSQQX-UHFFFAOYSA-N 258.299 1.454 5 50 CDBA CN1CC[C@@H]2CCN(c3ncccc3[N+](=O)[O-])[C@@H]2C1 272190781 MHOYBHZSEGEQHT-ZYHUDNBSSA-N 262.313 1.520 5 50 CDBA Cc1ccn(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)n1 615864 ITDFWYWLWUQLSX-UHFFFAOYSA-N 299.242 1.895 5 50 CDBA C[C@H](C(=O)O)N1Cc2ccc([N+](=O)[O-])cc2C1=O 809803 NYTKWHBITYKXRB-ZCFIWIBFSA-N 250.210 1.024 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCOCC1 189207988 STYNVUVSIQMFAE-SECBINFHSA-N 279.296 1.476 5 50 CDBA CCNc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 4675719 SOGCRXOXHLIOHX-UHFFFAOYSA-N 251.286 1.863 5 50 CDBA CN(C)CCNCCOCCOc1ccccc1[N+](=O)[O-] 5049744 IPBRSYRHEBMUJO-UHFFFAOYSA-N 297.355 1.141 5 50 CDBA Cc1[nH]c(=NCc2ncc(Cl)n2C)ccc1[N+](=O)[O-] 393326548 RBRZWSIZMWWWHX-UHFFFAOYSA-N 281.703 1.719 5 50 CDBA CCN1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 319141 IOQDNKIITJTZAZ-UHFFFAOYSA-N 277.324 1.681 5 50 CDBA CC[C@H](CO)Nc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 4081299 QRJVLGKRJMNHPD-LLVKDONJSA-N 295.339 1.614 5 50 CDBA O=C1[C@H]2CCCN2C(=O)N1c1cccc([N+](=O)[O-])c1 36755988 MKMUCICMDIXLLS-SNVBAGLBSA-N 261.237 1.526 5 50 CDBA Cc1nn(C)cc1COC(=O)c1ccc([N+](=O)[O-])cc1 372727 JUHTWRYBSSNGOA-UHFFFAOYSA-N 275.264 1.994 5 50 CDBA CNc1cc(N2CCN(C(C)=O)CC2)ccc1[N+](=O)[O-] 4125008 FZPOLZJQESDBBK-UHFFFAOYSA-N 278.312 1.305 5 50 CDBA Cc1cc(N(C)CCn2cnnc2)ncc1[N+](=O)[O-] 952875943 IRTRMMZHXNQLSF-UHFFFAOYSA-N 262.273 1.026 5 50 CDBA O=C(Nc1ncc([N+](=O)[O-])s1)c1cccnc1 4155210 RLRMQIMUGGQZTF-UHFFFAOYSA-N 250.239 1.699 5 50 CDBA Cc1ccc(NC(=O)Cn2cnc([N+](=O)[O-])c2)cc1 373480 XIFSCNASJRDQGS-UHFFFAOYSA-N 260.253 1.738 5 50 CDBA O=C(NCc1ccccn1)c1ccc([N+](=O)[O-])cc1 145300 DWCCZVGNMVCAKX-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA Cn1cnc([N+](=O)[O-])c1-c1noc(C2CCOCC2)n1 225553191 TWCOHZMMVCPASD-UHFFFAOYSA-N 279.256 1.272 5 50 CDBA CCCCNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C 225815465 PUJXOPDTLDMICF-UHFFFAOYSA-N 278.312 1.997 5 50 CDBA COc1ccc([N+](=O)[O-])cc1CN1CCCC1=O 543940 AJGPOSFCRQRXJL-UHFFFAOYSA-N 250.254 1.726 5 50 CDBA Cc1ccnc(NCCC[C@H]2C=NNC2=O)c1[N+](=O)[O-] 521398654 WTRCQDFIUGRVQC-VIFPVBQESA-N 277.284 1.222 5 50 CDBA Nc1nc(Cl)c(I)cc1[N+](=O)[O-] 95935966 FQFSWKVTOZFBOZ-UHFFFAOYSA-N 299.455 1.830 5 50 CDBA Cn1ncnc1Sc1nc2ccc([N+](=O)[O-])cc2[nH]1 1458364456 OXKYTYNKLIELHV-UHFFFAOYSA-N 276.281 1.751 5 50 CDBA C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1O 170604764 XKNRRKQPKBVCKI-PELKAZGASA-N 279.296 1.020 5 50 CDBA CCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)OC 1615002050 ZKRRSQMLAPRECJ-UHFFFAOYSA-N 297.311 1.815 5 50 CDBA COc1ccc(C(=O)N[C@@H]2CCSC2=O)cc1[N+](=O)[O-] 183875 DHEXWFBYRTVCPT-MRVPVSSYSA-N 296.304 1.365 5 50 CDBA NC(=S)c1cc2cc([N+](=O)[O-])ccc2oc1=O 439511 YNAZGVCXXNMBEK-UHFFFAOYSA-N 250.235 1.335 5 50 CDBA CN(C[C@@H]1CCCOC1)c1ccnc(F)c1[N+](=O)[O-] 585118395 MUOZVQBEZSCTPG-VIFPVBQESA-N 269.276 1.992 5 50 CDBA COC(=O)CCC(=O)Nc1cccc([N+](=O)[O-])c1 125250 SFPYPXJSMQYUIW-UHFFFAOYSA-N 252.226 1.487 5 50 CDBA Cc1cc(OCC(=O)N2CCOCC2)ccc1[N+](=O)[O-] 1053972 ZAARDLPEIQPJSY-UHFFFAOYSA-N 280.280 1.141 5 50 CDBA O=c1c([N+](=O)[O-])cc(Br)cn1Cn1cccn1 253425470 CSAFEDNDDULJAS-UHFFFAOYSA-N 299.084 1.221 5 50 CDBA NC1(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])CCCC1 595120161 PCUVAPRGVRYJQP-UHFFFAOYSA-N 299.352 1.145 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)CSCCO 5013985 XEPUDLDVRQDHPN-UHFFFAOYSA-N 270.310 1.567 5 50 CDBA O=[N+]([O-])c1ccccc1OCCCCN1CCNCC1 2838863 KIGAIXZCZPQBPD-UHFFFAOYSA-N 279.340 1.659 5 50 CDBA O=C(NCc1ccc(O)nc1)c1ccccc1[N+](=O)[O-] 118695523 LCKIXYIQZXDHBW-UHFFFAOYSA-N 273.248 1.625 5 50 CDBA CNC(=O)CSc1nc2sccn2c1[N+](=O)[O-] 1399960 INEYFCTXQUZBLA-UHFFFAOYSA-N 272.311 1.142 5 50 CDBA COC[C@H]1CN(c2cccc(C)c2[N+](=O)[O-])CCO1 188384117 YPKXZTATQJPJEA-LLVKDONJSA-N 266.297 1.755 5 50 CDBA Cc1cc[nH]c(=NCCCOc2ncccn2)c1[N+](=O)[O-] 585092287 NDJMKJOQIUEZEL-UHFFFAOYSA-N 289.295 1.391 5 50 CDBA CC(=O)c1cc(Cn2cnc([N+](=O)[O-])n2)cs1 12380062 GNFQTVMRGNWZIY-UHFFFAOYSA-N 252.255 1.499 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1cccs1 4743062 YLHNFSSVBUDVME-UHFFFAOYSA-N 266.282 1.169 5 50 CDBA CCOC(=O)CSCC(=O)Nc1cccc([N+](=O)[O-])c1 2506192 XERMWOWVBLBETL-UHFFFAOYSA-N 298.320 1.830 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)n2cc(Cl)cn2)cc1 371086 CUQBALGBFNCTGR-UHFFFAOYSA-N 287.684 1.682 5 50 CDBA COc1ccc([C@H]2N[C@H]2C(=O)OC(C)(C)C)cc1[N+](=O)[O-] 95830031 PPPFTYSVHDNEKF-VXGBXAGGSA-N 294.307 1.958 5 50 CDBA C[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)C[C@H](C2CC2)O1 408524591 VZRYRDJTRBUUJD-LDYMZIIASA-N 278.312 1.576 5 50 CDBA Cc1nc(N[C@@H]2CC[C@@H](CN)C2)ncc1[N+](=O)[O-] 420273250 LVRZGFFNYGUQIG-RKDXNWHRSA-N 251.290 1.233 5 50 CDBA C[C@@]1(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CCCO1 166119324 FMRWWWRRKMXOFA-LBPRGKRZSA-N 266.253 1.808 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCC[C@H](CO)C2)cc1 4948013 JZEBGNLIZMRNAU-LBPRGKRZSA-N 250.298 1.799 5 50 CDBA COC(=O)c1ccccc1CCn1cc([N+](=O)[O-])cn1 185409111 ZLTUBLCHCJKAFL-UHFFFAOYSA-N 275.264 1.821 5 50 CDBA CC1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)COC1 112728454 NPCVXZMIMCKJHA-UHFFFAOYSA-N 266.253 1.067 5 50 CDBA CC1(C2(NC(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1 408520405 CGJSSKVKPQTUKY-UHFFFAOYSA-N 264.285 1.240 5 50 CDBA CO[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1OC 170612147 BHKUYZWWUFJVCM-STQMWFEESA-N 294.307 1.010 5 50 CDBA Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)O)c1 368975 IDBOQHVHOATSKD-UHFFFAOYSA-N 261.237 1.846 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccccc1F 794795 KZSIRZVYFRDIAU-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA CCOC(=O)c1ccnc(N2CC(C(C)=O)C2)c1[N+](=O)[O-] 1775998798 KCMUDNHBSYFBJR-UHFFFAOYSA-N 293.279 1.192 5 50 CDBA CN(C)C1CCN(c2cccnc2[N+](=O)[O-])CC1 169725779 ZVYOALWCERHAIM-UHFFFAOYSA-N 250.302 1.520 5 50 CDBA O=C(NC[C@@H]1CCOC1)c1cccc([N+](=O)[O-])c1O 123110875 JEUCZPWXLROXMS-QMMMGPOBSA-N 266.253 1.067 5 50 CDBA Cc1ccc2c(ccn3cc4c(c(=O)n(C)c(=O)n4C)c23)c1 531793 XEGSMMVSGHNCAT-UHFFFAOYSA-N 293.326 1.952 5 50 CDBA O=[N+]([O-])c1ccccc1SCCCS(=O)(=O)O 2165044 MCMKUBXXWYNIMI-UHFFFAOYSA-N 277.323 1.965 5 50 CDBA CCCn1cc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)cn1 4810869 LAACAHQHYQXPPN-UHFFFAOYSA-N 292.299 1.345 5 50 CDBA Nc1c(C(=O)O)cc(Br)cc1[N+](=O)[O-] 16677994 MCQLFDJHSKKLHC-UHFFFAOYSA-N 261.031 1.638 5 50 CDBA in-vitro O=C(Cc1ccccc1[N+](=O)[O-])Nc1cnns1 170603836 FAUPQOKWKHKHLG-UHFFFAOYSA-N 264.266 1.628 5 50 CDBA O=C1[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 584904256 AQNMNKYXHBFFMN-WYUUTHIRSA-N 288.259 1.262 5 50 CDBA Cc1nn(C)c(NCc2nc3cccnc3[nH]2)c1[N+](=O)[O-] 170088694 HBMZPOMDEVQLQV-UHFFFAOYSA-N 287.283 1.520 5 50 CDBA O=C(OCCn1cc([N+](=O)[O-])cn1)c1cc(F)ccc1F 170604716 SGUWDYYYNUBYTN-UHFFFAOYSA-N 297.217 1.927 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)/N=c2/cccc[nH]2)cc1 1822 RFKCCVWFXQAMBJ-UHFFFAOYSA-N 279.277 1.213 5 50 CDBA CCCCn1nnc(NC(=O)c2ccccc2[N+](=O)[O-])n1 2865906 LUAGDRFTCHGQDV-UHFFFAOYSA-N 290.283 1.634 5 50 CDBA NS(=O)(=O)c1cc([N+](=O)[O-])c(O)c2ccccc12 4007307 YYXAEXKRRLMXDV-UHFFFAOYSA-N 268.250 1.101 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2cccnc2)c1 4705283 VKKZTHYZXNSUIH-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA NC(=O)c1cc(Br)c(F)cc1[N+](=O)[O-] 306706241 PSISFTSAUVMTGS-UHFFFAOYSA-N 263.022 1.595 5 50 CDBA CCOC(=O)C(C)(C(=O)OCC)c1ccc([N+](=O)[O-])cn1 44125828 GBNRGTYDHJAUFD-UHFFFAOYSA-N 296.279 1.374 5 50 CDBA CC1(N)CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 592380226 SSBBQCVPGRGYOX-UHFFFAOYSA-N 299.352 1.097 5 50 CDBA CC[C@@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)N(C)C 166119457 MFYRACICXFLIGT-VIFPVBQESA-N 267.285 1.579 5 50 CDBA COc1ccc(C=O)cc1Cn1cc([N+](=O)[O-])cn1 35781 XMSJDGSKTKNJLS-UHFFFAOYSA-N 261.237 1.661 5 50 CDBA in-vitro COc1cccc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c1 4753333 FWHHHJKDYWAWPK-UHFFFAOYSA-N 290.279 1.116 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCC1 192164 TVCJPXJRFSPNIZ-UHFFFAOYSA-N 256.283 1.379 5 50 CDBA COc1cc([N+](=O)[O-])c(OC)cc1N1C(=O)CCC1=O 4863223 KIPIWXOBXAXSCF-UHFFFAOYSA-N 280.236 1.265 5 50 CDBA COC(=O)CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 174246448 WZXMSJNVBCGGID-UHFFFAOYSA-N 294.307 1.611 5 50 CDBA CC(C)OC(=O)c1ccc([N+](=O)[O-])cc1C(=O)O 71771191 MMZPADNGCUNTPT-UHFFFAOYSA-N 253.210 1.858 5 50 CDBA O=[N+]([O-])c1cnc(NCCCn2ccnc2)c([N+](=O)[O-])c1 19757610 HEIOKZRPDNKOML-UHFFFAOYSA-N 292.255 1.597 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCN(c3ncccn3)CC2)c1 19536348 RZKJWHNLYVYZMI-UHFFFAOYSA-N 299.334 1.707 5 50 CDBA Cc1ccc(S(=O)(=O)n2c([N+](=O)[O-])cnc2C)c(C)c1 53227 BHYBXJVGQCNQLD-UHFFFAOYSA-N 295.320 1.954 5 50 CDBA Cc1nn([C@@H](C)C(=O)NC[C@H]2CCCO2)c(C)c1[N+](=O)[O-] 1071177 ZBVIZKKEENXYKH-WDEREUQCSA-N 296.327 1.264 5 50 CDBA Cc1nnc2n1N=C(c1ccc([N+](=O)[O-])cc1)CS2 6816793 DTSOMYAVZYZUIT-UHFFFAOYSA-N 275.293 1.853 5 50 CDBA O=C(NC[C@H]1CCCO1)c1ccc(O)c([N+](=O)[O-])c1 163960008 ONYUVNJUOBFYIN-SECBINFHSA-N 266.253 1.209 5 50 CDBA CS(=O)(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1Cl 39199226 MFZMFGOOVBJJKY-UHFFFAOYSA-N 279.657 1.350 5 50 CDBA in-vitro COCCCNC(=O)c1cccc(C)c1[N+](=O)[O-] 2827516 LOOOOSCCVWADHK-UHFFFAOYSA-N 252.270 1.670 5 50 CDBA CCNc1cc(N2CCNCC2)ccc1[N+](=O)[O-] 4688319 TZIIWRXQRBBQDG-UHFFFAOYSA-N 250.302 1.436 5 50 CDBA CON(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 160112657 GRINWUSYNUMATI-UHFFFAOYSA-N 289.085 1.991 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)N2CCCCC2)c1 3848627 BZBNTCYTNHCSJU-UHFFFAOYSA-N 270.310 1.769 5 50 CDBA Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1[N+](=O)[O-] 3996078 QXCQWNCHCAMZQN-UHFFFAOYSA-N 272.326 1.980 5 50 CDBA O=C(O)/C=C\C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 4963915 OZZUVTAMUUOPOJ-ARJAWSKDSA-N 270.628 1.828 5 50 CDBA O=C(Nc1ccc(Cl)cn1)c1n[nH]cc1[N+](=O)[O-] 371802 ACWYDLGURAYJKI-UHFFFAOYSA-N 267.632 1.619 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)C[S@@](C)=O 162479078 ZKTNFKCDIVVVTL-YBYGRFCBSA-N 299.352 1.792 5 50 CDBA CCC(=O)NC(=S)Nc1ccccc1[N+](=O)[O-] 4561649 JRPWXYOYBOWZNZ-UHFFFAOYSA-N 253.283 1.818 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)NCCc1ccccc1 1428852 KWCDMGIZAWBZRY-UHFFFAOYSA-N 288.307 1.459 5 50 CDBA O=C1CCC(=O)N1Sc1ccc([N+](=O)[O-])cc1 1510580 OFMYIQWJIWBLCY-UHFFFAOYSA-N 252.251 1.751 5 50 CDBA C[C@@H](CCCO)N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 239782578 CPKDXGJMVXIOES-VHSXEESVSA-N 267.329 1.989 5 50 CDBA COc1cc(/C=C2/SC(=N)NC2=O)cc([N+](=O)[O-])c1O 19286719 ATLBYVIPVJMCPD-XBXARRHUSA-N 295.276 1.448 5 50 CDBA C[C@H](O)C[C@@H]1CCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164994398 LHJPQOWTWRVOEQ-ONGXEEELSA-N 294.307 1.676 5 50 CDBA CCCOC(=O)Cn1c(=O)sc2cc([N+](=O)[O-])ccc21 5591245 KGADTZBYAPFPMG-UHFFFAOYSA-N 296.304 1.924 5 50 CDBA Cc1c(C(=O)N2CCN(C)CC2)cccc1[N+](=O)[O-] 19607136 NJDOSXHNWUATAD-UHFFFAOYSA-N 263.297 1.291 5 50 CDBA N=C1NC(=O)[C@@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)S1 18106275 TZUFCYVGNXOWGZ-MRVPVSSYSA-N 294.292 1.090 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccncc2)c1 4957263 FYNKLJOOLFWJLT-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA O=[N+]([O-])c1ccc2c(CN3CCOCC3)c[nH]c2c1 59459177 XUNPBFUTOLXFDN-UHFFFAOYSA-N 261.281 1.908 5 50 CDBA O=[N+]([O-])c1ccc2nc(CN3CCOCC3)[nH]c2c1 19929072 ALUIMZSYELSWQJ-UHFFFAOYSA-N 262.269 1.303 5 50 CDBA C[C@@H]1CN(c2c[n+]([O-])ccc2[N+](=O)[O-])C[C@H](C2CC2)O1 408523227 QGTXUESSMXJFAV-NOZJJQNGSA-N 279.296 1.232 5 50 CDBA O=[N+]([O-])c1ccc(F)cc1CSc1nnc(O)[nH]1 194633596 ACVVOQNNHJBIOK-UHFFFAOYSA-N 270.245 1.850 5 50 CDBA O=C(O)c1cccc([N+](=O)[O-])c1I 163345 XWOGTRRVKVPJSP-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro O=C(O)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 21952282 SAWBVPNJYFXPIA-UHFFFAOYSA-N 293.279 1.923 5 50 CDBA O=C1NCCc2cc(Br)c([N+](=O)[O-])cc21 1535642708 YFXQVBVQGGVTBU-UHFFFAOYSA-N 271.070 1.643 5 50 CDBA NC(=O)c1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 256266 BJTGNMXHIHCZKS-UHFFFAOYSA-N 299.286 1.875 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCN(c3ncccn3)CC2)o1 22591185 HUVVBOGAVPYZQV-UHFFFAOYSA-N 289.295 1.300 5 50 CDBA CC(=O)N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)NC(C)C 38205544 OQIYSHVGWUEISB-MDWZMJQESA-N 291.307 1.596 5 50 CDBA CS(=O)(=O)c1nc2ccc([N+](=O)[O-])cc2s1 1857478 XZXMLEUCJADXIG-UHFFFAOYSA-N 258.280 1.608 5 50 CDBA O=[N+]([O-])c1cnc(N2CCN(c3ccccc3)CC2)nc1 4819052 PFKYFMFJRJFUEL-UHFFFAOYSA-N 285.307 1.711 5 50 CDBA CCc1[nH]nc(C(=O)N2C[C@H]3[C@@H](C2)C3(C)C)c1[N+](=O)[O-] 174244038 QOTLZGMKRNWDKL-OCAPTIKFSA-N 278.312 1.608 5 50 CDBA C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517565 KKHLKORVTUUSBC-YFKPBYRVSA-N 255.186 1.388 5 50 CDBA in-vitro COc1cc(N(C)CCN(C)C)c([N+](=O)[O-])cc1N 1777699130 ZQJOHNKMQIVCHV-UHFFFAOYSA-N 268.317 1.183 5 50 CDBA COC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 4011937 RAMUFABIQJQFKV-UHFFFAOYSA-N 252.226 1.487 5 50 CDBA Cc1nnc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)s1 43455 CUOKAVPCIPXIKY-UHFFFAOYSA-N 278.293 1.936 5 50 CDBA CC(=O)NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2[nH]1 318094 VTYMMETXVJBPQB-UHFFFAOYSA-N 294.292 1.226 5 50 CDBA O=[N+]([O-])c1cc(CN2CCN(CCO)CC2)ccc1Cl 23114809 MQWIVLWUXRUFAU-UHFFFAOYSA-N 299.758 1.358 5 50 CDBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 3904567 AYLXAMIBVCVVPD-UHFFFAOYSA-N 281.287 1.793 5 50 CDBA O=C(OCc1cccc([N+](=O)[O-])c1)c1cnccn1 466932 OLHRIQZMHNERAB-UHFFFAOYSA-N 259.221 1.742 5 50 CDBA C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H](C)O1 241371257 MLTFWOQTGGOMJW-DOFRTFSJSA-N 294.307 1.986 5 50 CDBA COc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])on1 170594344 ONJMREHWOFEZJP-UHFFFAOYSA-N 291.263 1.864 5 50 CDBA COc1ccc(Cn2ccnc2CO)cc1[N+](=O)[O-] 374920 NGRNARRTVQPMPJ-UHFFFAOYSA-N 263.253 1.341 5 50 CDBA O=C(O)[C@H]1CS[C@H](c2ccc([N+](=O)[O-])cc2)N1 77895 WHEHQPOUIXMETN-RKDXNWHRSA-N 254.267 1.383 5 50 CDBA N[C@@H]1CC[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@@H]21 239807475 CSGQQIVXQBZHIZ-JFUSQASVSA-N 293.298 1.543 5 50 CDBA Cc1c(NC(=O)N[C@@H]2C[C@H](C)OC2=O)cccc1[N+](=O)[O-] 585119924 AFHKOTPAUVFMMQ-OIBJUYFYSA-N 293.279 1.729 5 50 CDBA CCOC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 16682799 OJOISAKQKBYKBE-UHFFFAOYSA-N 268.225 1.999 5 50 CDBA COC[C@@H]1CN(c2c(Cl)cncc2[N+](=O)[O-])CCO1 408516816 GIQKWZZKCWWCFA-QMMMGPOBSA-N 287.703 1.495 5 50 CDBA Cc1nn2cc(-c3n[nH]cc3[N+](=O)[O-])cnc2c1C(=O)O 1104366 DLGXTORHUOBXGK-UHFFFAOYSA-N 288.223 1.034 5 50 CDBA COc1cc(CN2C[C@@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1O 4838236 BPBMXUKMXJKJNY-NXEZZACHSA-N 296.323 1.918 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)N1CCc2ccccc21 1428841 ZMCIINBFJKASTA-UHFFFAOYSA-N 286.291 1.689 5 50 CDBA Cc1nnc(CCNc2ccc([N+](=O)[O-])cn2)n1C 170610809 GOXIMWQQXJRUAB-UHFFFAOYSA-N 262.273 1.081 5 50 CDBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C(N)=O)C1 192938308 RXMRKFLOHQRKGQ-SNVBAGLBSA-N 291.307 1.241 5 50 CDBA COc1cc(/C=C/C(=O)O)c([N+](=O)[O-])cc1OC 153558 BZIRMMAJZSOLEW-ONEGZZNKSA-N 253.210 1.710 5 50 CDBA in-vitro Cc1c([N+](=O)[O-])ncn1CCO[C@@H]1CCCCO1 1775990281 WPPUDRPDDYLHNH-SNVBAGLBSA-N 255.274 1.643 5 50 CDBA O=C(COc1ccccc1[N+](=O)[O-])NCc1ccco1 115692 MAPZUQMGFCTHKF-UHFFFAOYSA-N 276.248 1.883 5 50 CDBA O=C(O)Cc1c([N+](=O)[O-])cc(Cl)cc1[N+](=O)[O-] 3083746 FSTJKYIPTGKUNR-UHFFFAOYSA-N 260.589 1.784 5 50 CDBA CN(CCO)c1cc(Cl)c2nonc2c1[N+](=O)[O-] 3882571 RGJBQHGWILSDRA-UHFFFAOYSA-N 272.648 1.213 5 50 CDBA C[C@@H]1CNCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 420165422 HGJZTJKCAACMFZ-MRVPVSSYSA-N 287.266 1.994 5 50 CDBA C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1CCOC1 170005547 WBWSDNIYWQGRFV-PSASIEDQSA-N 280.280 1.455 5 50 CDBA C[C@H](CN(C)c1ncc(Cl)cc1[N+](=O)[O-])c1nnn[nH]1 129829548 FVQYEGNTOQQZDY-ZCFIWIBFSA-N 297.706 1.396 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O 13670944 LCTLIEHXUJWWHU-CHWSQXEVSA-N 278.308 1.970 5 50 CDBA O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccc2c(c1)OCO2 3893946 XDNXEOGLZNIQLH-UHFFFAOYSA-N 287.231 1.971 5 50 CDBA CN1CCN(c2ccc([N+](=O)[O-])c(NCCCO)c2)CC1 4333813 PYZXEPLLFDIQLF-UHFFFAOYSA-N 294.355 1.141 5 50 CDBA Cn1cncc1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 225475429 XFGKEWNMBQQWLM-UHFFFAOYSA-N 286.251 1.457 5 50 CDBA CC(C)C(=O)N[C@@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 253425445 UCEJUEFCPNOQAN-SECBINFHSA-N 298.368 1.792 5 50 CDBA COC(=O)COc1c(C)c(C)c([N+](=O)[O-])c(C)c1[N+](=O)[O-] 30836094 BCFBNNYDAMQUMF-UHFFFAOYSA-N 298.251 1.980 5 50 CDBA COCCCS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 1615565244 KIHBJIIQTQDQAX-UHFFFAOYSA-N 273.310 1.546 5 50 CDBA O=[N+]([O-])c1c(N2CC(OCCO)C2)ccc2ncccc12 952881927 KLAMIYBVLPRQRC-UHFFFAOYSA-N 289.291 1.341 5 50 CDBA CO[C@@H]1CCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1O 160573672 PQMFYKCBFMUTTC-MWLCHTKSSA-N 280.280 1.598 5 50 CDBA O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@H]1CCCSC1 1775984909 PATZIABCJNEATJ-LURJTMIESA-N 256.287 1.400 5 50 CDBA COc1cc(N2CCN(C3CC3)CC2)ccc1[N+](=O)[O-] 266146426 RYQHOVQNLBZKCN-UHFFFAOYSA-N 277.324 1.888 5 50 CDBA CC1=C[C@H](C)[C@H]2C(=O)N(CCC[N+](C)(C)C)C(=O)[C@@H]2C1 4184308 GOEBHGSAJXXUNJ-BFHYXJOUSA-N 279.404 1.670 5 50 CDBA CC(=O)Nc1cc2c(c([N+](=O)[O-])c1[N+](=O)[O-])OCCO2 64038135 PBSAFZNQZDBRJP-UHFFFAOYSA-N 283.196 1.233 5 50 CDBA COC(=O)c1cc(Cn2cnc([N+](=O)[O-])c2)c(C)s1 121253783 QXZGNLBCSZEPAF-UHFFFAOYSA-N 281.293 1.996 5 50 CDBA CC(C)Cn1c(C(C)C)nc([N+](=O)[O-])c1C(=O)NCCO 5384348 UWGBLGGHXUIRIP-UHFFFAOYSA-N 298.343 1.293 5 50 CDBA CC(CO)(CO)CNc1ccc(Cl)cc1[N+](=O)[O-] 328593719 ALEPTSQGCBJTBO-UHFFFAOYSA-N 274.704 1.651 5 50 CDBA Cc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1 4718878 AWMOERZTSKVOHN-VOTSOKGWSA-N 273.248 1.863 5 50 CDBA CN(C)c1c([N+](=O)[O-])cc2[nH]c(O)nc2c1[N+](=O)[O-] 8580959 KKMMBSVYIIGEQM-UHFFFAOYSA-N 267.201 1.151 5 50 CDBA C[C@]1(CO)CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 123524532 SOQOKPJREONSQL-AWEZNQCLSA-N 294.307 1.535 5 50 CDBA C[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 445354 DNSKBCPNYHYFTR-QWRGUYRKSA-N 278.308 1.773 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccccc2Cl)N1 90864 TYGMJKKENBLZGE-MWLCHTKSSA-N 254.673 1.936 5 50 CDBA CNS(=O)(=O)CCNc1ccc(Cl)cc1[N+](=O)[O-] 231677840 KENDRUPKNJVJJK-UHFFFAOYSA-N 293.732 1.209 5 50 CDBA CCC1(Nc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])CC1 296339505 QAHHTWGEOUPAKS-UHFFFAOYSA-N 299.352 1.857 5 50 CDBA C[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](C)C1 163356804 YBTFZFZDTRHRAC-YUMQZZPRSA-N 252.274 1.579 5 50 CDBA COC(=O)COC(=O)c1cc([N+](=O)[O-])cc(C)c1F 170616555 YCCDUIIDIVRSJK-UHFFFAOYSA-N 271.200 1.372 5 50 CDBA O=[N+]([O-])c1cc(S(=O)(=O)O)ccc1Br 1680879 LKQYUJYPYBCDOA-UHFFFAOYSA-N 282.071 1.604 5 50 CDBA NC(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 435978 CRHLHAYVXATWKX-UHFFFAOYSA-N 285.259 1.946 5 50 CDBA COC(=O)C1(C(=O)OC)Cc2cccc([N+](=O)[O-])c2C1 115183692 YNOARURNDVTFQP-UHFFFAOYSA-N 279.248 1.026 5 50 CDBA O=C(O)CSc1cc(C(=O)O)ccc1[N+](=O)[O-] 188930 OZEQVONQYGMOCC-UHFFFAOYSA-N 257.223 1.470 5 50 CDBA O=C1[C@@H]2CCCN2C(=O)N1c1cccc([N+](=O)[O-])c1 36755987 MKMUCICMDIXLLS-JTQLQIEISA-N 261.237 1.526 5 50 CDBA NC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12 278296 XCSROMRNYAPQNT-UHFFFAOYSA-N 269.256 1.810 5 50 CDBA O=[N+]([O-])c1cccc(NC(=S)N2CCOCC2)c1 610880 YVRWUKVMGOYHMG-UHFFFAOYSA-N 267.310 1.624 5 50 CDBA Cc1nn(C[C@@H]2CNC(=O)O2)c2ccc([N+](=O)[O-])cc12 282224369 OLDUQKLYMRVTOX-VIFPVBQESA-N 276.252 1.361 5 50 CDBA CCOc1ccc(NC(=O)[C@H](C)O)c([N+](=O)[O-])c1 4826782 AKVZEESPETUWKJ-ZETCQYMHSA-N 254.242 1.313 5 50 CDBA Cc1cc(C)c(C[N+]23CN4CN(CN(C4)C2)C3)c(C)c1 19321047 BTCAMAZADXKUDK-UHFFFAOYSA-N 273.404 1.620 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](O)C1 163158023 CUMWLZKYKAWACH-SNVBAGLBSA-N 265.269 1.502 5 50 CDBA COC[C@@H](C)NC(=O)c1ccc(C)c([N+](=O)[O-])c1 456653 VMFYAPIJHGBIKZ-SECBINFHSA-N 252.270 1.668 5 50 CDBA Nc1ccccc1SC1=C([N+](=O)[O-])CS(=O)(=O)C1 875271 YJNIIEKKWZTUMM-UHFFFAOYSA-N 286.334 1.278 5 50 CDBA O=C(O)CSc1ccc([N+](=O)[O-])cc1C(=O)O 1508457 OHUNNGBOLPPURJ-UHFFFAOYSA-N 257.223 1.470 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCOC[C@@H]1[C@@H]1CCC[C@H]1O 521398443 HIJSRYWCRVMPAM-CYZMBNFOSA-N 293.323 1.356 5 50 CDBA NS(=O)(=O)c1cc(Cl)c([N+](=O)[O-])c(Cl)c1 263625266 YEWWCSYSIVFTDW-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA NS(=O)(=O)c1ccc(Cc2ccc([N+](=O)[O-])cc2)cc1 2848314 BTYDYHYETOUTRB-UHFFFAOYSA-N 292.316 1.833 5 50 CDBA CCN(CC)CCC[C@@H](C)Nc1ncnc(N)c1[N+](=O)[O-] 3912509 FKJUDAMJFOFLRM-SNVBAGLBSA-N 296.375 1.889 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N1CC[C@H]([C@H]2CCOC2)C1 408426466 UMRJEIOLAUHUNK-UWVGGRQHSA-N 266.301 1.191 5 50 CDBA CCC(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1F 456150 ZYXDPJIICLTHTO-UHFFFAOYSA-N 271.273 1.957 5 50 CDBA N=C1NC(=O)/C(=C\c2cc([N+](=O)[O-])ccc2O)S1 4991718 FVSCNLHHHWANGE-XBXARRHUSA-N 265.250 1.439 5 50 CDBA CC[C@@H](CO)N1CCN(c2cccc(C)c2[N+](=O)[O-])CC1 225459380 PCBWIYGNDQQUPR-ZDUSSCGKSA-N 293.367 1.796 5 50 CDBA C[C@H](C(=O)N1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 22515630 AZVGXKXMYKNCQJ-NSHDSACASA-N 277.324 1.472 5 50 CDBA NS(=O)(=O)c1ccc([N+](=O)[O-])c(Cl)c1Cl 263624882 UWMDDAGMZMSJMZ-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA CN(C)c1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 3877745 HPESPZDCCQMDOO-UHFFFAOYSA-N 255.186 1.267 5 50 CDBA in-vitro O=c1[nH]c(O)nc(/C=C/c2ccsc2)c1[N+](=O)[O-] 4727566 DMNNYALXRUIKLT-OWOJBTEDSA-N 265.250 1.616 5 50 CDBA CCC(=O)N[C@H](Cc1ccc(OC)c([N+](=O)[O-])c1)C(=O)O 311955 ZQJITFNZEBENHG-SECBINFHSA-N 296.279 1.125 5 50 CDBA Cc1ccc(F)cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 356084 QYZMFHSGWRFLSI-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA O=[N+]([O-])c1ccc2[nH]cc(CN3CCNCC3)c2c1 328578078 XFFCTGYEAOMXIV-UHFFFAOYSA-N 260.297 1.481 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CC[C@H](C)S(=O)(=O)CC1 170613560 TVXNMMIRYHIIEF-JTQLQIEISA-N 299.352 1.312 5 50 CDBA COC(=O)[C@H](CC(C)C)NC(=O)c1ccccc1[N+](=O)[O-] 318605 IZJKSTSDGTZPJE-NSHDSACASA-N 294.307 1.912 5 50 CDBA O=C(Oc1cccc([N+](=O)[O-])c1)[C@@H]1CCCNC1 6092487 MUVROTJILUATRW-SECBINFHSA-N 250.254 1.500 5 50 CDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC(CO)CC1 119291157 YZQGZZVRAJBQKE-UHFFFAOYSA-N 280.280 1.145 5 50 CDBA C[Si](C)(C)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 585079787 OMEGTTUFQHHZEZ-UHFFFAOYSA-N 284.392 1.636 5 50 CDBA NC(=O)c1[nH]c2c([N+](=O)[O-])cccc2c1CCCC(=O)O 1775970931 KPFNGSDSUVTTAO-UHFFFAOYSA-N 291.263 1.582 5 50 CDBA CC(C)[C@@H](C(=O)O)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 191424 WYZPKTOYRYTTRJ-JTQLQIEISA-N 292.247 1.300 5 50 CDBA CC(=O)N1[C@@H](C(=O)O)CS[C@@H]1c1ccc([N+](=O)[O-])cc1 185047 DPFVSVGVJVQKSP-GHMZBOCLSA-N 296.304 1.642 5 50 CDBA CC(=O)N1CC[C@@H](CNc2nccc(C)c2[N+](=O)[O-])C1 521394240 LCPZIRPPYYVCOP-NSHDSACASA-N 278.312 1.579 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NNc2ccccc2)c1 5021181 DTPZPGCBXXDDEU-UHFFFAOYSA-N 293.304 1.900 5 50 CDBA CCOCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] 4700589 RWSOFMGXUYHDBA-UHFFFAOYSA-N 254.242 1.578 5 50 CDBA Cc1ncc(CNc2nccc(C)c2[N+](=O)[O-])c(=N)[nH]1 585092415 VVALNMMHIHFAHV-UHFFFAOYSA-N 274.284 1.421 5 50 CDBA Cc1c(NC(=O)N[C@@H]2C[C@@H](C)OC2=O)cccc1[N+](=O)[O-] 585119923 AFHKOTPAUVFMMQ-GMSGAONNSA-N 293.279 1.729 5 50 CDBA NC(=O)Cc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 164960 DIRZWLIATNEVTJ-UHFFFAOYSA-N 263.278 1.746 5 50 CDBA O=C1N=CC=C[C@H]1c1noc(-c2ccc([N+](=O)[O-])cc2)n1 253415999 ZPOLYFUTDMLBHK-JTQLQIEISA-N 284.231 1.896 5 50 CDBA CC[N+](C)(CC)C[C@@H]1CO[C@H](C[N+](C)(CC)CC)CO1 225657 FROPDBPURWDMRD-HZPDHXFCSA-N 288.476 1.743 5 50 CDBA CC(C)(C)OC(=O)CNc1ncccc1[N+](=O)[O-] 143752882 YJYJATIUIUXMHI-UHFFFAOYSA-N 253.258 1.743 5 50 CDBA C[C@H]1CN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C 292852723 ABLMCCLXRADBSI-QWRGUYRKSA-N 298.364 1.709 5 50 CDBA CC(C)(CO)NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 547726 NJGSJCQBPHKHPB-VMPITWQZSA-N 264.281 1.495 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccncc1 333752 BYBWNRWKFSHCJU-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA O=C1c2ccccc2C(=O)N1c1cc([N+](=O)[O-])ccn1 367708 DJRIHOHHHKLNRT-UHFFFAOYSA-N 269.216 1.790 5 50 CDBA Cc1ccc(S(=O)(=O)n2cccc2[N+](=O)[O-])cc1 196844162 DYDHHXIHVGYNKP-UHFFFAOYSA-N 266.278 1.942 5 50 CDBA Cc1nn([C@H]2CCN(C3CC3)C2=O)c(C)c1[N+](=O)[O-] 408345423 ANZSGOKZFITCTC-JTQLQIEISA-N 264.285 1.344 5 50 CDBA Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n(C)n1 170594706 CGFODPGRPMKHPZ-UHFFFAOYSA-N 279.231 1.423 5 50 CDBA O=c1ccc(F)cn1CCOc1ccc([N+](=O)[O-])cc1 190745419 HTBVWLFKCFNUPL-UHFFFAOYSA-N 278.239 1.975 5 50 CDBA COCCNc1cc(F)c(F)c(N(C)C)c1[N+](=O)[O-] 936069369 SEPVFCLYRYLZHD-UHFFFAOYSA-N 275.255 1.997 5 50 CDBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC1 2872557 QSDCIZYNHKADMG-JTQLQIEISA-N 264.281 1.985 5 50 CDBA CCOC(COCCNc1ncccc1[N+](=O)[O-])OCC 170618744 USFOPRKSQYNEQT-UHFFFAOYSA-N 299.327 1.817 5 50 CDBA O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@@H]1CCCO1 585089361 HGTHTZZMWOCQJX-JTQLQIEISA-N 282.271 1.572 5 50 CDBA COc1ccc(C(=O)NCCCN(C)C)cc1[N+](=O)[O-] 2912028 MFCATFFYAWVXEO-UHFFFAOYSA-N 281.312 1.285 5 50 CDBA biogenic O=[N+]([O-])c1cc(CSc2ncn[nH]2)ccc1O 18130294 CXXAUUSUQKWGLH-UHFFFAOYSA-N 252.255 1.711 5 50 CDBA C[C@@H](O)CN(C)Nc1ccc2ncccc2c1[N+](=O)[O-] 952963881 MWCNHKMKNVKAOM-SECBINFHSA-N 276.296 1.783 5 50 CDBA O=c1[nH]c(O)nc(/C=C/c2ccc(O)cc2)c1[N+](=O)[O-] 4891479 IXRBZNCTCYNHKP-ZZXKWVIFSA-N 275.220 1.260 5 50 CDBA COc1cc(CN2CCC[C@@H](O)C2)cc([N+](=O)[O-])c1O 16310450 ZZCQBVDHHFPMKV-SNVBAGLBSA-N 282.296 1.266 5 50 CDBA COc1ccc(CSc2nncn2N)cc1[N+](=O)[O-] 305869 BCTZDVHJIPTYSU-UHFFFAOYSA-N 281.297 1.201 5 50 CDBA CCN(C)[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cn2)C1 170606547 PGMYIYHCSSJRGB-NSHDSACASA-N 264.329 1.829 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN3C[C@@H](F)C[C@H]3C2)c(F)c1 952993069 VNKPOVXILATSPN-ONGXEEELSA-N 283.278 1.966 5 50 CDBA CN(C)[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])cn1 585118055 YDVDOPUBLUWNQI-GHMZBOCLSA-N 250.302 1.884 5 50 CDBA COc1ccccc1NC(=O)Cn1c([N+](=O)[O-])cnc1C 464882 KLYSORZDETZMOV-UHFFFAOYSA-N 290.279 1.747 5 50 CDBA O=C1CCc2cc([N+](=O)[O-])c(NCc3cc[nH]n3)cc2N1 134222101 MHBLSKSPIAAPSE-UHFFFAOYSA-N 287.279 1.815 5 50 CDBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ccncc1[N+](=O)[O-] 241262014 LAOKBYFBBFJDKS-UMNHJUIQSA-N 290.323 1.613 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)C[S@](C)=O 162478782 ZKTNFKCDIVVVTL-GSDQLPOLSA-N 299.352 1.792 5 50 CDBA O=C(N[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 71773939 AURNBJUNLCGYMJ-QWRGUYRKSA-N 250.254 1.238 5 50 CDBA CCOC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2026171 QXQPIQWWXNPKNQ-UHFFFAOYSA-N 272.644 1.750 5 50 CDBA CCOC(=O)c1ccc(NCC(=O)O)c([N+](=O)[O-])c1 71196128 IOJCFTJBMNJGLJ-UHFFFAOYSA-N 268.225 1.268 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)/N=c1/cccc[nH]1 3122182 GDVIEMRVYPXDDU-UHFFFAOYSA-N 279.277 1.213 5 50 CDBA CCOC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 197822 OGWYDXOVZXOHSD-UHFFFAOYSA-N 263.205 1.878 5 50 CDBA biogenic COc1cccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1 122546 KFYLNOYLFXNMLQ-JQWIXIFHSA-N 250.254 1.292 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)NCc1cccs1 1068719 IRKAKZBAFKREEH-UHFFFAOYSA-N 266.282 1.169 5 50 CDBA COC(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-] 4016334 RQZHHQQATAKKER-UHFFFAOYSA-N 252.226 1.487 5 50 CDBA CC(=O)N1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 19634300 OQGOZEUKJCLPBS-GQCTYLIASA-N 289.335 1.772 5 50 CDBA O=[N+]([O-])c1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)O)c1 4181925 ODEUZCDONYETMV-UHFFFAOYSA-N 282.617 1.403 5 50 CDBA CCc1[nH]nc(C(=O)N2CCSCC[C@@H]2C)c1[N+](=O)[O-] 192937135 VEFICPSDPJYXLS-QMMMGPOBSA-N 298.368 1.848 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1NCCCO 4980202 MFXSEJCNELEBDC-UHFFFAOYSA-N 281.312 1.226 5 50 CDBA CCOC(=O)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] 1706056 ZSOCPPIVHVUSGS-UHFFFAOYSA-N 269.253 1.718 5 50 CDBA CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br 173005323 RGLQVAZHRDAQCH-UHFFFAOYSA-N 295.114 1.265 5 50 CDBA Cn1cc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])nn1 240569385 HADVUGNZDQQTHY-UHFFFAOYSA-N 265.204 1.115 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N[C@@H]2C(=O)NCC[C@H]2C)c1 193521093 DPMHQENPDNDFIP-SKDRFNHKSA-N 263.297 1.840 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(F)cc1 1060054 HZKQHCIIRIJLKG-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA O=C(O)CSc1ccc(C(=O)O)cc1[N+](=O)[O-] 58224 JTCYKOZBAMATGW-UHFFFAOYSA-N 257.223 1.470 5 50 CDBA NS(=O)(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 4158824 AASPRUQATTUAOP-UHFFFAOYSA-N 285.325 1.233 5 50 CDBA CCN1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1 4614194 JGTPDLWGLKDLDG-UHFFFAOYSA-N 277.324 1.681 5 50 CDBA CCOC(=O)COc1cc2c(cc1[N+](=O)[O-])OCO2 4782706 QBYXAGLOVQEIHW-UHFFFAOYSA-N 269.209 1.265 5 50 CDBA O=C(O)CCCC(=O)Nc1ccc([N+](=O)[O-])cc1O 5065494 VDYHVWMVXREVLK-UHFFFAOYSA-N 268.225 1.494 5 50 CDBA N[C@H](CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517254 AYMDNNQPNXWIKK-MRVPVSSYSA-N 298.255 1.107 5 50 CDBA Nc1ccc2nn(-c3cc([N+](=O)[O-])ccc3O)nc2c1 36162515 ILUKYDTWSCCIQJ-UHFFFAOYSA-N 271.236 1.617 5 50 CDBA CCc1[nH]nc(C(=O)N2C[C@@H]3[C@@H](C2)C3(C)C)c1[N+](=O)[O-] 174244023 QOTLZGMKRNWDKL-HTQZYQBOSA-N 278.312 1.608 5 50 CDBA CC1(N)CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 592380751 XRBTYLMSFVFWCB-UHFFFAOYSA-N 299.352 1.097 5 50 CDBA O=[N+]([O-])c1nn(CCC2OCCO2)cc1Br 163658737 SFWAELXKEMYDLC-UHFFFAOYSA-N 292.089 1.317 5 50 CDBA CCOC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc2c1=O 8652206 DBJCDCSZGDONQQ-UHFFFAOYSA-N 262.221 1.613 5 50 CDBA in-vitro COc1cccc(/C=C/c2nc(O)nc(O)c2[N+](=O)[O-])c1 12371511 HZHRPAGNRIOZKF-AATRIKPKSA-N 289.247 1.975 5 50 CDBA COc1cc(CN2CCN(C)CC2)cc([N+](=O)[O-])c1O 19537138 OFXZTMZBLFXEAC-UHFFFAOYSA-N 281.312 1.056 5 50 CDBA CCOC(=O)COc1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 4779404 BHXLLSVOHJUCBH-GQCTYLIASA-N 295.247 1.635 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C 4833860 RXNGUHIWCPDEDM-UHFFFAOYSA-N 253.258 1.104 5 50 CDBA O=[N+]([O-])c1cnc(N[C@H]2CCO[C@]3(CCOC3)C2)c(F)c1 408472290 USVSLHIGJNJNQK-TVQRCGJNSA-N 297.286 1.879 5 50 CDBA COc1ccc(C(=O)NCC(C)C)cc1[N+](=O)[O-] 103437 CTJKHNKDZHFPGA-UHFFFAOYSA-N 252.270 1.989 5 50 CDBA C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517567 KKHLKORVTUUSBC-RXMQYKEDSA-N 255.186 1.388 5 50 CDBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCO1 4777417 RIGKPBKPPIVLOS-GWCFXTLKSA-N 294.307 1.657 5 50 CDBA O=C(O)COc1ccc(Br)cc1[N+](=O)[O-] 26509955 PNFGYDNFHHYLCK-UHFFFAOYSA-N 276.042 1.821 5 50 CDBA C[C@]1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1 127828809 ZOCMDCPIMYHBPW-LBPRGKRZSA-N 266.253 1.209 5 50 CDBA Cc1cc(NCc2nc(N(C)C)n[nH]2)ccc1[N+](=O)[O-] 585132714 OPBURYSKJIYINJ-UHFFFAOYSA-N 276.300 1.699 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@]2(CCOC2)C1 192775798 UMINPYWMYRLCNP-CYBMUJFWSA-N 296.327 1.115 5 50 CDBA CC1([N+](=O)[O-])COC(c2ccc3c(c2)OCO3)OC1 2172314 XAGSYKYHSOUFNM-UHFFFAOYSA-N 267.237 1.496 5 50 CDBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@](O)(C(F)F)C1 355650 SUVWTQNPRXWFDS-GFCCVEGCSA-N 299.233 1.770 5 50 CDBA C[C@H]1CCCN([C@]2(O)C(=O)Nc3ccc([N+](=O)[O-])cc32)C1 239038537 DJSFIGARWKRMBO-LKFCYVNXSA-N 291.307 1.424 5 50 CDBA CCOc1ccc([C@H](O)C[N+](=O)[O-])cc1OCC 140324 GLOGSVOPMKZAKV-SNVBAGLBSA-N 255.270 1.794 5 50 CDBA CCN(CC)CCC[C@H](C)Nc1ncnc(N)c1[N+](=O)[O-] 3912510 FKJUDAMJFOFLRM-JTQLQIEISA-N 296.375 1.889 5 50 CDBA CCOC(=O)C(C(=O)OCC)C(C)(C)C[N+](=O)[O-] 23549983 QVWNPUMYQKVROR-UHFFFAOYSA-N 261.274 1.032 5 50 CDBA CO[C@@]1(C)CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 230285590 JKPJROGOYPVGPG-AWEZNQCLSA-N 293.323 1.818 5 50 CDBA Cc1nc(N2CCC(c3nnc[nH]3)CC2)ccc1[N+](=O)[O-] 151488860 IRDZAZRBJDGQIF-UHFFFAOYSA-N 288.311 1.800 5 50 CDBA C[C@@H]1CC(=O)N(Cc2c(F)cc([N+](=O)[O-])cc2F)C1=O 408518608 PWFDDPOPGMGPQU-ZCFIWIBFSA-N 284.218 1.768 5 50 CDBA C[C@@H](NC(=O)NC(=O)c1cccc([N+](=O)[O-])c1)C1CC1 232000 RMSLASNQTWYYQO-MRVPVSSYSA-N 277.280 1.833 5 50 CDBA CS(=O)(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 7777142 MSIOVNOVZUQYED-UHFFFAOYSA-N 284.215 1.985 5 50 CDBA COc1cc(CCN2CCCC2=O)c([N+](=O)[O-])cc1OC 30947835 UMHITRVPVQHIPQ-UHFFFAOYSA-N 294.307 1.777 5 50 CDBA O=c1[nH]nc(CSc2ccc([N+](=O)[O-])cc2)[nH]1 5731159 HOYGURFBUZNFIU-UHFFFAOYSA-N 252.255 1.299 5 50 CDBA Cc1ccc(C(=O)NCc2cnn(C)c2)cc1[N+](=O)[O-] 1054941 YHXAUVZHMOPUAA-UHFFFAOYSA-N 274.280 1.567 5 50 CDBA CS(=O)(=O)NCCNc1cc(Cl)ccc1[N+](=O)[O-] 4565474 TZXCBRLOKBPWIG-UHFFFAOYSA-N 293.732 1.209 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2cc3c(cc2Cl)OCO3)N1 89577 ISQNUCJEUYXRGA-PRHODGIISA-N 298.682 1.665 5 50 CDBA CN1CCC(N(C)Cc2ccc(O)c([N+](=O)[O-])c2)CC1 4986365 NDCNPNJPJIVOEV-UHFFFAOYSA-N 279.340 1.826 5 50 CDBA Cc1ccnc(N2CC(N3CCCC3)C2)c1[N+](=O)[O-] 585092812 OYBQAQLEAABRGS-UHFFFAOYSA-N 262.313 1.583 5 50 CDBA COc1ccc(C(=O)N[C@H]2CCSC2=O)cc1[N+](=O)[O-] 183874 DHEXWFBYRTVCPT-QMMMGPOBSA-N 296.304 1.365 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)n1ccnc1 191413 JIKAWNLIQSUFJM-UHFFFAOYSA-N 253.239 1.028 5 50 CDBA CC(C)(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 301478 YVSUQTZCHSBFEN-UHFFFAOYSA-N 258.299 1.672 5 50 CDBA in-vitro COC(=O)c1cc([N+](=O)[O-])c(Cl)c([N+](=O)[O-])c1 1687732 YJUFTUQWRBJBJN-UHFFFAOYSA-N 260.589 1.943 5 50 CDBA Cc1nc(N2CCOCC2)nc(N2CCCC2)c1[N+](=O)[O-] 4008336 OOXVNONOCMZLIU-UHFFFAOYSA-N 293.327 1.130 5 50 CDBA C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CN(C)C 4700910 VGNRVHHGEFDIGO-LLVKDONJSA-N 279.340 1.451 5 50 CDBA C[C@@H](C(=O)N1CCCCCC1)n1cc([N+](=O)[O-])cn1 1432068 RLPSLFKVIKMDCF-JTQLQIEISA-N 266.301 1.755 5 50 CDBA C[C@@]1(CNC(=O)c2cccc([N+](=O)[O-])c2O)CCCO1 158779332 NQAOBXQUPGNTSB-ZDUSSCGKSA-N 280.280 1.599 5 50 CDBA C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ncn(C)n1 391976771 MDEXQVZMJAWJPK-JTQLQIEISA-N 275.312 1.617 5 50 CDBA O=[N+]([O-])c1ccc(NCCNCCO)c(Cl)c1 4587883 ZDFPMINOGMCWFU-UHFFFAOYSA-N 259.693 1.242 5 50 CDBA NC(=O)c1cc([N+](=O)[O-])ccc1NCc1cccnc1 4755142 YGOUPMYBESSSAI-UHFFFAOYSA-N 272.264 1.701 5 50 CDBA in-vitro C[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)C[C@@H](C2CC2)O1 408524590 VZRYRDJTRBUUJD-KWQFWETISA-N 278.312 1.576 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)N[C@@H](C)c1ccccc1 196095 MNIRMFLJSSZBCR-NSHDSACASA-N 288.307 1.977 5 50 CDBA C[C@H](C(=O)N1CCCCCC1)n1cc([N+](=O)[O-])cn1 1432069 RLPSLFKVIKMDCF-SNVBAGLBSA-N 266.301 1.755 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(F)cc1 170596 RSLFBBAKPSAZLK-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA O=[N+]([O-])c1ccc(NCCN2CCCOCC2)cc1 188490187 ICSDRGQQUKMTSB-UHFFFAOYSA-N 265.313 1.729 5 50 CDBA COc1cc(C(=O)N[C@@H](C)CCC(=O)O)ccc1[N+](=O)[O-] 165374703 KQOVFOIFORXHNM-QMMMGPOBSA-N 296.279 1.587 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@@H](c3ccon3)C2)nc1 1775989421 NUINCVUDQHEAPX-SECBINFHSA-N 260.253 1.972 5 50 CDBA COc1ccc(OC)c([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1 115940 CVLKDXLRWZVGRV-GWCFXTLKSA-N 280.280 1.300 5 50 CDBA NC(=S)NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2141512 QKVKVSYJCRXTRD-UHFFFAOYSA-N 274.689 1.613 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N1CC(Nc2ccc(F)cc2)C1 585092747 MECPCYDFTPJSEG-UHFFFAOYSA-N 291.286 1.768 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)n2cccc2)cc1 1674533 XQLYKJOAKINWEF-UHFFFAOYSA-N 252.251 1.633 5 50 CDBA CN(C)CCCNC(=O)c1cccc([N+](=O)[O-])c1 2900983 GRFMMVHWUWNDQY-UHFFFAOYSA-N 251.286 1.276 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2cncs2)n1 1012182 VXUROFPSDYWLMO-UHFFFAOYSA-N 253.243 1.037 5 50 CDBA CCN(C)[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cn2)C1 170606546 PGMYIYHCSSJRGB-LLVKDONJSA-N 264.329 1.829 5 50 CDBA CN(C)[S@@](C)(=O)=NC(=O)Cc1ccccc1[N+](=O)[O-] 1615059071 ZKIGJEHBATYFGX-IBGZPJMESA-N 285.325 1.238 5 50 CDBA CCN(CC(OC)OC)c1ccc([N+](=O)[O-])c(C)n1 1616038469 QIZPMLJQXSWCFF-UHFFFAOYSA-N 269.301 1.743 5 50 CDBA Cc1cc(N2CC[C@]3(CCCN3C)C2)ncc1[N+](=O)[O-] 952880568 BZMXHTIYBHUXQP-CQSZACIVSA-N 276.340 1.973 5 50 CDBA COc1cccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1 122551 KFYLNOYLFXNMLQ-PWSUYJOCSA-N 250.254 1.292 5 50 CDBA O=[N+]([O-])c1ccc(N2CCCC2)cc1NCCCO 4045588 BCTKQCQGINTGIP-UHFFFAOYSA-N 265.313 1.989 5 50 CDBA O=[N+]([O-])c1ccc([C@H](O)[C@H](CO)N2CCCCC2)cc1 96027513 PJWKHFUUONPSEU-KBPBESRZSA-N 280.324 1.475 5 50 CDBA CCOC(=O)c1nc2cc([N+](=O)[O-])ccc2c(=O)[nH]1 169105498 LKNRHKFKTSMVPE-UHFFFAOYSA-N 263.209 1.008 5 50 CDBA CC(C)[C@@H]1CNCCN1c1ccc([N+](=O)[O-])nc1 600947778 NNZDKNDGUNFMMC-NSHDSACASA-N 250.302 1.424 5 50 CDBA COc1cc([C@@H](C)O)c([N+](=O)[O-])cc1OCCCC(=O)O 2244334 DUIJUTBRRZCWRD-MRVPVSSYSA-N 299.279 1.900 5 50 CDBA in-vitro NNc1ncnc(NCc2ccccc2)c1[N+](=O)[O-] 4534917 FBFDGSAPWLEDDX-UHFFFAOYSA-N 260.257 1.283 5 50 CDBA CC(C)NS(=O)(=O)CCNc1ccccc1[N+](=O)[O-] 195248395 OOIRHFLJXQOYKG-UHFFFAOYSA-N 287.341 1.335 5 50 CDBA CN(C)CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 4953043 SBGZFCXNCZBHPF-UHFFFAOYSA-N 271.704 1.540 5 50 CDBA CN1C(=N)S/C(=C\c2cc([N+](=O)[O-])ccc2O)C1=O 18086667 OLLOOCVCFKZRGR-PPTIDMBMSA-N 279.277 1.781 5 50 CDBA Cc1ccnc(NCCCN2CCCOCC2)c1[N+](=O)[O-] 1776005328 HMCFFSOMZKOARE-UHFFFAOYSA-N 294.355 1.823 5 50 CDBA CCOC(=O)Cn1nc(-c2ccc([N+](=O)[O-])o2)sc1=O 1561292 YWVDILPFGWJRCW-UHFFFAOYSA-N 299.264 1.036 5 50 CDBA Nc1ncnc2c1cnn2-c1ccc([N+](=O)[O-])cc1 1680445 NFVAFEQWWNNKLX-UHFFFAOYSA-N 256.225 1.306 5 50 CDBA O=C1C[C@@H](N2CCCC2)C(=O)N1c1ccc([N+](=O)[O-])cc1 4948517 GWAZYKAMWYPQOU-GFCCVEGCSA-N 289.291 1.323 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)/C=C\C(=O)O 32650313 QRJLYPZBDPQQEO-PLNGDYQASA-N 250.210 1.483 5 50 CDBA Nc1cc2n(n1)CCCN(c1ccc(F)cc1[N+](=O)[O-])C2 952994939 XEYQWDWNSVKCNN-UHFFFAOYSA-N 291.286 1.923 5 50 CDBA COc1ccc(C(=O)NCc2cccnc2)cc1[N+](=O)[O-] 117072 KHYGBKABOFGPEU-UHFFFAOYSA-N 287.275 1.928 5 50 CDBA CCOC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 2936793 YOZDBDUMEDNZND-UHFFFAOYSA-N 268.225 1.105 5 50 CDBA Cc1c(C(=O)N2CCOCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3154510 NWRSNWTUZJLEIV-UHFFFAOYSA-N 295.251 1.284 5 50 CDBA Cc1nc(N[C@@H]2CC[C@H](CN)C2)ncc1[N+](=O)[O-] 420273248 LVRZGFFNYGUQIG-DTWKUNHWSA-N 251.290 1.233 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/C(=O)O 38717 MRKPTXZBUGDKNJ-SNAWJCMRSA-N 266.209 1.183 5 50 CDBA CCOC(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 37067734 CMBNAFSZAQQLAU-UHFFFAOYSA-N 293.323 1.280 5 50 CDBA Cc1ccc(CNC(=O)Cn2c([N+](=O)[O-])cnc2C)cc1 205442 PBEVLHMZGYDDOJ-UHFFFAOYSA-N 288.307 1.725 5 50 CDBA Cc1cc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)no1 1070959 HKAPGJLYQYFQPP-UHFFFAOYSA-N 279.256 1.343 5 50 CDBA CCN(C)c1ccccc1CNC(=O)[C@H]1C[C@H]1[N+](=O)[O-] 248269213 UVSWUELWOYFFON-WCQYABFASA-N 277.324 1.424 5 50 CDBA CCOc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 192532 SYGHDGQXOCINAK-UHFFFAOYSA-N 290.279 1.979 5 50 CDBA NS(=O)(=O)c1c(Cl)ccc(Cl)c1[N+](=O)[O-] 263624915 VDJLCVPXZZHMRZ-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA O=C(N[C@@H]1CCC[C@H]1CCO)c1ccc([N+](=O)[O-])s1 170601324 UVOOHKTUCANRIB-DTWKUNHWSA-N 284.337 1.937 5 50 CDBA CN(C)c1noc(CCNc2ncccc2[N+](=O)[O-])n1 170603366 GMTCJUHKGWSUQJ-UHFFFAOYSA-N 278.272 1.093 5 50 CDBA Cc1c(NC(=O)NCC2OCCCO2)cccc1[N+](=O)[O-] 584909011 NLKXPQWFRRBRLA-UHFFFAOYSA-N 295.295 1.788 5 50 CDBA COCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 4755777 VROMYHBDLUFVOV-UHFFFAOYSA-N 292.247 1.077 5 50 CDBA CC(C)[C@H]1C(C#N)(C#N)C(C#N)=C(N)[C@]1(C)[N+](=O)[O-] 22135326 MKNXHHJVJVVPHB-MWLCHTKSSA-N 259.269 1.078 5 50 CDBA COc1cc(C(=O)N2CCCC2)c([N+](=O)[O-])cc1OC 209665 DHZACFKEJZIZNX-UHFFFAOYSA-N 280.280 1.848 5 50 CDBA Nc1cc([N+](=O)[O-])ccc1I 1608858 VKQOHFHGWCXKOA-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA in-vitro O=[N+]([O-])c1cc(Br)cnc1N1CCNCC1 36226496 KEICYYFEZSTEIP-UHFFFAOYSA-N 287.117 1.162 5 50 CDBA in-vitro CC[S@](=O)CCNc1cc(N)ccc1[N+](=O)[O-] 800849355 CFSLSDOVARDXKU-KRWDZBQOSA-N 257.315 1.358 5 50 CDBA Cc1nn(CC(=O)NCc2cccnc2)c(C)c1[N+](=O)[O-] 1070846 MINNLRWNLCUMAI-UHFFFAOYSA-N 289.295 1.120 5 50 CDBA CSC[C@@](C)(O)CNc1cc([N+](=O)[O-])c(C)c[n+]1[O-] 225541083 FMSRVHTXIIRMOL-NSHDSACASA-N 287.341 1.063 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccccc1Cl 371788 KEEHLNJLCVMGQG-UHFFFAOYSA-N 294.698 1.761 5 50 CDBA CC(=O)Nc1cc([N+](=O)[O-])ccc1N1CCN(C)CC1 5049873 FSQBTKZGKQMDMQ-UHFFFAOYSA-N 278.312 1.305 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)CC(C)=O 5092771 AWRWFTFHIONLAG-UHFFFAOYSA-N 252.226 1.521 5 50 CDBA Cc1ccc(C(=O)N2CCC(C(N)=O)CC2)cc1[N+](=O)[O-] 447534 KYNQEYXSDMWSMX-UHFFFAOYSA-N 291.307 1.241 5 50 CDBA COC[C@@H](C)NC(=O)c1cccc(C)c1[N+](=O)[O-] 463450 SINSNMLSKXKHFE-SECBINFHSA-N 252.270 1.668 5 50 CDBA C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@H]1C[C@H]1[N+](=O)[O-] 251977234 DTXBDFLFWSFQOT-JFUSQASVSA-N 293.279 1.779 5 50 CDBA C[C@@H](c1nnc2n1CCCCC2)n1cc([N+](=O)[O-])cn1 72334101 IQSQOGBESYJNQB-VIFPVBQESA-N 276.300 1.719 5 50 CDBA CN(C)[C@@H](CNc1ncc([N+](=O)[O-])s1)C1CC1 241287097 LJVZKZQMAMWZIZ-QMMMGPOBSA-N 256.331 1.803 5 50 CDBA Nc1cccc(I)c1[N+](=O)[O-] 91252307 YURLZSSAVLKVNB-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA Nc1ccc(I)cc1[N+](=O)[O-] 12957450 QVCRSYXVWPPBFJ-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA in-vitro CN(C)C1CCN(c2ccc(C=O)c([N+](=O)[O-])c2)CC1 169725294 GYWLIIWNSNTXDM-UHFFFAOYSA-N 277.324 1.938 5 50 CDBA Cc1cc([N+](=O)[O-])nn1Cc1ccc(C(=O)O)cc1 368981 TWWPZZUZTIDIAY-UHFFFAOYSA-N 261.237 1.846 5 50 CDBA NS(=O)(=O)c1ccc(Nc2ncccc2[N+](=O)[O-])cc1 3880511 ORZXNZPUHIVGAL-UHFFFAOYSA-N 294.292 1.381 5 50 CDBA Cc1c(C(=O)OCCc2nncn2C)cccc1[N+](=O)[O-] 225855152 KQGQCRHENCVCEQ-UHFFFAOYSA-N 290.279 1.431 5 50 CDBA CC(C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 442634 DTSQPAOZFKCYDW-UHFFFAOYSA-N 272.326 1.919 5 50 CDBA O=c1cc[nH]c(/C=C/c2ccc(F)c([N+](=O)[O-])c2)n1 225732052 LLCRFKSLCMSCLL-DUXPYHPUSA-N 261.212 1.988 5 50 CDBA C[C@H](c1cccc([N+](=O)[O-])c1)n1cc(COCCO)nn1 2325827283 BFABSPATFAYUFK-SNVBAGLBSA-N 292.295 1.305 5 50 CDBA CN1C=C(C(=O)NCCC[N+](C)(C)C)C=C/C1=C\N=O 137772246 AWUFUPQZTBKRDK-JLHYYAGUSA-O 279.364 1.192 5 50 CDBA O=C(O)Cc1ccc(Br)c([N+](=O)[O-])c1 166519914 MLZLMIGRMVOYLK-UHFFFAOYSA-N 260.043 1.984 5 50 CDBA COC[C@H](C)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 455591 VRNCNFCVIZBIDN-QMMMGPOBSA-N 296.279 1.146 5 50 CDBA CC(=O)c1cc([N+](=O)[O-])ccc1NCC(C)(C)C(N)=O 253415404 HDDIIVQKJOHSSF-UHFFFAOYSA-N 279.296 1.721 5 50 CDBA O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC2CC3)nc1 1472900718 WEIWONFCKQMUKH-LLVKDONJSA-N 262.313 1.744 5 50 CDBA Cc1ccnc(NCCC[C@@H]2C=NNC2=O)c1[N+](=O)[O-] 521398653 WTRCQDFIUGRVQC-SECBINFHSA-N 277.284 1.222 5 50 CDBA CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@@H]1CCOC1 160290680 YZLZJGWIZWGHPZ-SECBINFHSA-N 266.253 1.161 5 50 CDBA Cc1ccnc(N2CC[C@@H](c3ncon3)C2)c1[N+](=O)[O-] 952880360 ALYHXMXGMAFVPM-SECBINFHSA-N 275.268 1.675 5 50 CDBA COc1cc(C(=O)N2CCOCC2)c([N+](=O)[O-])cc1OC 38996 HFSMXILHWHTYTG-UHFFFAOYSA-N 296.279 1.084 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1I 4365981 LOLSEMNGXKAZBZ-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA CNS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 119262573 NELKDSJGYIUOTL-UHFFFAOYSA-N 295.114 1.265 5 50 CDBA C[C@H]1CCOCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 119727165 ULJTUDBKOKGTEZ-VIFPVBQESA-N 280.280 1.551 5 50 CDBA COC(=O)c1cccc([N+](=O)[O-])c1N1CC(C)(OC)C1 585093046 ZMCKSSCSGNFLEL-UHFFFAOYSA-N 280.280 1.607 5 50 CDBA O=C(Cn1nnc2ccccc21)Nc1ccc([N+](=O)[O-])cc1 5669825 UXKPSIQTIDAFKA-UHFFFAOYSA-N 297.274 1.978 5 50 CDBA O=C(O)Cn1nc(C(F)F)c([N+](=O)[O-])c1C(F)F 12395837 IOSPMYFLEOGSNI-UHFFFAOYSA-N 271.126 1.751 5 50 CDBA CCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 4006702 HJFAPXHHSJMZAB-UHFFFAOYSA-N 258.299 1.673 5 50 CDBA O=[N+]([O-])c1ccc(Cl)c(CN2CCN(CCO)CC2)c1 4948290 DUPROKCYARFKFI-UHFFFAOYSA-N 299.758 1.358 5 50 CDBA COC(=O)[C@H](C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 32626943 PISQBNDMQJLRAL-LURJTMIESA-N 286.671 1.540 5 50 CDBA in-vitro C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1 127829043 ZOCMDCPIMYHBPW-GFCCVEGCSA-N 266.253 1.209 5 50 CDBA COCCNCCOc1ccc(C)cc1[N+](=O)[O-] 3000309 VUZUPIRXIUTTSM-UHFFFAOYSA-N 254.286 1.518 5 50 CDBA Cc1ccc([C@H]2N[C@@H](C(=O)O)CS2)cc1[N+](=O)[O-] 32988 XCCZFOBFTQIDBX-SCZZXKLOSA-N 268.294 1.691 5 50 CDBA Cc1cc(Sc2ncnc(N)c2[N+](=O)[O-])ncn1 3892557 CRZKXAVOSBDDBX-UHFFFAOYSA-N 264.270 1.217 5 50 CDBA O=C(O)CCCNC(=O)c1cccc([N+](=O)[O-])c1 2765636 VTORFDDFPJDQBJ-UHFFFAOYSA-N 252.226 1.189 5 50 CDBA C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)CN 262555622 XKSFWXGRWYKQNW-SECBINFHSA-N 297.380 1.929 5 50 CDBA CN(Cc1cccnc1)C(=O)c1cccc([N+](=O)[O-])c1O 157814515 FNQXTJZRDLDVMT-UHFFFAOYSA-N 287.275 1.968 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CCCNCC1 226461371 FHHZJANUXKSFJB-SNVBAGLBSA-N 299.352 1.015 5 50 CDBA C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 2829681 JYORBNUHGKBRNJ-GHMZBOCLSA-N 278.308 1.773 5 50 CDBA CN1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 3877865 HMNVCTLPNUWCPO-UHFFFAOYSA-N 272.308 1.895 5 50 CDBA CON(C)C(=O)[C@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 218115611 KGXGWVIKULLBRL-QWRGUYRKSA-N 250.254 1.718 5 50 CDBA COCCCNc1ccc(C(N)=O)cc1[N+](=O)[O-] 5050290 GIHMWBLWVWFFNK-UHFFFAOYSA-N 253.258 1.142 5 50 CDBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 12417944 HWYYUVZSWZFHEI-AOOOYVTPSA-N 264.281 1.844 5 50 CDBA CCOC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 198671 CFYBVBIJEKTNSZ-UHFFFAOYSA-N 296.279 1.603 5 50 CDBA CS(=O)(=O)c1cc([N+](=O)[O-])c(Br)cc1F 95496058 BGECMANMRHXGNN-UHFFFAOYSA-N 298.089 1.900 5 50 CDBA O=C(Cn1ccnc1[N+](=O)[O-])N1CCC[C@H]2CCCC[C@H]21 585133052 PJAJELDKOCFWJO-VXGBXAGGSA-N 292.339 1.973 5 50 CDBA O=C(O)c1ccc(I)cc1[N+](=O)[O-] 16698051 IZBFYNYRKIUGSG-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro O=[N+]([O-])c1ccc(N2CCNCC2)cc1N1CCCCC1 4344178 IEZDTNCUMWPRTD-UHFFFAOYSA-N 290.367 1.995 5 50 CDBA COc1cc([N+](=O)[O-])cc2onc(C3OCCO3)c12 32752 GXIRYYVEJARDHL-UHFFFAOYSA-N 266.209 1.790 5 50 CDBA C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)CN 262555623 XKSFWXGRWYKQNW-VIFPVBQESA-N 297.380 1.929 5 50 CDBA Nc1cccc([N+](=O)[O-])c1I 198357224 MNCRWCXZMAPTQW-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA CCn1nnc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)n1 557574 WXXLOFFTOGNLJI-UHFFFAOYSA-N 276.256 1.162 5 50 CDBA CCOc1ccc(N2C(=O)C=CC2=O)c([N+](=O)[O-])c1 5034864 OFAKXRLICZCZPP-UHFFFAOYSA-N 262.221 1.423 5 50 CDBA Cc1cc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])no1 68337 QFEDDNGWUIKTEP-UHFFFAOYSA-N 283.265 1.692 5 50 CDBA O=[N+]([O-])c1ccc2n[nH]cc2c1NC[C@@H]1CCOC1 1775999171 OWJWFRWINYOVNH-QMMMGPOBSA-N 262.269 1.920 5 50 CDBA CO[C@]1(C)CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 230285593 JKPJROGOYPVGPG-CQSZACIVSA-N 293.323 1.818 5 50 CDBA C[C@H]1CC(=O)N(Cc2c(F)cc([N+](=O)[O-])cc2F)C1=O 408518607 PWFDDPOPGMGPQU-LURJTMIESA-N 284.218 1.768 5 50 CDBA Cc1ccnc(N2CCC[C@@](O)(CN(C)C)C2)c1[N+](=O)[O-] 585092431 WNCIVIWTGJPORU-CQSZACIVSA-N 294.355 1.191 5 50 CDBA Cc1ccc(OCCN2CCNCC2)c([N+](=O)[O-])c1 4480168 GLZLBFJDJDTYHC-UHFFFAOYSA-N 265.313 1.187 5 50 CDBA O=C(NCc1cccnc1)c1ccccc1[N+](=O)[O-] 299509 JAFATDRGTMWFAM-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA O=C(NCCOCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 4717777 HYRUGIUWLDAVFJ-UHFFFAOYSA-N 292.213 1.904 5 50 CDBA CN1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 54975179 CTYNEKWYUBCOJB-VOTSOKGWSA-N 275.308 1.382 5 50 CDBA O=C(O)[C@H]1CCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O1 71778213 YYULGVYLSQGCRW-MRVPVSSYSA-N 268.181 1.281 5 50 CDBA CCN(C[C@@H]1CCOC1)C(=O)c1ccc([N+](=O)[O-])c(O)c1 169971416 MRBKJZSKCQSWSO-JTQLQIEISA-N 294.307 1.799 5 50 CDBA CC(C)(CO)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 533174 KVAFTQANPIPGOD-VOTSOKGWSA-N 264.281 1.495 5 50 CDBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@H]1CCCO1 464391 POJZUVGLJGSOGO-ABZNLYFFSA-N 276.292 1.903 5 50 CDBA Cc1ccc(S(=O)(=O)NC(C)C)cc1[N+](=O)[O-] 3996082 QZMPGPWLHONTIX-UHFFFAOYSA-N 258.299 1.590 5 50 CDBA CCC(=O)NC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 952874735 AFESTEJBFINNFQ-UHFFFAOYSA-N 292.339 1.793 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)NC1CCCCCC1 1430192 UWNLHZVBXWFSOE-UHFFFAOYSA-N 280.328 1.939 5 50 CDBA Cc1cc(C)n(C[C@H](O)COc2ccccc2[N+](=O)[O-])n1 449099 IOVJOXZKFTZDAO-LBPRGKRZSA-N 291.307 1.848 5 50 CDBA COC[C@H](C)NC(=O)c1cccc(C)c1[N+](=O)[O-] 463449 SINSNMLSKXKHFE-VIFPVBQESA-N 252.270 1.668 5 50 CDBA Cc1cn2nc(NCCn3cc([N+](=O)[O-])cn3)sc2n1 269099581 QQVMRQPPJWQRHK-UHFFFAOYSA-N 293.312 1.316 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCN(c3ccccn3)CC2)o1 22591573 SCOROAHHMUIRMK-UHFFFAOYSA-N 288.307 1.905 5 50 CDBA C[C@@H]1CCC(C)(C)N1C(=O)Cn1cc([N+](=O)[O-])cn1 408520305 LGUJCEUTLPTYBI-SECBINFHSA-N 266.301 1.581 5 50 CDBA COc1cc(C(=O)N[C@H](C)CCC(=O)O)ccc1[N+](=O)[O-] 165374820 KQOVFOIFORXHNM-MRVPVSSYSA-N 296.279 1.587 5 50 CDBA CCC1(CC)CNC(=O)[C@H]1Nc1ncccc1[N+](=O)[O-] 929084562 BEEGVYPGPQDBOR-SNVBAGLBSA-N 278.312 1.707 5 50 CDBA CC[C@H](O)[C@H]1CC(c2ccc([N+](=O)[O-])cc2)=NO1 4576761 MFUIMKPWEBKXMS-NWDGAFQWSA-N 250.254 1.859 5 50 CDBA Cc1nc(N2CCC(C)CC2)nc(N)c1[N+](=O)[O-] 4951948 ZVOGSHACNRBWGD-UHFFFAOYSA-N 251.290 1.512 5 50 CDBA O=C(COc1ccc([N+](=O)[O-])cc1)N1CCCC1 38535 UQYFUARYMROWQH-UHFFFAOYSA-N 250.254 1.596 5 50 CDBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCC1 2872558 QSDCIZYNHKADMG-SNVBAGLBSA-N 264.281 1.985 5 50 CDBA Cc1ccc(OCCCCNCCN)c([N+](=O)[O-])c1 3000937 FCDRPLHEZGVPDI-UHFFFAOYSA-N 267.329 1.611 5 50 CDBA CN1C(=S)C(=N)O[C@H]1c1cccc([N+](=O)[O-])c1 4828292 PRSARNBEOCUELF-VIFPVBQESA-N 251.267 1.860 5 50 CDBA O=[N+]([O-])c1cc(I)ccc1CO 114785053 DMOPRQSYYMKIHH-UHFFFAOYSA-N 279.033 1.692 5 50 CDBA CCC[C@H](NCCOc1ccc([N+](=O)[O-])cc1)C(=O)O 185050520 HAHIQAKVYGBHMB-LBPRGKRZSA-N 282.296 1.817 5 50 CDBA O=C(NC(=S)N1CCCC1)c1cccc([N+](=O)[O-])c1 314870 ALQUINSYHFFWIJ-UHFFFAOYSA-N 279.321 1.705 5 50 CDBA Nc1cc(=O)[nH]c(SCc2ccc([N+](=O)[O-])cc2)n1 18247558 RJJRKEFSOZXOAZ-UHFFFAOYSA-N 278.293 1.553 5 50 CDBA O=c1c2ccccc2c(O)nn1-c1ccc([N+](=O)[O-])cc1 50262 POOVNRMVMWCFKK-UHFFFAOYSA-N 283.243 2.000 5 50 CDBA C[C@@H]1COCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164177575 OTOVZGUSDNKXGG-MRVPVSSYSA-N 266.253 1.161 5 50 CDBA O=C(N[C@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 71773940 AURNBJUNLCGYMJ-WDEREUQCSA-N 250.254 1.238 5 50 CDBA CCOC(=O)[C@@H](C(C)=O)c1ccc(N)cc1[N+](=O)[O-] 4530444 YDHOUFMUOSRUKJ-NSHDSACASA-N 266.253 1.413 5 50 CDBA CSC[C@](C)(O)CNc1cc([N+](=O)[O-])c(C)c[n+]1[O-] 225541048 FMSRVHTXIIRMOL-LLVKDONJSA-N 287.341 1.063 5 50 CDBA Cn1cc(C(=O)c2ccc([N+](=O)[O-])cc2)cc1C=O 166259 NXKMAVMESJKNLK-UHFFFAOYSA-N 258.233 1.977 5 50 CDBA in-vitro C[C@H](CO)Nc1ccc([N+](=O)[O-])cc1OC(F)F 165411039 GRPVNUOVJQIWEN-ZCFIWIBFSA-N 262.212 1.989 5 50 CDBA Cc1ccnc(N2CC(OCCF)C2)c1[N+](=O)[O-] 585092273 MNPXOVLTHZAFBJ-UHFFFAOYSA-N 255.249 1.473 5 50 CDBA Nc1ncnc(NCc2ccc(F)cc2)c1[N+](=O)[O-] 3912520 UKYAYHWQKUXKOL-UHFFFAOYSA-N 263.232 1.718 5 50 CDBA COc1ncc(Cn2c([N+](=O)[O-])cnc2C)c(C)n1 347701744 RZKXVPGNUSXSSP-UHFFFAOYSA-N 263.257 1.255 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)NC1CCCCCC1 4386103 SARSEIXSOIASEH-UHFFFAOYSA-N 280.328 1.939 5 50 CDBA CC(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 4561544 DPQRIWLUJSSAEE-UHFFFAOYSA-N 283.715 1.917 5 50 CDBA COCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 2088298 PXIAEPFENXKROM-UHFFFAOYSA-N 258.661 1.624 5 50 CDBA CC(=O)c1ccc(N[C@@H]2COC(=O)C2)c([N+](=O)[O-])c1 408518720 WGZRKZXBVRSYKB-VIFPVBQESA-N 264.237 1.525 5 50 CDBA COc1cccc(Nc2ncnc(N)c2[N+](=O)[O-])c1 3912554 HXDOGWXLDBRUIP-UHFFFAOYSA-N 261.241 1.719 5 50 CDBA Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)NCc1ccco1 300165 VFDJOWRKMAQVTJ-UHFFFAOYSA-N 298.686 1.663 5 50 CDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](N2CCCC2)CC1 229904374 MMBKPZLIMAEUCO-JHJVBQTASA-N 281.356 1.129 5 50 CDBA CN1CCCC[C@@H]1CCSc1ncc([N+](=O)[O-])c(=N)[nH]1 521394974 JXHDLFCMZDUPPP-SECBINFHSA-N 297.384 1.764 5 50 CDBA Cn1ccc([C@@H]2C[C@H]2Nc2ccc([N+](=O)[O-])cn2)n1 1775989585 QCPWGJHOEXSQSD-GXSJLCMTSA-N 259.269 1.691 5 50 CDBA C[C@H](NC(=O)NC(=O)c1cccc([N+](=O)[O-])c1)C1CC1 2900808 RMSLASNQTWYYQO-QMMMGPOBSA-N 277.280 1.833 5 50 CDBA O=C(O)c1c(N2CCOCC2)ccc([N+](=O)[O-])c1Cl 536953921 LTZBINQKEDJHNT-UHFFFAOYSA-N 286.671 1.783 5 50 CDBA O=C(N[C@H]1CC=CCC1)c1cnc(O)c([N+](=O)[O-])c1 193601181 QEJSMOMGTHDMDS-VIFPVBQESA-N 263.253 1.534 5 50 CDBA COC(=O)/C=C/S(=O)(=O)c1ccc([N+](=O)[O-])cc1 5510642 RSCZGJWVZORLAL-VOTSOKGWSA-N 271.250 1.055 5 50 CDBA COCCN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1 169959935 JKLYBUJBBANHTK-UHFFFAOYSA-N 254.242 1.019 5 50 CDBA NS(=O)(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 59417660 MBLDYEXWNFSKAI-UHFFFAOYSA-N 278.289 1.909 5 50 CDBA CC(=O)c1ccc(N2CC(CN(C)C)C2)c([N+](=O)[O-])c1 382237181 AHYVWJXWIJJRIE-UHFFFAOYSA-N 277.324 1.795 5 50 CDBA O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOCC1 83666 BZSCJBRBFREOTK-UHFFFAOYSA-N 270.672 1.721 5 50 CDBA O=C1Nc2ccc([N+](=O)[O-])cc2[C@]1(O)N1CCCCC1 4155871 YNAYNLVTESDOLF-CYBMUJFWSA-N 277.280 1.178 5 50 CDBA C[C@@H]1[C@H]2CCCN2CCN1Cc1ccc(O)c([N+](=O)[O-])c1 22078415 FTITUJQJYXKYKM-DGCLKSJQSA-N 291.351 1.969 5 50 CDBA NCC1(NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCCC1 111832674 DFMGDRRVJMDCPI-UHFFFAOYSA-N 299.352 1.145 5 50 CDBA O=C1[C@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2O1 244866556 VYHCUDLEIGISHF-DDHJBXDOSA-N 286.243 1.038 5 50 CDBA COc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 19093947 JANBLAADNZANNL-LURJTMIESA-N 269.209 1.268 5 50 CDBA O=[N+]([O-])c1ccccc1OCCCN1CCOCC1 19607355 VQZSRUVSNOEJHB-UHFFFAOYSA-N 266.297 1.696 5 50 CDBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCCO1 375709 AYUPVFAVNLZROP-SNVBAGLBSA-N 254.217 1.851 5 50 CDBA Cc1ccc(C(=O)NCc2cnn(C)c2C)cc1[N+](=O)[O-] 371059 GVZOIEVDHKWXSJ-UHFFFAOYSA-N 288.307 1.875 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@@H](C)C[C@H](C)N)c1[N+](=O)[O-] 520815205 BFTCFEAQEGJFPY-YUMQZZPRSA-N 283.332 1.126 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 5041474 UAWVQXHNCPBOGA-UHFFFAOYSA-N 270.310 1.688 5 50 CDBA CNC(=O)[C@H]1CCCCN1c1ccc([N+](=O)[O-])cn1 1615588144 XJBAEZQKKCIBLJ-SNVBAGLBSA-N 264.285 1.095 5 50 CDBA CCOc1ccc(NC2=C([N+](=O)[O-])CS(=O)(=O)C2)cc1 297605 ZDUVTLVWULIOLG-UHFFFAOYSA-N 298.320 1.414 5 50 CDBA O=C(CSc1ncn[nH]1)Nc1ccccc1[N+](=O)[O-] 4844781 JDRCMLVBMHIQAU-UHFFFAOYSA-N 279.281 1.444 5 50 CDBA O=C1C[C@H](N2CCCC2)C(=O)N1c1ccc([N+](=O)[O-])cc1 22016028 GWAZYKAMWYPQOU-LBPRGKRZSA-N 289.291 1.323 5 50 CDBA COc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 37044 VRWPBVMXBBMYIO-UHFFFAOYSA-N 276.252 1.439 5 50 CDBA Cn1ccs/c1=N\C(=O)c1ccc(O)c([N+](=O)[O-])c1 164454821 WPPJTEBLWLAYRR-QXMHVHEDSA-N 279.277 1.442 5 50 CDBA CCN(CC)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4006861 YGHFQKUPFLTGIF-UHFFFAOYSA-N 272.326 1.934 5 50 CDBA O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 225397992 RHTXPNZOIRDFBU-GAIPPQHRSA-N 277.280 1.172 5 50 CDBA C[C@@H]1CC(O)C[C@@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1 170605833 HNWOWMCAJDWGCQ-GHMZBOCLSA-N 292.335 1.898 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCN2CCNCC2)c1 4986387 UCIOPBNGIYMPAF-UHFFFAOYSA-N 265.313 1.187 5 50 CDBA O=C(O)CCCC(=O)Nc1ccc(F)c([N+](=O)[O-])c1 2167914 LBLRATLCTKTLKB-UHFFFAOYSA-N 270.216 1.927 5 50 CDBA CCN1CCN(c2ccc3nsnc3c2[N+](=O)[O-])CC1 3897563 KFJPFBFAOOXWNZ-UHFFFAOYSA-N 293.352 1.741 5 50 CDBA O=C(O)[C@@H]1C[C@@H](Cc2ccccc2[N+](=O)[O-])CN1 4241395 OETHXWXQNOKWOM-SCZZXKLOSA-N 250.254 1.200 5 50 CDBA O=C(NCC[C@@H]1CCCCO1)c1ccc(O)c([N+](=O)[O-])c1 119785123 IKTYGSHSLUAECH-NSHDSACASA-N 294.307 1.989 5 50 CDBA Cc1cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)nn1C 1054062 WUQJICQZMVXKLK-UHFFFAOYSA-N 288.307 1.496 5 50 CDBA C[C@@H](NCC(=O)N1CCOCC1)c1ccccc1[N+](=O)[O-] 253393941 YYZVHXZBOWACOP-LLVKDONJSA-N 293.323 1.104 5 50 CDBA N[C@@H]1CCC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 124981556 RBTOVHWKCCAALK-ZJUUUORDSA-N 299.352 1.143 5 50 CDBA O=[N+]([O-])c1cccc2c(N3CCOCC3)ccnc12 4629010 YHBDEISEYCJNRG-UHFFFAOYSA-N 259.265 1.980 5 50 CDBA Cc1cc(NC(=O)c2nn(C)c(C)c2[N+](=O)[O-])no1 375968 IACFVRJZILONOT-UHFFFAOYSA-N 265.229 1.185 5 50 CDBA O=[N+]([O-])c1cccc2ccc(N3CCOCC3)nc12 4754607 NPRXCEZJOJIUJD-UHFFFAOYSA-N 259.265 1.980 5 50 CDBA Cc1nn(Cc2nnc3n2CCCCC3)cc1[N+](=O)[O-] 72334159 FUGGNVATCHQBRC-UHFFFAOYSA-N 276.300 1.466 5 50 CDBA O=C1CCC[C@@H]2[C@H]3CCC[N@@+]4([O-])CCC[C@@H](CN12)[C@@H]34 238809611 XVPBINOPNYFXID-KAHWEZKRSA-N 264.369 1.884 5 50 CDBA biogenic,in-vitro COC[C@H](Nc1ncccc1[N+](=O)[O-])C1CCOCC1 585092977 WUCZAHJOLZTYBI-NSHDSACASA-N 281.312 1.843 5 50 CDBA Cc1nc(N2CCC[C@H](C3=NCCN3)C2)ccc1[N+](=O)[O-] 1775992112 XJYAZWAFYPLPMI-NSHDSACASA-N 289.339 1.516 5 50 CDBA CS(=O)(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 1218405 QMUPVLWZTBOZNA-UHFFFAOYSA-N 273.295 1.576 5 50 CDBA O=[N+]([O-])c1cc(CN2CCC[C@H](CO)C2)ccc1O 23280482 YWVCIBCGNOKLKZ-NSHDSACASA-N 266.297 1.505 5 50 CDBA CC1(O)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 170613529 MDQKZHLAENHTOD-UHFFFAOYSA-N 285.687 1.847 5 50 CDBA O=C1CSCC(=O)N1c1cccc([N+](=O)[O-])c1 2506185 NVSFWMXQKRIQFA-UHFFFAOYSA-N 252.251 1.201 5 50 CDBA CCOc1ccc(NC(=O)CCC(=O)O)c([N+](=O)[O-])c1 4628459 LVNUJOFBQCYFTI-UHFFFAOYSA-N 282.252 1.797 5 50 CDBA CCc1ccc(NC(=O)Cn2cnc([N+](=O)[O-])c2)cc1 823951 FBPBFVJADBHYHQ-UHFFFAOYSA-N 274.280 1.992 5 50 CDBA O=C(O)c1cc(-c2cc([N+](=O)[O-])ccc2F)[nH]n1 725264742 SMMCRNAQLDPPCI-UHFFFAOYSA-N 251.173 1.822 5 50 CDBA Cc1cc(N2CCc3c(O)nn(C)c3C2)ccc1[N+](=O)[O-] 585132771 UOQOJLMMSHMWJN-UHFFFAOYSA-N 288.307 1.905 5 50 CDBA CCC[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)C(=O)O 185050536 HAHIQAKVYGBHMB-GFCCVEGCSA-N 282.296 1.817 5 50 CDBA C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ncnn1C 170608515 BYTGQUXCTKEACQ-LURJTMIESA-N 281.297 1.276 5 50 CDBA O=[N+]([O-])c1ccc(NCCNCCO)c2ncccc12 4045572 BXHJGTQQLRRSJI-UHFFFAOYSA-N 276.296 1.137 5 50 CDBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(C)C 70247437 DJVOBSOAHSUGEY-UHFFFAOYSA-N 274.298 1.290 5 50 CDBA Cc1cc([N+](=O)[O-])nn1Cc1nnnn1-c1ccccc1 170619294 CMTJCHSCBJEREI-UHFFFAOYSA-N 285.267 1.124 5 50 CDBA Nc1c(C(=O)NC2CCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3878385 FHZSEZIZPXVGDS-UHFFFAOYSA-N 294.267 1.758 5 50 CDBA C[C@H](O)CNc1cc(N2CCCC2)ccc1[N+](=O)[O-] 4003290 SPSPZOVABAKXAR-JTQLQIEISA-N 265.313 1.988 5 50 CDBA CCCNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 5045875 LGVAAFDSZVYNED-UHFFFAOYSA-N 278.717 1.937 5 50 CDBA O=C(NCCC1=CCOCC1)c1ccc(O)c([N+](=O)[O-])c1 164998753 XCUASXPJFDGUJS-UHFFFAOYSA-N 292.291 1.767 5 50 CDBA O=C(NC[C@H]1CCSC1)c1cc([N+](=O)[O-])ccc1O 279731318 JIBHPVYRZOPRNO-MRVPVSSYSA-N 282.321 1.783 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@H]1c1ccc([N+](=O)[O-])cc1 256306 XVIOCUMPZRUXAE-NSHDSACASA-N 290.275 1.645 5 50 CDBA COC(=O)C1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 457044 CTYWZYQPCCWRNL-UHFFFAOYSA-N 292.291 1.620 5 50 CDBA O=[N+]([O-])c1c(NC[C@H]2CCCO2)ccc2nonc12 4131799 RNTJBBPIEFZPLT-SSDOTTSWSA-N 264.241 1.722 5 50 CDBA Cc1ccc(NC(=O)c2ccnc(N)c2[N+](=O)[O-])c(O)c1 241383268 MTUSCKKAHFEZLS-UHFFFAOYSA-N 288.263 1.838 5 50 CDBA C[Si](C)(C)c1nnn(-c2ccc([N+](=O)[O-])cc2)c1C=O 195820130 QUMOSOMCEKENFG-UHFFFAOYSA-N 290.355 1.533 5 50 CDBA CCOC[C@H](O)COc1c(C)cc(C)cc1[N+](=O)[O-] 193824707 VSICKHPOXWEFDP-NSHDSACASA-N 269.297 1.988 5 50 CDBA C[C@H]1OC[C@@H]2[C@@H](c3ccc([N+](=O)[O-])cc3)N(C)O[C@H]2CO1 247996989 DJCIBOAHTWGRGS-NZPIUUIZSA-N 294.307 1.891 5 50 CDBA O=C(O)c1cc(-n2ccnc2)c(F)cc1[N+](=O)[O-] 42684297 MRXQKKIAHFIDNX-UHFFFAOYSA-N 251.173 1.618 5 50 CDBA in-vitro C[C@H](N)[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 135236998 KLUNMTGYVKYXBY-WCQYABFASA-N 291.351 1.723 5 50 CDBA CC(C)OCCN(C)C(=O)c1c(N)cccc1[N+](=O)[O-] 252540571 PMZRCEKYIZFKKB-UHFFFAOYSA-N 281.312 1.674 5 50 CDBA C[C@@H](NC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)O 40545255 XSCVYCGATHCQFJ-ZCFIWIBFSA-N 253.214 1.189 5 50 CDBA biogenic,in-vitro O=[N+]([O-])c1cccnc1NCCS(=O)(=O)C(F)(F)F 585092756 MQBIGNHGVAVFBW-UHFFFAOYSA-N 299.230 1.336 5 50 CDBA O=C(O)CSc1ccc([N+](=O)[O-])c2nonc12 2944612 PRBSYBDYLHMABV-UHFFFAOYSA-N 255.211 1.308 5 50 CDBA CO[C@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H]1OC 234757334 CJNSEXMRGCUQSS-TXEJJXNPSA-N 298.270 1.220 5 50 CDBA Cc1nn(CC(=O)Nc2cccc(O)c2)c(C)c1[N+](=O)[O-] 429970 XLADKHBPWDMSJZ-UHFFFAOYSA-N 290.279 1.752 5 50 CDBA C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 445353 DNSKBCPNYHYFTR-GHMZBOCLSA-N 278.308 1.773 5 50 CDBA CCCCSC[C@@H]1Cn2nc([N+](=O)[O-])nc2O1 2496765 KFJIWSFOZDOGLI-ZETCQYMHSA-N 258.303 1.481 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CCc2c(O)nn(C)c2C1 585132599 DGOHAPZKEPWEGI-UHFFFAOYSA-N 289.295 1.300 5 50 CDBA CC(C)NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 5074121 QMAZUDVLWSCNIP-UHFFFAOYSA-N 269.282 1.042 5 50 CDBA Cc1cnc(=O)n(CCCOc2ccc([N+](=O)[O-])cc2)c1 253419729 RLNAUTNPUZMTMX-UHFFFAOYSA-N 289.291 1.929 5 50 CDBA CS(=O)(=O)Nc1c(Cl)cccc1[N+](=O)[O-] 675050635 NJLIFWGVKUJUTI-UHFFFAOYSA-N 250.663 1.620 5 50 CDBA CN1CC[C@@H]2CN(C(=O)c3csc([N+](=O)[O-])c3)C[C@@H]21 408472091 YVKOAVNYSNNQPP-SCZZXKLOSA-N 281.337 1.432 5 50 CDBA C[C@@H]1OCC[C@]12CN(Cc1cccc([N+](=O)[O-])c1)CCO2 280520186 RUUBJRNFDVDGFS-WFASDCNBSA-N 292.335 1.975 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@@H]([C@H](O)C(F)(F)F)C2)cn1 450885807 VICVZIUQHRHQKJ-XCBNKYQSSA-N 291.229 1.739 5 50 CDBA O=C(CCc1cccc([N+](=O)[O-])c1)NC1(C(=O)O)CC1 238080574 QYPZWRFDONCGEP-UHFFFAOYSA-N 278.264 1.261 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N[C@H]2C(=O)NCC[C@H]2C)c1 193521081 DPMHQENPDNDFIP-BXKDBHETSA-N 263.297 1.840 5 50 CDBA CC(=O)N1CCN(c2cc(C)c([N+](=O)[O-])cc2F)CC1 3998670 BLAGHULHIRUZAZ-UHFFFAOYSA-N 281.287 1.711 5 50 CDBA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 225385011 HRCNYRYYTNHPKZ-OUAUKWLOSA-N 280.328 1.732 5 50 CDBA CN(C)[C@@H]1COC(=O)O[C@H]1c1ccc([N+](=O)[O-])cc1 217041309 JVHRFDUBKQWSDL-MNOVXSKESA-N 266.253 1.733 5 50 CDBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCCOCC1 169968600 XLFZXOOHNDNZKH-UHFFFAOYSA-N 266.253 1.163 5 50 CDBA NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2[nH]1 5819079 UVTRXKJFSCMLHJ-UHFFFAOYSA-N 252.255 1.049 5 50 CDBA NC(=O)c1[nH]c2ccc([N+](=O)[O-])cc2c1CCCC(=O)O 1775971543 UKRFSZCDPINXOU-UHFFFAOYSA-N 291.263 1.582 5 50 CDBA Cn1nc([N+](=O)[O-])nc1Sc1nc2ccccc2n1C 89984 ZCNYFGQARSSVFK-UHFFFAOYSA-N 290.308 1.761 5 50 CDBA O=[N+]([O-])c1cnc(N2CCOCC2)c(Br)c1 38537070 RUDIJMQSMFYHSD-UHFFFAOYSA-N 288.101 1.589 5 50 CDBA in-vitro O=C(Nc1ccc(O)c([N+](=O)[O-])c1)C1=CCCCO1 166185037 YBFHSHCBTOHHGG-UHFFFAOYSA-N 264.237 1.933 5 50 CDBA Cc1ccnc(N2CCC[C@](O)(CN(C)C)C2)c1[N+](=O)[O-] 585092430 WNCIVIWTGJPORU-AWEZNQCLSA-N 294.355 1.191 5 50 CDBA COCCNC(=S)Nc1ccc([N+](=O)[O-])cc1C 13497334 QZBQBCNBLPFBTN-UHFFFAOYSA-N 269.326 1.836 5 50 CDBA O=C1Nc2ccc([N+](=O)[O-])cc2[C@@]1(O)N1CCCCCC1 5015563 IJKZPJDBFDPZMA-AWEZNQCLSA-N 291.307 1.568 5 50 CDBA CC(C)(C(=O)O)S(=O)(=O)c1ccccc1[N+](=O)[O-] 95218054 NAEVYVZCUKBQKR-UHFFFAOYSA-N 273.266 1.232 5 50 CDBA in-vitro CC(C)N1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 5059444 JUGCYVQAMIGXEP-JTQLQIEISA-N 291.307 1.790 5 50 CDBA CCOC(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19633538 JDBDWCLWWZQKBD-UHFFFAOYSA-N 293.323 1.869 5 50 CDBA O=C(O)CCCC(=O)Nc1ccc([N+](=O)[O-])cc1 4425721 LFUGLIZRNPFEON-UHFFFAOYSA-N 252.226 1.788 5 50 CDBA Cc1nc(N2C[C@H]3CCN(C)C[C@H]3C2)ccc1[N+](=O)[O-] 601184109 HJNNPIXNWKSRSK-NEPJUHHUSA-N 276.340 1.686 5 50 CDBA CN(C)[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cn2)C12CCC2 585117973 LEPUATLFOQZHGG-MNOVXSKESA-N 277.328 1.670 5 50 CDBA CCOC(=O)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19632946 VJNBZBBQNJJHLT-UHFFFAOYSA-N 293.323 1.869 5 50 CDBA NC(=O)c1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1 335468 MOHDDECYHGSHBH-UHFFFAOYSA-N 285.259 1.946 5 50 CDBA Cc1ccc(C(=O)NC[C@@H](C)CN(C)C)cc1[N+](=O)[O-] 2935528 QEAVLLDXMJVFPM-SNVBAGLBSA-N 279.340 1.831 5 50 CDBA CN(C)C(=O)OCCN1CCc2ccc([N+](=O)[O-])cc2C1 158883903 OUTCMRKVWRBPEJ-UHFFFAOYSA-N 293.323 1.651 5 50 CDBA COCCCN(c1ccccc1[N+](=O)[O-])S(C)(=O)=O 252496798 PSABQYAQENCZDC-UHFFFAOYSA-N 288.325 1.397 5 50 CDBA CN1CC[C@@]2(CCCN(c3ncccc3[N+](=O)[O-])C2)C1 585092010 AMFUOWBTZWBSGJ-AWEZNQCLSA-N 276.340 1.912 5 50 CDBA O=C(OCCN1CCOCC1)c1ccc([N+](=O)[O-])cc1 19535302 BBTAQXPSLIPHOJ-UHFFFAOYSA-N 280.280 1.084 5 50 CDBA CCCc1[nH]nc(C(=O)N2C[C@H](CN)C[C@@H]2C)c1[N+](=O)[O-] 261900852 WPMQAIPRZJOIJU-IUCAKERBSA-N 295.343 1.080 5 50 CDBA O=C1NC(=O)/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)S1 975832 NIKHJYBOXDDCAS-XNWCZRBMSA-N 294.244 1.647 5 50 CDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1 4179345 MKUHRNFZJODRNV-MRVPVSSYSA-N 266.257 1.301 5 50 CDBA in-vitro CC(=O)c1cccc(Nc2ncnc(N)c2[N+](=O)[O-])c1 3912562 DRIFUVZNKBVWMF-UHFFFAOYSA-N 273.252 1.913 5 50 CDBA Cc1cc(C)c(S(=O)(=O)n2cnc([N+](=O)[O-])n2)c(C)c1 115199 SFYDWLYPIXHPML-UHFFFAOYSA-N 296.308 1.349 5 50 CDBA biogenic,in-vitro N[C@H]1CCC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 124980945 RBTOVHWKCCAALK-VHSXEESVSA-N 299.352 1.143 5 50 CDBA COC[C@H]1CN(c2c(Cl)cncc2[N+](=O)[O-])CCO1 408516815 GIQKWZZKCWWCFA-MRVPVSSYSA-N 287.703 1.495 5 50 CDBA O=C(NC[C@@H]1CCCNC1)c1ccc([N+](=O)[O-])cc1Cl 237811512 GEQBZSONGMGOSP-SECBINFHSA-N 297.742 1.978 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-] 81295 DUGMRWWBMORGRS-JTQLQIEISA-N 290.275 1.645 5 50 CDBA CN(C)c1ccc(NC2=C([N+](=O)[O-])CS(=O)(=O)C2)cc1 297134 OHWVTHZEJBUEKL-UHFFFAOYSA-N 297.336 1.081 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)c2ccco2)c([N+](=O)[O-])c1 4543029 QRRXSVSPTGGQLW-UHFFFAOYSA-N 298.232 1.929 5 50 CDBA CCOC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 4782840 LJLACWKNDNQPQD-UHFFFAOYSA-N 253.210 1.349 5 50 CDBA O=C(c1ccc(Cn2cc([N+](=O)[O-])cn2)o1)N1CCCC1 375987 MRQFAIMFOHDNMZ-UHFFFAOYSA-N 290.279 1.669 5 50 CDBA COCCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 2870835 IMLXTQXZLDPQLN-UHFFFAOYSA-N 258.661 1.624 5 50 CDBA C[C@H]1CN(c2c[n+]([O-])ccc2[N+](=O)[O-])C[C@H](C2CC2)O1 408523232 QGTXUESSMXJFAV-TVQRCGJNSA-N 279.296 1.232 5 50 CDBA Cc1c(CC(=O)OCCn2cccn2)cccc1[N+](=O)[O-] 170684227 YSKXKAPTQWWLJX-UHFFFAOYSA-N 289.291 1.886 5 50 CDBA O=c1cc(N2CCOCC2)nc2c3ccccc3ccn12 13608047 BVRDQVRQVGRNHG-UHFFFAOYSA-N 281.315 1.684 5 50 CDBA in-vivo CC[N+](C)(CC)C[C@H]1CO[C@H](C[N+](C)(CC)CC)CO1 225655 FROPDBPURWDMRD-IYBDPMFKSA-N 288.476 1.743 5 50 CDBA Cc1nn(C)cc1CNC(=O)c1ccc([N+](=O)[O-])cc1 461741 CLRMSIMVPFLFJC-UHFFFAOYSA-N 274.280 1.567 5 50 CDBA CCN(CC)CC(=O)Nc1ccccc1[N+](=O)[O-] 4993583 TVLJLUCHRYRTKV-UHFFFAOYSA-N 251.286 1.875 5 50 CDBA COC(=O)CCc1ccc([S@](=O)O)c([N+](=O)[O-])c1 675062597 IWPNQWLUKAQMOQ-UHFFFAOYSA-N 273.266 1.281 5 50 CDBA Cn1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)n1 5060777 VWBBCQGGNWUHDR-UHFFFAOYSA-N 261.241 1.972 5 50 CDBA Cc1ccc(NC2=C([N+](=O)[O-])CS(=O)(=O)C2)cc1 297369 UVDMQRNUPSPGHN-UHFFFAOYSA-N 268.294 1.324 5 50 CDBA CC[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 368816 AFESPGHMFBWEIW-QMMMGPOBSA-N 258.299 1.672 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@H](O)CNC2CCCC2)cc1 4481964 GMKXDUGJTXJRHW-CYBMUJFWSA-N 280.324 1.867 5 50 CDBA CN1CCCC[C@H]1CCSc1ncc([N+](=O)[O-])c(=N)[nH]1 521394975 JXHDLFCMZDUPPP-VIFPVBQESA-N 297.384 1.764 5 50 CDBA Cc1c(CC(=O)OCCCC(N)=O)cccc1[N+](=O)[O-] 170617297 UUTHKYWMHIPYMW-UHFFFAOYSA-N 280.280 1.254 5 50 CDBA CC1(C)CN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@H]1O 287856082 SGEIIKRZAYCOIU-MRVPVSSYSA-N 294.336 1.807 5 50 CDBA O=C(NCc1ccncc1)c1cccc([N+](=O)[O-])c1 271636 NJUYOTXFBZZMCU-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA NC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4740992 YLAKGERNZIGANP-UHFFFAOYSA-N 284.703 1.449 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCN(c2ncc[nH]2)CC1 225647874 YKLWAQQOVMHUTL-UHFFFAOYSA-N 274.284 1.040 5 50 CDBA O=[N+]([O-])c1ccc(O)cc1I 71791108 FIWCMSJAIDKMNX-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA in-vitro CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@](C)(O)C1 67151 TZYDUQBFBRCHEN-GFCCVEGCSA-N 263.253 1.525 5 50 CDBA CCOC(=O)Cn1nc([N+](=O)[O-])c(Br)c1C 255452 OZTZXCSOJKMYDM-UHFFFAOYSA-N 292.089 1.425 5 50 CDBA Cc1cc(C)nc(NC(=O)c2ccc([N+](=O)[O-])o2)n1 310345 UHEWHZMFGSHLFD-UHFFFAOYSA-N 262.225 1.847 5 50 CDBA O=C1CSC2=NCN(c3cccc([N+](=O)[O-])c3)CN12 1306733 IQGWFCXREFKUJF-UHFFFAOYSA-N 278.293 1.261 5 50 CDBA O=[N+]([O-])c1ccc(N2CCNCC2)c2cccnc12 4499384 MPGZAAGYNPKHDS-UHFFFAOYSA-N 258.281 1.553 5 50 CDBA COC(=O)/C=C(/Nc1cccc([N+](=O)[O-])c1C)C(=O)OC 101365000 MPCQLYCWZWWLIQ-JXMROGBWSA-N 294.263 1.545 5 50 CDBA CCOc1cc(CSc2nnc(N)[nH]2)ccc1[N+](=O)[O-] 276907196 MOJNDNIZRVGWAG-UHFFFAOYSA-N 295.324 1.986 5 50 CDBA COC(=O)C(C(=O)OC)c1ccc([N+](=O)[O-])cc1 170091 PYUABAXAUVLRNX-UHFFFAOYSA-N 253.210 1.024 5 50 CDBA in-vitro CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 3894034 OFCJTLZYBAMNSC-UHFFFAOYSA-N 283.715 1.917 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)n2ccnc2)cc1 6467764 DBLUTOHJSJINHD-UHFFFAOYSA-N 253.239 1.028 5 50 CDBA in-vitro C[C@H](C(=O)N1CCCCC1)n1cc([N+](=O)[O-])cn1 1432071 YFEGEPZGZFHFOA-SECBINFHSA-N 252.274 1.365 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CCO[C@H]1CCCCO1 196792849 XQXUFEMJNJHIBN-NSHDSACASA-N 255.274 1.643 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)OCc1ccccc1 4820737 QJTZNQBMDLNVML-UHFFFAOYSA-N 261.237 1.535 5 50 CDBA O=[N+]([O-])c1cc(CO)c(F)cc1Br 238722932 SWMDXXYDJXJIHX-UHFFFAOYSA-N 250.023 1.989 5 50 CDBA CC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@H]1CCCO1 152533988 XTIQBODKKHSVEP-ZYHUDNBSSA-N 294.307 1.988 5 50 CDBA O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cnns1 170603834 ZCCWFOGEQDQZTC-UHFFFAOYSA-N 264.266 1.628 5 50 CDBA CC1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1 483222 QOGKICWDCGRVDR-UHFFFAOYSA-N 252.274 1.200 5 50 CDBA O=[N+]([O-])c1cc[n+]([O-])cc1NCC1CCSCC1 408523077 OQNSZSLELRXYFW-UHFFFAOYSA-N 269.326 1.783 5 50 CDBA Cc1nc([N+](=O)[O-])c(NCC[S@@](=O)C(C)(C)C)n1C 169988372 GCIRKMGLVZAWAJ-LJQANCHMSA-N 288.373 1.596 5 50 CDBA CCOC(=O)[C@@H](F)[C@H]1CCN(c2ncccc2[N+](=O)[O-])C1 585092263 MCMPYQHBCYCRLG-ONGXEEELSA-N 297.286 1.717 5 50 CDBA O=[N+]([O-])c1cc(Br)c2c(c1)[C@H](O)CN2 169725903 GVVZGKQCCDWUPF-SSDOTTSWSA-N 259.059 1.816 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCO1 474439 NNPUULCEZUUSOR-NSHDSACASA-N 266.253 1.721 5 50 CDBA C[C@H](C(=O)O)N1CCc2ccc([N+](=O)[O-])cc2C1 237448928 ZUIPFXJTUHGKBF-MRVPVSSYSA-N 250.254 1.426 5 50 CDBA Cc1nn(C(=O)Cn2cc([N+](=O)[O-])cn2)c(C)c1Cl 1069450 FKKHPAOWVCHPBT-UHFFFAOYSA-N 283.675 1.598 5 50 CDBA Nc1nonc1OCCCNc1ccc([N+](=O)[O-])cc1 3877911 OATXLZYTSCXPDI-UHFFFAOYSA-N 279.256 1.441 5 50 CDBA Cc1cc(C)n(S(=O)(=O)c2cccc([N+](=O)[O-])c2)n1 192101 JRDVAFHVPSTDNG-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CCOCC2)c([N+](=O)[O-])c1 100517032 CPZXPDQTMDRNBY-UHFFFAOYSA-N 298.211 1.248 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1Sc1n[nH]c(CO)n1 170606521 DBCWXTTYMTVDOS-UHFFFAOYSA-N 267.270 1.060 5 50 CDBA CC[C@@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 585098108 KKZQBCVENSMGPV-MRVPVSSYSA-N 253.258 1.311 5 50 CDBA O=[N+]([O-])c1ccccc1N1CCN(CCCCCO)CC1 96026579 GNAVUVMQGHCSEL-UHFFFAOYSA-N 293.367 1.879 5 50 CDBA Cc1cc(NC(=O)CCCn2cc([N+](=O)[O-])cn2)no1 2884829 LHQIYXAGWHTMBB-UHFFFAOYSA-N 279.256 1.507 5 50 CDBA CC(=O)N1c2ccc([N+](=O)[O-])cc2NC(=O)C[C@H]1C 3997082 JZBPVSYPNBPFCX-SSDOTTSWSA-N 263.253 1.678 5 50 CDBA CN1CCN(Cc2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 328578030 LGTPLBQTVISMCH-UHFFFAOYSA-N 274.324 1.824 5 50 CDBA Cc1ccn(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 1615544714 AUUHTHWBFVVRDR-UHFFFAOYSA-N 267.266 1.337 5 50 CDBA Cc1ccc(C(=O)N(CC#N)CC#N)cc1[N+](=O)[O-] 123353 PGCZHTUNARDZBA-UHFFFAOYSA-N 258.237 1.393 5 50 CDBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1[N+](=O)[O-])[C@H]1C=C[C@H]2C1 100216051 PBVHTBPFNZTURL-VDUILEQBSA-N 284.271 1.906 5 50 CDBA CN1C(=O)S/C(=C/c2ccc([N+](=O)[O-])o2)C1=O 71772848 YCFGRCYBRIEDCQ-GQCTYLIASA-N 254.223 1.854 5 50 CDBA CC(C)(CNc1cccc(F)c1[N+](=O)[O-])C(N)=O 218121699 MXSLRUJFBPCPKD-UHFFFAOYSA-N 255.249 1.657 5 50 CDBA O=C(N[C@H]1C[C@H]2CC[C@H]1O2)c1ccc([N+](=O)[O-])c(O)c1 191437589 FZNSNTCNOVLVPY-VDDIYKPWSA-N 278.264 1.350 5 50 CDBA CC(=O)N1CCN(C(=S)c2ccc([N+](=O)[O-])cc2)CC1 307287 JYZOVCDCAWPUTB-UHFFFAOYSA-N 293.348 1.434 5 50 CDBA CCOC(=O)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] 4671603 KKNUEHGYBZVPOQ-UHFFFAOYSA-N 268.225 1.105 5 50 CDBA CC(=O)c1cc(NCC(C)(C)O)ccc1[N+](=O)[O-] 225819390 SNLTZTLXMWVTEH-UHFFFAOYSA-N 252.270 1.980 5 50 CDBA CC1(C)COC(=O)[C@@H]1OC(=O)c1ccc([N+](=O)[O-])cc1 34385706 MKJHFKPUKIGUQC-JTQLQIEISA-N 279.248 1.703 5 50 CDBA COC[C@H]1CN(c2cc(OC)c(C)cc2[N+](=O)[O-])CCO1 408518524 LZAFUMHJQUVENF-LLVKDONJSA-N 296.323 1.763 5 50 CDBA COCCCNC(=O)Cc1ccccc1[N+](=O)[O-] 2829583 ARWXDMJWDLSBMN-UHFFFAOYSA-N 252.270 1.290 5 50 CDBA COCCCNC(=S)Nc1cc([N+](=O)[O-])ccc1OC 5041381 OTZAUBAVPIZICR-UHFFFAOYSA-N 299.352 1.926 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN(c3ncccn3)CC2)nc1 19640267 HODRSYBSOZPUFX-UHFFFAOYSA-N 286.295 1.106 5 50 CDBA CCOCCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] 4828734 JVYLMXKNGYXQPV-UHFFFAOYSA-N 268.269 1.969 5 50 CDBA CC[C@@H](C)NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 1000891 BIDDCILYNCYNKO-SSDOTTSWSA-N 254.290 1.323 5 50 CDBA C[C@@H]1CCCC[C@@]1(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 408520805 XQNKCPGWTLGUMK-ZWNOBZJWSA-N 280.328 1.876 5 50 CDBA O=C(O)c1nsnc1-c1cc([N+](=O)[O-])ccc1O 16385896 RLUDIMCZTNAWCS-UHFFFAOYSA-N 267.222 1.517 5 50 CDBA CC(C)[C@H](N)C(=O)OCc1ccc([N+](=O)[O-])cc1 38202252 USBVDPVTFGLYPZ-NSHDSACASA-N 252.270 1.621 5 50 CDBA in-vitro CCOC(=O)COc1cc(OC)c(OC)cc1[N+](=O)[O-] 390834881 LOTOBDTYQGDUDN-UHFFFAOYSA-N 285.252 1.554 5 50 CDBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CCC(=O)O 262643217 JKJJYUCQVIXEEP-SECBINFHSA-N 295.295 1.328 5 50 CDBA COc1cc(/C=C/[N+](=O)[O-])c([N+](=O)[O-])c(OC)c1 34925600 LDVTWFLAQMFUKQ-ONEGZZNKSA-N 254.198 1.859 5 50 CDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(OC2CCCCC2)CC1 170603135 KVFFXOATKBIEIB-ZIAGYGMSSA-N 296.367 1.992 5 50 CDBA CCOC[C@@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 193805665 JIFUQWTWCZEUND-ZDUSSCGKSA-N 291.307 1.856 5 50 CDBA O=[N+]([O-])c1ccc(NCCN2CCOCC2)c([N+](=O)[O-])c1 19721041 NZYUIUZGOFCPLB-UHFFFAOYSA-N 296.283 1.247 5 50 CDBA COc1ccc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 371970 NJNIKWGRPHVYOB-UHFFFAOYSA-N 290.279 1.116 5 50 CDBA Cc1cc(NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)no1 1421987 PAHOHFSIPRBPQB-ZETCQYMHSA-N 265.229 1.287 5 50 CDBA CC(C)c1ccc(CN2C[C@@H](O)C[C@H]2CO)cc1[N+](=O)[O-] 187670664 IVCABRLYLDITEP-STQMWFEESA-N 294.351 1.646 5 50 CDBA CC[N+](C)(CC)CCNC(=O)C1=CN(C)C(=CN=O)C=C1 1857524611 BUQYCSRBEIQKDK-UHFFFAOYSA-O 293.391 1.582 5 50 CDBA Cc1ccsc1/C=C\c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-] 30840502 PIVANJNCMHZARN-IHWYPQMZSA-N 279.277 1.512 5 50 CDBA Cc1[nH]nc(C(=O)N2CCC[C@H]2[C@@H]2CCCO2)c1[N+](=O)[O-] 285828162 OHRUMYODQUAMPG-UWVGGRQHSA-N 294.311 1.410 5 50 CDBA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 239073286 GWKGSCMXUZSZSH-KXUCPTDWSA-N 280.328 1.883 5 50 CDBA CS(=O)(=O)c1cc([N+](=O)[O-])cc(Br)c1F 94986258 MHVOFNPXNVSLCB-UHFFFAOYSA-N 298.089 1.900 5 50 CDBA in-vitro COc1ccc(OC)c(Nc2ncnc(N)c2[N+](=O)[O-])c1 3912601 BUEUEUHNRYVEJS-UHFFFAOYSA-N 291.267 1.728 5 50 CDBA O=[N+]([O-])c1cccc(OCCNC[C@H]2CCCO2)c1 4870231 AJPAIZDZBXRKKX-CYBMUJFWSA-N 266.297 1.742 5 50 CDBA CCC[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1nnn[nH]1 136624102 MATWCGSBOJEBMG-LURJTMIESA-N 296.312 1.441 5 50 CDBA CC(C)(O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1 139713131 OYHFEAFLLHMLAB-GFCCVEGCSA-N 294.307 1.676 5 50 CDBA C[C@]1(COc2ccccc2)C[N+]23CCO[B-]2(OCC3)O1 195810372 RPEUXZOKVJBTSP-QQFBHYJXSA-N 277.129 1.167 5 50 CDBA COC(=O)/C=C1\Nc2cc([N+](=O)[O-])ccc2NC1=O 18116778 ZYPUSFLXOBXGJG-UITAMQMPSA-N 263.209 1.016 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)n1cncc1C 321567 NVVLVCWRZUQFNT-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA CC(=O)Nc1ccc(NC(C)=O)c([N+](=O)[O-])c1[N+](=O)[O-] 3861627 DGNNIDWBARYYSR-UHFFFAOYSA-N 282.212 1.420 5 50 CDBA Cc1nc(N[C@H]2CC[C@H](CN)C2)ncc1[N+](=O)[O-] 420273249 LVRZGFFNYGUQIG-IUCAKERBSA-N 251.290 1.233 5 50 CDBA COc1ccc(N2C(=O)CS/C2=C\[N+](=O)[O-])cc1 1387341 AOIKBISFFCTHDO-WDZFZDKYSA-N 266.278 1.851 5 50 CDBA Cc1nc(N2CCC[C@@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-] 301621253 FIOXFIBJXHYVJW-LLVKDONJSA-N 292.339 1.603 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCCO1 5061036 NGSJDKZZFOXQIG-JTQLQIEISA-N 295.295 1.904 5 50 CDBA COC[C@@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1O 156555573 VYULYPWBKHRTFH-VIFPVBQESA-N 280.280 1.551 5 50 CDBA CCN1CCN(C(=S)c2ccc([N+](=O)[O-])cc2)CC1 55526427 OBXBYWMIZVRLAE-UHFFFAOYSA-N 279.365 1.908 5 50 CDBA C[C@H](c1nnc2n1CCCCC2)n1cc([N+](=O)[O-])cn1 72334102 IQSQOGBESYJNQB-SECBINFHSA-N 276.300 1.719 5 50 CDBA Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C(N)=O)C1 192938294 RXMRKFLOHQRKGQ-JTQLQIEISA-N 291.307 1.241 5 50 CDBA O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)OC[C@H]1CC12CC2 2325765615 MFROFSDAOTZIFO-SECBINFHSA-N 278.264 1.100 5 50 CDBA CN(C)/C=C1\N=C(c2ccc([N+](=O)[O-])cc2)OC1=O 448071 DHGUTVMZVHEETL-YFHOEESVSA-N 261.237 1.301 5 50 CDBA COC(=O)c1cccc(/C=C/N(C)C)c1[N+](=O)[O-] 55106966 PPCHVJGFXSDKDO-BQYQJAHWSA-N 250.254 1.914 5 50 CDBA O=C(c1cc[nH]n1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188465534 NMUKJAVPOXATHS-UHFFFAOYSA-N 288.263 1.221 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)N1CCCCC1 1070145 RVBDRCVKCLXCOB-UHFFFAOYSA-N 252.274 1.112 5 50 CDBA O=C(Nc1cccc([N+](=O)[O-])c1)c1cnsn1 618964 UYZQXEBHABVNHR-UHFFFAOYSA-N 250.239 1.699 5 50 CDBA CN(Cc1ccccc1)c1ncnc(N)c1[N+](=O)[O-] 3878084 JSUJYCLUZZXIBH-UHFFFAOYSA-N 259.269 1.603 5 50 CDBA O=c1[nH]c(O)nc(/C=C/c2ccccc2)c1[N+](=O)[O-] 4071054 ITFUSTYTUCGMEV-VOTSOKGWSA-N 259.221 1.554 5 50 CDBA CN(C)CCNCCCCOc1cccc([N+](=O)[O-])c1 5049502 LQJJFHFZXBNAPE-UHFFFAOYSA-N 281.356 1.905 5 50 CDBA COc1ccc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)cc1 9010349 BLYOMZFPRBCQQW-QPJJXVBHSA-N 289.247 1.563 5 50 CDBA CC1(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCNCC1 229627719 ULFUWQJCYRXOEK-UHFFFAOYSA-N 299.352 1.015 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1OCCN1CCOCC1 585662088 ANPLGKCFHOBBTB-UHFFFAOYSA-N 266.297 1.614 5 50 CDBA O=[N+]([O-])c1ccc(OCCN2CCOCC2)cc1 19850956 BERKHGFFGHNCSO-UHFFFAOYSA-N 252.270 1.306 5 50 CDBA NC(=O)c1ccc(NCc2cccnc2)c([N+](=O)[O-])c1 4755085 YYAYMHJNJQXIRL-UHFFFAOYSA-N 272.264 1.701 5 50 CDBA COC[C@H](C)NC(=O)/C=C/c1ccccc1[N+](=O)[O-] 2830926 BPVNNJNDZALIRS-JARNTUPDSA-N 264.281 1.759 5 50 CDBA CC(C)C[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1 4521637 AXZJHDNQDSVIDR-LLVKDONJSA-N 251.286 1.907 5 50 CDBA COC(=O)C(C(=O)OC)c1cccc(F)c1[N+](=O)[O-] 74937731 OGJCUSFTJIEQRF-UHFFFAOYSA-N 271.200 1.164 5 50 CDBA in-vitro O=[N+]([O-])c1ccc(F)cc1NCCCn1ccnn1 127410169 LYVVIUPMYSPRNL-UHFFFAOYSA-N 265.248 1.828 5 50 CDBA CC(=O)c1ccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 98234 BFJINKWPRYFWDA-UHFFFAOYSA-N 289.251 1.028 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCO 4583118 YHVRNZUHTBWVOX-UHFFFAOYSA-N 253.258 1.359 5 50 CDBA Cc1cc(NC[C@H]2CC(=O)N(C3CC3)C2)ncc1[N+](=O)[O-] 253425781 PKGNFPMWDYVQRR-SNVBAGLBSA-N 290.323 1.721 5 50 CDBA O=[N+]([O-])c1[nH]c(Br)nc1Br 5425212 ZGEMTDYSQTXJOF-UHFFFAOYSA-N 270.868 1.843 5 50 CDBA O=[N+]([O-])c1cc(Cl)ccc1N1CCN(CCO)CC1 19286375 IGAXAUQESKLXLF-UHFFFAOYSA-N 285.731 1.363 5 50 CDBA CCOC(=O)CCc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 2166670 YLIMSIWQDHNBCZ-UHFFFAOYSA-N 284.224 1.704 5 50 CDBA CN(C)CCNc1c([N+](=O)[O-])c(=O)n(C)c2ccccc12 4680199 UIUVCQPGPOYUEP-UHFFFAOYSA-N 290.323 1.420 5 50 CDBA N=c1nc(O)c2cc(Br)cc([N+](=O)[O-])c2[nH]1 498049316 MNXKARCUBGTBGH-UHFFFAOYSA-N 285.057 1.419 5 50 CDBA CC1(O)CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 272592118 GBDFFETUIYIMBH-UHFFFAOYSA-N 279.296 1.164 5 50 CDBA Cc1c(NC(=O)N2CCOCCN2)cccc1[N+](=O)[O-] 585119922 ABJAXVGSHGPMAZ-UHFFFAOYSA-N 280.284 1.272 5 50 CDBA CCn1cc(C(=O)O)c(=O)c2cc([N+](=O)[O-])ccc21 33296 MPPOPOLESXYPNH-UHFFFAOYSA-N 262.221 1.628 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccc3c(c2)OCO3)N1 103378 FKMJJAMPPJQKFX-UFBFGSQYSA-N 264.237 1.012 5 50 CDBA C[C@@H](C(=O)Nn1cnnc1)c1ccc([N+](=O)[O-])cc1 471524 SPTNSYQPAKGAML-MRVPVSSYSA-N 261.241 1.060 5 50 CDBA COCCn1cc([N+](=O)[O-])s/c1=N\C(=O)C(C)(C)C 44124905 FGDVWFYNIWFSQM-BENRWUELSA-N 287.341 1.578 5 50 CDBA CCc1[nH]nc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1C 408522215 FNXZFVDUADSQOA-UHFFFAOYSA-N 278.272 1.024 5 50 CDBA Cc1nc(N2C[C@@H]3CN(C)CC[C@H]3C2)ccc1[N+](=O)[O-] 1616021093 HJNNPIXNWKSRSK-RYUDHWBXSA-N 276.340 1.686 5 50 CDBA Cc1ccc(-n2c(=O)[nH]c3ccccc3c2=O)cc1[N+](=O)[O-] 1578357 DUVMWSBTNLIFSI-UHFFFAOYSA-N 297.270 1.896 5 50 CDBA NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccc1[N+](=O)[O-] 247703211 BJTDPZWRFIXVIZ-FOGDFJRCSA-N 290.323 1.613 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCc2c[nH]nc2C1 378410747 IRUPLNOPYMPNBS-JTQLQIEISA-N 273.296 1.991 5 50 CDBA Cc1ccnc(NCc2cc3n(n2)CCCO3)c1[N+](=O)[O-] 521398385 CKEVNIFTFUUISR-UHFFFAOYSA-N 289.295 1.889 5 50 CDBA O=C(O)c1cccc([N+](=O)[O-])c1N1CCOCC1 4342581 HMDGHIWDEAZTDZ-UHFFFAOYSA-N 252.226 1.130 5 50 CDBA CNC(=O)NC1CN(c2ccc(C)cc2[N+](=O)[O-])C1 253397980 IIKLXUXMBVQYOI-UHFFFAOYSA-N 264.285 1.021 5 50 CDBA Cc1ccnc(N2CC[C@@H](N3CCC3)C2)c1[N+](=O)[O-] 952883883 ZDSRDDPOJKANIA-LLVKDONJSA-N 262.313 1.583 5 50 CDBA O=[N+]([O-])c1ccc2nc(N3CCNCC3)ccc2c1 2530705 GGDBEAVVGFNWIA-UHFFFAOYSA-N 258.281 1.553 5 50 CDBA in-vivo C[C@H](O)CCN(C)C(=O)c1ccc(O)c([N+](=O)[O-])c1 119121506 BBSMEOMKDASPEK-QMMMGPOBSA-N 268.269 1.143 5 50 CDBA Cc1cc(N[C@@H]2C[C@@H](O)[C@H]2n2cccn2)ncc1[N+](=O)[O-] 1615003494 QAJRXWLCHCXWLA-XWIASGKRSA-N 289.295 1.281 5 50 CDBA O=C(O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 15443266 VEAIWASLIKZFDF-VIFPVBQESA-N 250.254 1.896 5 50 CDBA Nc1ncc([N+](=O)[O-])cc1I 20358037 FEADVZZIWYNCBF-UHFFFAOYSA-N 265.010 1.177 5 50 CDBA in-vitro COC[C@H](C)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2840097 UXMQZCOOEAIZFO-FGEFZZPRSA-N 264.281 1.759 5 50 CDBA COc1ccc(C=O)cc1Cn1cnc([N+](=O)[O-])n1 258124 JIFQWYNLVVZWCK-UHFFFAOYSA-N 262.225 1.056 5 50 CDBA O=Cc1cc(S(=O)(=O)C(F)(F)F)cc([N+](=O)[O-])c1O 1168519 WIQAZGGRKNRNPN-UHFFFAOYSA-N 299.182 1.406 5 50 CDBA O=[N+]([O-])c1ccccc1/C=C/CN1CCN(CCO)CC1 4987152 XTLNYLRQJWXZRM-HWKANZROSA-N 291.351 1.218 5 50 CDBA C[C@H]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CN 164004416 UEGPFLPIEUAKBR-UWVGGRQHSA-N 289.339 1.892 5 50 CDBA COC(=O)[C@@H]1CC/C(=C\[N+](=O)[O-])N1Cc1ccccc1 114860831 YQNCAIYSKJHBTA-XSNHNAGMSA-N 276.292 1.942 5 50 CDBA O=C1NC(=O)/C(=C/c2ccccc2[N+](=O)[O-])S1 13016310 AOOOVMMYAYKAGI-YVMONPNESA-N 250.235 1.919 5 50 CDBA O=C(NC[C@H]1CCCNC1)c1ccc([N+](=O)[O-])cc1Cl 237811537 GEQBZSONGMGOSP-VIFPVBQESA-N 297.742 1.978 5 50 CDBA O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)OC[C@@H]1CC12CC2 2325765616 MFROFSDAOTZIFO-VIFPVBQESA-N 278.264 1.100 5 50 CDBA COCCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 2959220 VOOHTMIKAOMIHQ-QPJJXVBHSA-N 250.254 1.371 5 50 CDBA CN(C)CCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3154224 LKPYPWIZCULEMC-UHFFFAOYSA-N 283.240 1.221 5 50 CDBA COC(=O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 95495942 XGOSQZCCMOJEEQ-MRVPVSSYSA-N 264.237 1.121 5 50 CDBA O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 584904255 AQNMNKYXHBFFMN-KKOKHZNYSA-N 288.259 1.262 5 50 CDBA O=c1c2nc3ccccc3n2c(=O)n2c1nc1ccccc12 198353 NKOPIQVXIJXRIR-UHFFFAOYSA-N 288.266 1.447 5 50 CDBA O=C(N[C@@H]1CC12CCCCC2)c1cc([N+](=O)[O-])[nH]n1 285690732 CBYKPFIZZLIUKI-SECBINFHSA-N 264.285 1.771 5 50 CDBA NS(=O)(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] 263622893 BTSDXDHSRFYNLP-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA COC(=O)CNc1cc(Br)cc([N+](=O)[O-])c1 253393570 MXAVUTCGIKVQPE-UHFFFAOYSA-N 289.085 1.942 5 50 CDBA O=[N+]([O-])c1cccnc1NCCCOc1ncccn1 585092479 ZMDDZCVMMCJMRA-UHFFFAOYSA-N 275.268 1.661 5 50 CDBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(N)c2)C[C@@H](C)N1 5275387 OTASVJFNJXDROV-DTORHVGOSA-N 250.302 1.364 5 50 CDBA CC(C)(N)CNc1ncc([N+](=O)[O-])cc1Br 131830329 NPVHDKVEBOKPKN-UHFFFAOYSA-N 289.133 1.902 5 50 CDBA O=C(CCCn1cc([N+](=O)[O-])cn1)NCc1ccco1 1068479 OWRCUKYZQRGRCM-UHFFFAOYSA-N 278.268 1.481 5 50 CDBA CCN(CC)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N 3878383 JEKZTAIOGZQAJM-UHFFFAOYSA-N 282.256 1.567 5 50 CDBA CC(=O)c1ccccc1Oc1ncnc(N)c1[N+](=O)[O-] 3912710 UNYHFPAEHUSSPE-UHFFFAOYSA-N 274.236 1.962 5 50 CDBA C[S@](=O)CCCNc1cc(F)ccc1[N+](=O)[O-] 229295308 OYPXLDNGKRRMTJ-KRWDZBQOSA-N 260.290 1.914 5 50 CDBA O=[N+]([O-])c1ccccc1CN1CCOC[C@@]12CCOC2 193671640 YIPAQGFHALTRHT-AWEZNQCLSA-N 278.308 1.586 5 50 CDBA COc1ccc(C(=O)NC[C@@H](C)CN(C)C)cc1[N+](=O)[O-] 5077394 BSILJAXGVZKKSJ-SNVBAGLBSA-N 295.339 1.531 5 50 CDBA CCOc1cc([N+](=O)[O-])cc(C=O)c1O[C@H](C)C(=O)O 4803514 RJBBXGKMBBIBSC-SSDOTTSWSA-N 283.236 1.658 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)NC1CCCCC1 529227 IVFVIHRPCWUEIZ-UHFFFAOYSA-N 266.301 1.549 5 50 CDBA C[C@H]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CN 253196962 UEGPFLPIEUAKBR-VHSXEESVSA-N 289.339 1.892 5 50 CDBA C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)O 35407403 AGHYCQKOMGHZNX-ZCFIWIBFSA-N 253.214 1.189 5 50 CDBA O=C(O)c1ccc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O 41602838 CTLNUURLOJIYGC-UHFFFAOYSA-N 260.205 1.648 5 50 CDBA O=[N+]([O-])c1ccc(Sc2cnn[nH]2)c([N+](=O)[O-])c1 1772491151 VWBBJLHBXPRVOR-UHFFFAOYSA-N 267.226 1.772 5 50 CDBA O=[N+]([O-])c1ccc(NC(=S)NN2CCOCC2)cc1 5041194 XLHOBTRRPCBDME-UHFFFAOYSA-N 282.325 1.128 5 50 CDBA N[C@@H](CC(=O)O)c1cccn1-c1ccc([N+](=O)[O-])cc1 32764 QPTSBCSINGPCKQ-NSHDSACASA-N 275.264 1.860 5 50 CDBA CCCCNC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1 2898991 UQMCQZMDTPQTKT-UHFFFAOYSA-N 281.337 1.999 5 50 CDBA COc1cc(CN(C)CCN(C)C)cc([N+](=O)[O-])c1O 4948596 HVLYZSFYSVWPDB-UHFFFAOYSA-N 283.328 1.302 5 50 CDBA Cc1ccc(NC(=O)/C=C\C(=O)O)cc1[N+](=O)[O-] 31843550 POKXHZCYWHLENN-PLNGDYQASA-N 250.210 1.483 5 50 CDBA C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C1CCOCC1 163539520 QNGZIWCGXZFNKA-SECBINFHSA-N 294.307 1.845 5 50 CDBA CC(=O)c1ccc(SCC(=O)O)c([N+](=O)[O-])c1 3186839 PNFZRSLSTKUNAW-UHFFFAOYSA-N 255.251 1.974 5 50 CDBA O=[N+]([O-])c1cccc2[nH]cc(CN3CCOCC3)c12 1772715389 JWPWQYLOTBTAOO-UHFFFAOYSA-N 261.281 1.908 5 50 CDBA O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCCC1 5068280 IGXXJWCKQNEELE-GFCCVEGCSA-N 280.324 1.867 5 50 CDBA CCCCn1c(O)nc2nc3cc(N)ccc3nc2c1=O 18039667 SCMRSTXDCBCLRG-UHFFFAOYSA-N 285.307 1.428 5 50 CDBA COCCN1CCn2c(nc3cc([N+](=O)[O-])ccc32)C1 19874446 FVALSJMCEPPZGN-UHFFFAOYSA-N 276.296 1.407 5 50 CDBA Cc1nn([C@@H](C)C(=O)N2CCCC2)c(C)c1[N+](=O)[O-] 1068007 ODDAEHZXKFEBGC-JTQLQIEISA-N 266.301 1.592 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)NCc1cccs1 375921 YFQCFKOTDQWOTF-UHFFFAOYSA-N 266.282 1.320 5 50 CDBA Cc1cc(C)n(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 437927 SEOZLOMDALRAGL-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCCC1 4832362 DHIFTCQPXSKPQU-UHFFFAOYSA-N 279.296 1.638 5 50 CDBA O=C(N[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1[N+](=O)[O-] 229724468 GSUWEFSKUVXFQK-OCCSQVGLSA-N 289.335 1.951 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccccc2Cl)N1 90856 TYGMJKKENBLZGE-GXSJLCMTSA-N 254.673 1.936 5 50 CDBA CC[C@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 585098111 KKZQBCVENSMGPV-QMMMGPOBSA-N 253.258 1.311 5 50 CDBA Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 373005 DEBCBCVLQZUBGF-UHFFFAOYSA-N 260.253 1.258 5 50 CDBA O=C(Oc1cccc([N+](=O)[O-])c1)N1CCOCC1 2833721 PXQYQNRJZSNTOD-UHFFFAOYSA-N 252.226 1.426 5 50 CDBA COC(=O)c1cnc(N2CCC(OC)CC2)c([N+](=O)[O-])c1 276610576 SPLDQJMSJYASMB-UHFFFAOYSA-N 295.295 1.392 5 50 CDBA CCOC(=O)[C@H](F)[C@H]1CCN(c2ncccc2[N+](=O)[O-])C1 585092260 MCMPYQHBCYCRLG-GXSJLCMTSA-N 297.286 1.717 5 50 CDBA C[C@H]1CCC[C@H](C)C1NC(=O)Cn1cc([N+](=O)[O-])cn1 193266163 SLHPTAZLMFPPJZ-UWVGGRQHSA-N 280.328 1.732 5 50 CDBA COc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 2546068 JANBLAADNZANNL-ZCFIWIBFSA-N 269.209 1.268 5 50 CDBA O=C([C@H]1C[C@@H]1[N+](=O)[O-])N1CCC(OC2CCCCC2)CC1 170603133 KVFFXOATKBIEIB-KBPBESRZSA-N 296.367 1.992 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])cc(Br)c1N 199537464 WKGMRNVMTBOZIS-UHFFFAOYSA-N 275.058 1.726 5 50 CDBA C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cc[nH]n1 1875259780 GFHVZOYVDIXSTE-MRVPVSSYSA-N 296.308 1.357 5 50 CDBA Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 1424779 SBTJLQZXMJIEAL-UHFFFAOYSA-N 260.253 1.738 5 50 CDBA CN(C[C@H]1CCCOC1)c1ccnc(F)c1[N+](=O)[O-] 585118394 MUOZVQBEZSCTPG-SECBINFHSA-N 269.276 1.992 5 50 CDBA O=[N+]([O-])c1ccc(-n2ccnc2)nc1-n1ccnc1 360827 LDUPBNGAJSXGNA-UHFFFAOYSA-N 256.225 1.361 5 50 CDBA CC[C@H](C)NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 1000892 BIDDCILYNCYNKO-ZETCQYMHSA-N 254.290 1.323 5 50 CDBA Cc1ccnc(NC[C@@H](O)c2cncs2)c1[N+](=O)[O-] 1615003625 YTVFKTNKXHGINL-MRVPVSSYSA-N 280.309 1.900 5 50 CDBA CCOC(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 19632786 OJKGMZJACAOMGH-UHFFFAOYSA-N 293.323 1.869 5 50 CDBA COc1cc(C(=O)N[C@H](C)[C@H](C)C(=O)O)ccc1[N+](=O)[O-] 164801980 PVEHFFINWSOWAG-JGVFFNPUSA-N 296.279 1.442 5 50 CDBA O=C(O)c1ccc(N2CCOCC2)cc1[N+](=O)[O-] 71787938 XTCFTNJWMQVACD-UHFFFAOYSA-N 252.226 1.130 5 50 CDBA COCCCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 2910231 KZLJZEIEGQRPMP-UHFFFAOYSA-N 268.269 1.370 5 50 CDBA CCOC(=O)CCC(CCC(=O)OCC)[N+](=O)[O-] 3074835 HCIJCLAFQCYQGE-UHFFFAOYSA-N 261.274 1.318 5 50 CDBA COc1ccc(NC(=O)Cn2c([N+](=O)[O-])cnc2C)cc1 5028262 PODMZAKWTNPEQP-UHFFFAOYSA-N 290.279 1.747 5 50 CDBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1nccs1 264093 QXESQTMPMWFROE-UHFFFAOYSA-N 275.245 1.852 5 50 CDBA O=C(O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 3884577 SREBONXEMNOUKV-UHFFFAOYSA-N 252.226 1.130 5 50 CDBA O=C1OCC[C@@H]2CN(c3ccnc(F)c3[N+](=O)[O-])CCN12 585118418 NXRCVVCQRAIISH-MRVPVSSYSA-N 296.258 1.160 5 50 CDBA CCN(CC)CCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 2836488 KERGYICXYAUTHB-UHFFFAOYSA-N 295.339 1.675 5 50 CDBA COCCCNCCOc1ccc(C)cc1[N+](=O)[O-] 3003248 NNHBVMSCCUSVDM-UHFFFAOYSA-N 268.313 1.908 5 50 CDBA O=C(Nc1ccc([N+](=O)[O-])cc1)OCCN1CCOC1=O 4264610 YUJSDPOTNYSRID-UHFFFAOYSA-N 295.251 1.596 5 50 CDBA O=[N+]([O-])c1cc(CN2CCC[C@@H](CO)C2)ccc1O 23280479 YWVCIBCGNOKLKZ-LLVKDONJSA-N 266.297 1.505 5 50 CDBA CC(=O)c1cc(C(=O)C(F)(F)F)[nH]c1[N+](=O)[O-] 642882248 JIDNGPOWHVAMGQ-UHFFFAOYSA-N 250.132 1.871 5 50 CDBA Cc1nc([N+](=O)[O-])c(NCCO)n1Cc1ccccc1 3832888 DTKUADYOSMPHLP-UHFFFAOYSA-N 276.296 1.552 5 50 CDBA NS(=O)(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 4158825 JROHUDZYXHGVJU-UHFFFAOYSA-N 299.352 1.623 5 50 CDBA CCc1ccc(C(=O)N2CC(O)(CC)C2)cc1[N+](=O)[O-] 282832633 DLWUHNROJQGBQR-UHFFFAOYSA-N 278.308 1.754 5 50 CDBA CC[N@+]1(C)[C@@H](C)[C@@H](O)[C@H](O)[C@@H]1c1ccc(OC)c(OC)c1 252441332 QIVWXVZLBPQWKQ-MJQUHVBXSA-N 296.387 1.335 5 50 CDBA biogenic COC(=O)N1CC(NC(=O)c2cccc([N+](=O)[O-])c2C)C1 170680574 ABISJVPMZSBMSQ-UHFFFAOYSA-N 293.279 1.084 5 50 CDBA COCCOc1ncc([N+](=O)[O-])cc1Br 116512263 OABOROOTMFAYDL-UHFFFAOYSA-N 277.074 1.778 5 50 CDBA O=C(CC1(C[N+](=O)[O-])COC1)OCc1ccccc1 95627022 GVQWDHVSVMXSQA-UHFFFAOYSA-N 265.265 1.413 5 50 CDBA COC(=O)c1nc(O)c([N+](=O)[O-])cc1Br 675050662 OKZSPXOINPXAPB-UHFFFAOYSA-N 277.030 1.245 5 50 CDBA CC(=O)Nc1ccc([N+](=O)[O-])cc1N1CCOCC1 12379704 QZTWZMGCJIHILW-UHFFFAOYSA-N 265.269 1.390 5 50 CDBA Nc1ncnc(Nc2c(F)cccc2F)c1[N+](=O)[O-] 3912581 MXBSZEMPZJIZHM-UHFFFAOYSA-N 267.195 1.989 5 50 CDBA CN(C)c1noc(COc2cc(F)ccc2[N+](=O)[O-])n1 170598590 OOLJAINANPOTQZ-UHFFFAOYSA-N 282.231 1.762 5 50 CDBA Nc1cc2n(n1)CCCN(c1ccccc1[N+](=O)[O-])C2 1615003605 WXMNHNGBXCJHKN-UHFFFAOYSA-N 273.296 1.784 5 50 CDBA CCOc1cc(/C=C\[N+](=O)[O-])ccc1OCC(N)=O 5014295 GKLIYSDPXVNZHE-WAYWQWQTSA-N 266.253 1.197 5 50 CDBA COc1cc([N+](=O)[O-])cc(CCC(=O)O)c1OC 30952745 XMEKYUKXPIMEOJ-UHFFFAOYSA-N 255.226 1.629 5 50 CDBA COc1nn(Cc2nnc3n2CCCCC3)cc1[N+](=O)[O-] 72334169 INAHLKRMDWGPHW-UHFFFAOYSA-N 292.299 1.166 5 50 CDBA Nc1ncnc(Nc2ccc3c(c2)OCO3)c1[N+](=O)[O-] 4059577 GOFQXGLUIVUPPC-UHFFFAOYSA-N 275.224 1.439 5 50 CDBA COCOc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 140175267 WAMLPUXAXKAAKS-GQCTYLIASA-N 267.237 1.764 5 50 CDBA CCOC(=O)CNc1ccc(C(=O)OC)cc1[N+](=O)[O-] 85210130 LHVJHRILVDYQAX-UHFFFAOYSA-N 282.252 1.356 5 50 CDBA in-vitro CCN(CC)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 93274 ZRRXXXGBVDGATC-GFCCVEGCSA-N 291.307 1.569 5 50 CDBA O=C(O)[C@H]1CS[C@H](c2cccc([N+](=O)[O-])c2)N1 77920 SALHXESGFYVCIK-RKDXNWHRSA-N 254.267 1.383 5 50 CDBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1ccco1 474663 INAULTGLYURLBW-UHFFFAOYSA-N 272.216 1.984 5 50 CDBA Nc1nc(-c2ccco2)nn1C(=O)c1ccc([N+](=O)[O-])cc1 608678 CESFCUXECOEKCB-UHFFFAOYSA-N 299.246 1.717 5 50 CDBA CC(=O)NCCOc1ccc([N+](=O)[O-])c2cccnc12 4694117 XLDGYVUAGMXEHN-UHFFFAOYSA-N 275.264 1.658 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)n1cc(Cl)cn1 355915 LLAVUGICHZTPET-UHFFFAOYSA-N 287.684 1.682 5 50 CDBA O=[N+]([O-])c1cccnc1N1CC[C@H](c2cc(O)n[nH]2)C1 585092770 NAHBUGYGHYFGTF-QMMMGPOBSA-N 275.268 1.412 5 50 CDBA O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc([N+](=O)[O-])c1O 225434535 WGNWKKRELBTZQX-BCMRRPTOSA-N 278.264 1.350 5 50 CDBA O=c1ccc(Cl)nn1-c1ccc([N+](=O)[O-])cc1 3123731 GLWFGRAIKWTQCK-UHFFFAOYSA-N 251.629 1.794 5 50 CDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC[C@@H]1C1CC1 119402687 WIMDLFXWPVBBEI-GFCCVEGCSA-N 292.291 1.551 5 50 CDBA Cc1ccc(CNC(=O)c2nn(C)c(C)c2[N+](=O)[O-])cc1 370934 VWRFDHYLJUPWTA-UHFFFAOYSA-N 288.307 1.875 5 50 CDBA COC(=O)c1cc(Br)c(O)c([N+](=O)[O-])c1 8729918 QVNQBMGIVJNPJH-UHFFFAOYSA-N 276.042 1.850 5 50 CDBA in-vitro COc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] 180957 SVUWWFRUKSMTMN-UWVGGRQHSA-N 294.307 1.853 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nccs2)cc1 198656 CIASIHHEOGXVOM-UHFFFAOYSA-N 285.306 1.852 5 50 CDBA in-man CC(C)N1C[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 1163514 GBOMHZMCOJEVBR-SNVBAGLBSA-N 291.307 1.790 5 50 CDBA O=[N+]([O-])[C@@H]1[C@H]2C[C@@H]3[C@@H]4[C@H]5[C@@H](C[C@@H]1[C@@H]5[C@H]42)[C@@H]3[N+](=O)[O-] 257357054 LVAWNZCHNHYYFC-PSWXTKDHSA-N 250.254 1.055 5 50 CDBA Cc1ccc(NC(=O)/C=C/C(=O)O)cc1[N+](=O)[O-] 2164733 POKXHZCYWHLENN-SNAWJCMRSA-N 250.210 1.483 5 50 CDBA Cc1ccc(NC(=O)N[C@H](C)C(=O)O)c([N+](=O)[O-])c1 1775971267 QAMDATDNFXQLIY-SSDOTTSWSA-N 267.241 1.498 5 50 CDBA NS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl 38328494 QQUJUEWKTUDYKI-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA CON(C)C(=O)[C@@H]1C[C@@H]1c1ccc([N+](=O)[O-])cc1 218115380 KGXGWVIKULLBRL-GHMZBOCLSA-N 250.254 1.718 5 50 CDBA CCNc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 670417719 BMQXTUHFUYMEDW-UHFFFAOYSA-N 254.202 1.034 5 50 CDBA C[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCCO1 310903078 BJGVTQDIMRORAI-MRVPVSSYSA-N 252.274 1.187 5 50 CDBA O=[N+]([O-])c1cnc(N[C@H]2CCO[C@@]3(CCOC3)C2)c(F)c1 408472291 USVSLHIGJNJNQK-ZANVPECISA-N 297.286 1.879 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2nncn2c1 170605196 IYJZASDQZQRVOW-UHFFFAOYSA-N 298.262 1.472 5 50 CDBA C[C@@H](CNc1ncccc1[N+](=O)[O-])c1nncn1C 170606514 PHTAXZJPIBJLMS-QMMMGPOBSA-N 262.273 1.334 5 50 CDBA COc1ccc(NC2=NC(=O)CS2)c([N+](=O)[O-])c1 18217732 IARFQDBDCIVICB-UHFFFAOYSA-N 267.266 1.645 5 50 CDBA O=C(NN1CCCCC1)c1cccc([N+](=O)[O-])c1O 128523694 HHZMOKXFGSLQMU-UHFFFAOYSA-N 265.269 1.431 5 50 CDBA CC(C)(C)ONC(=O)c1ccc([N+](=O)[O-])c(O)c1 156030052 JXXQDSADLPLFBP-UHFFFAOYSA-N 254.242 1.760 5 50 CDBA COc1ccc(NC(=O)CC(C)=O)c([N+](=O)[O-])c1 4087928 QBHQQQKWEKZEHK-UHFFFAOYSA-N 252.226 1.521 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCc2c[nH]nc2C1 378410748 IRUPLNOPYMPNBS-SNVBAGLBSA-N 273.296 1.991 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1ncccc1F 170605149 SUJWHOYKBJMVDS-UHFFFAOYSA-N 290.254 1.641 5 50 CDBA O=[N+]([O-])c1ccc(-n2cnc(Br)n2)cc1 66054530 CMJIFYZIPZNUOY-UHFFFAOYSA-N 269.058 1.938 5 50 CDBA in-vitro CC[C@@]1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 135443645 WJPWMMYPGWBZLK-AWEZNQCLSA-N 294.307 1.942 5 50 CDBA C[C@H]1[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCN1C 408085696 BZRBKCMUQPQJSH-VHSXEESVSA-N 293.323 1.465 5 50 CDBA COCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 2774162 WIZOQSMTSBQVMW-UHFFFAOYSA-N 258.661 1.624 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 407979781 AWMLDOKRYPQFHE-BBBLOLIVSA-N 278.312 1.698 5 50 CDBA O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)N2CCCCC2)cc1 96027512 PJWKHFUUONPSEU-ZIAGYGMSSA-N 280.324 1.475 5 50 CDBA N[C@@H]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 125146122 OBCRDRKAYPZJNR-ZJUUUORDSA-N 299.352 1.143 5 50 CDBA CN[C@H](C)CNc1ncc([N+](=O)[O-])cc1Br 261575818 JWQQAHWVOITFSQ-ZCFIWIBFSA-N 289.133 1.772 5 50 CDBA Cc1cc([N+](=O)[O-])cc2nc(N3CCOCC3)oc12 1772491488 OKKNINFVLYUEPZ-UHFFFAOYSA-N 263.253 1.881 5 50 CDBA CC(C)NC(=O)c1ccc2nc3ccccc3c(=O)n2c1 422960 KVDIOCXYSGBAJH-UHFFFAOYSA-N 281.315 1.986 5 50 CDBA COC[C@H](Nc1ccc([N+](=O)[O-])cn1)[C@@H]1CCCO1 225714329 NBIGRCVIIPSXPU-QWRGUYRKSA-N 267.285 1.596 5 50 CDBA O=[N+]([O-])c1ccc2[nH]cc(CN3CCOCC3)c2c1 31623080 LINZZROYNSDZPC-UHFFFAOYSA-N 261.281 1.908 5 50 CDBA Cc1nn(CC(=O)N2CCCC2)c(C)c1[N+](=O)[O-] 197077 JGVSWPFKNLOOTF-UHFFFAOYSA-N 252.274 1.031 5 50 CDBA CCOCCC(=O)Nc1cc([N+](=O)[O-])ccc1OC 4828801 VRGXBWCXSYTTMT-UHFFFAOYSA-N 268.269 1.969 5 50 CDBA CC(=O)N1CCN(C(=S)c2cccc([N+](=O)[O-])c2)CC1 305966 JZVCVYNWHJLCAX-UHFFFAOYSA-N 293.348 1.434 5 50 CDBA CCOC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1C 2871060 ZCRCMXLMANGZGG-UHFFFAOYSA-N 266.253 1.196 5 50 CDBA COc1cc([N+](=O)[O-])c(NC(=O)[C@H]2CCCO2)cc1F 585125829 GYUWBCQQTXGFGO-SNVBAGLBSA-N 284.243 1.860 5 50 CDBA CSc1nnn(Cc2ccc([N+](=O)[O-])cc2)n1 1059292 GLHUSVSELMLKEB-UHFFFAOYSA-N 251.271 1.352 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC1=NC(=O)CS1 4951411 FUDVBVUENMBNBV-UHFFFAOYSA-N 267.266 1.645 5 50 CDBA CC(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(F)(F)F 348092997 NHJIOKVDUZZRMS-SECBINFHSA-N 294.233 1.494 5 50 CDBA CCOC(=O)c1nn(CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 217038808 TXZXYSQDVPZRJV-UHFFFAOYSA-N 299.283 1.310 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCCc1ccccc1 4743077 HNPRPJWNKVXEOU-UHFFFAOYSA-N 274.280 1.150 5 50 CDBA Cc1cc(C)n(C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1 449100 IOVJOXZKFTZDAO-GFCCVEGCSA-N 291.307 1.848 5 50 CDBA C[C@H]1CN(c2cc(N)c([N+](=O)[O-])cc2F)C[C@H](C)N1 4623617 CNHUHUYYUWJDRI-YUMQZZPRSA-N 268.292 1.503 5 50 CDBA C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 366264312 DIUFJAYKTWCHIX-DOMZBBRYSA-N 292.335 1.975 5 50 CDBA CC(C)(C)C1CCC(O)(CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])CC1 170624122 MXIPLZZAXFWZAV-XWAURUHHSA-N 298.383 1.735 5 50 CDBA CC[C@@H]1CN(c2ccnc(F)c2[N+](=O)[O-])CCO1 585118453 PMJSJJDRQGVKOL-MRVPVSSYSA-N 255.249 1.744 5 50 CDBA Cc1nn(C(=O)Cn2nc([N+](=O)[O-])cc2C)c(C)c1Cl 1068696 AJZFMCZGELWDEQ-UHFFFAOYSA-N 297.702 1.907 5 50 CDBA Cc1ccc([C@H]2N[C@H](C(=O)O)CS2)cc1[N+](=O)[O-] 32990 XCCZFOBFTQIDBX-WPRPVWTQSA-N 268.294 1.691 5 50 CDBA CC(=O)OC(OC(C)=O)c1ccc([N+](=O)[O-])s1 36721 QYESFCLSVSNRTN-UHFFFAOYSA-N 259.239 1.781 5 50 CDBA CCn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)cn1 473545 KXASFJDQOBCUNK-UHFFFAOYSA-N 274.280 1.741 5 50 CDBA O=C(O)c1ccc(NC[C@H]2CCCO2)c([N+](=O)[O-])c1 4978110 XZOJOADZBOXPHS-SECBINFHSA-N 266.253 1.884 5 50 CDBA CC1=C[C@H](C)[C@@H]2C(=O)N(CCC[N+](C)(C)C)C(=O)[C@@H]2C1 101138424 GOEBHGSAJXXUNJ-MJBXVCDLSA-N 279.404 1.670 5 50 CDBA CCc1cc([N+](=O)[O-])c(N(C)CC(N)=O)cc1Cl 241590534 PFQSQFGMGFZNBR-UHFFFAOYSA-N 271.704 1.732 5 50 CDBA C[C@H]1C[C@@H](C)C[C@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 286441560 LVCTYBZCDNAZPQ-BRPSZJMVSA-N 266.301 1.872 5 50 CDBA C[C@@H](C(=O)Nc1cccnc1)n1cc([N+](=O)[O-])cn1 1423168 RXLQCEHRCNOMBW-QMMMGPOBSA-N 261.241 1.386 5 50 CDBA Cc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-] 4021537 ZKVATJPXXAGNNZ-UHFFFAOYSA-N 270.310 1.688 5 50 CDBA C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)[C@@H](C(N)=O)C1 952993331 WVACXDXSYNAGJK-PRHODGIISA-N 281.287 1.824 5 50 CDBA Cc1cnc(OCc2cnns2)c([N+](=O)[O-])c1 253425840 JFKSMRLNHWLXOK-UHFFFAOYSA-N 252.255 1.729 5 50 CDBA COc1ccc(OCCn2ccnn2)c([N+](=O)[O-])c1 128022028 WAFSPVDYFWAABW-UHFFFAOYSA-N 264.241 1.274 5 50 CDBA CCN(c1ncc([N+](=O)[O-])cn1)[C@@H](C)C(=O)OC(C)(C)C 585098916 QAKGUNNHANDLNX-VIFPVBQESA-N 296.327 1.941 5 50 CDBA O=C(COc1ccccc1[N+](=O)[O-])Nc1nncs1 148496 OVFJMRYHHRCJIN-UHFFFAOYSA-N 280.265 1.464 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccc(F)cc1 4821115 YCLHGOCLMIOTLO-UHFFFAOYSA-N 278.243 1.247 5 50 CDBA O=[N+]([O-])c1cccc(-c2cn(O)c3c([n+]2=O)CCC3)c1 334157306 UJMTZRODJUEVQX-UHFFFAOYSA-N 274.256 1.704 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@H](O)CN2CCCCC2)cc1 32694 HUKIYIZTJIPXIR-CYBMUJFWSA-N 280.324 1.820 5 50 CDBA O=C(O)CCCC(=O)Nc1cc([N+](=O)[O-])ccc1O 4917983 ZZUDSUAHNMJDLR-UHFFFAOYSA-N 268.225 1.494 5 50 CDBA Cc1cc(C(N)=O)cc([N+](=O)[O-])c1Br 306816138 DAHXBPXTQUXLTK-UHFFFAOYSA-N 259.059 1.765 5 50 CDBA Cc1nn([C@@H](C)C(=O)NC[C@@H]2CCCO2)c(C)c1[N+](=O)[O-] 1071180 ZBVIZKKEENXYKH-QWRGUYRKSA-N 296.327 1.264 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)c1cnccn1 4904250 SAOSWMUQIUDZNY-UHFFFAOYSA-N 258.237 1.946 5 50 CDBA CC(=O)CCCSc1ncc([N+](=O)[O-])c(=N)[nH]1 408522669 LIZBVFZFWSLNPE-UHFFFAOYSA-N 256.287 1.259 5 50 CDBA COc1ccccc1[C@@H]1NC(=O)CC[C@H]1[N+](=O)[O-] 90841 XLHBDHDXTFIGJA-SKDRFNHKSA-N 250.254 1.292 5 50 CDBA CCC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4818975 XCZKJWFWQYAFBJ-UHFFFAOYSA-N 281.287 1.793 5 50 CDBA Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ccccc1 88446 ANDXGHGQPGMSAU-UHFFFAOYSA-N 274.280 1.416 5 50 CDBA Cc1c(NC(=O)N[C@H]2C[C@H](C)OC2=O)cccc1[N+](=O)[O-] 585119926 AFHKOTPAUVFMMQ-XVKPBYJWSA-N 293.279 1.729 5 50 CDBA CC[C@H](O)[C@@H]1CC(c2ccc([N+](=O)[O-])cc2)=NO1 4576757 MFUIMKPWEBKXMS-RYUDHWBXSA-N 250.254 1.859 5 50 CDBA C[N+](C)(C)C[C@@H](CC(=O)O)OC(=O)/C=C/c1ccccc1 138952586 IHFYXXVXPHBYPU-ATWMFIQVSA-O 292.355 1.793 5 50 CDBA C[C@@H]1C(=O)NCCCN1c1nc2sccn2c1[N+](=O)[O-] 170606334 VMCNDWHVXDQQKK-SSDOTTSWSA-N 295.324 1.019 5 50 CDBA COc1cc(CN2CCCN(C)CC2)cc([N+](=O)[O-])c1O 4832322 ULYUWBYPEDDMBQ-UHFFFAOYSA-N 295.339 1.447 5 50 CDBA CCOc1ccccc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1428117 ZXFLZCFQQSGGMI-UHFFFAOYSA-N 290.279 1.829 5 50 CDBA O=C1[C@H]2[C@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@H]1CC[C@H]2O1 584904254 AQNMNKYXHBFFMN-DDHJBXDOSA-N 288.259 1.262 5 50 CDBA CC(C)NC[C@H]1CCc2cc(CO)c([N+](=O)[O-])cc2N1 570 XCGYUJZMCCFSRP-GFCCVEGCSA-N 279.340 1.812 5 50 CDBA biogenic,world O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@]3(CCOC3)C2)c(F)c1 408472287 USVSLHIGJNJNQK-NOZJJQNGSA-N 297.286 1.879 5 50 CDBA O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 169685307 VYHCUDLEIGISHF-WYUUTHIRSA-N 286.243 1.038 5 50 CDBA O=[N+]([O-])c1cccc2c(S(=O)(=O)O)cccc12 1685530 FTNWWQOFRQZWSC-UHFFFAOYSA-N 253.235 1.995 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1[N+](=O)[O-] 3878525 JIUBTRVKXPIHOL-UHFFFAOYSA-N 253.214 1.340 5 50 CDBA CC(=O)N1CCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c21 4551773 KQQKPOGPCKAIFD-UHFFFAOYSA-N 251.198 1.412 5 50 CDBA CCN1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC1 8653707 PPWVZYXBHUGWAT-UHFFFAOYSA-N 294.380 1.929 5 50 CDBA CN(CC(N)=O)c1ccnc2c([N+](=O)[O-])cccc12 432337758 UVIZTMPLOSTBNY-UHFFFAOYSA-N 260.253 1.065 5 50 CDBA Cc1nn(C[C@H]2CNC(=O)O2)c2ccc([N+](=O)[O-])cc12 282224365 OLDUQKLYMRVTOX-SECBINFHSA-N 276.252 1.361 5 50 CDBA CO[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 170005771 KFNLKQYTYAGWNH-ZWNOBZJWSA-N 294.307 1.988 5 50 CDBA CC(C)[C@@H]1C[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1 456329238 LEOQYMTWFMPJEZ-ONGXEEELSA-N 266.301 1.200 5 50 CDBA CCNC(=O)CNc1nc(-c2ccc([N+](=O)[O-])cc2)no1 170602194 FFGLDQSUWFROCY-UHFFFAOYSA-N 291.267 1.193 5 50 CDBA NC(=O)[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 4987194 SFTGNNSWLGSSMZ-LLVKDONJSA-N 263.297 1.292 5 50 CDBA O=C(c1ccc([N+](=O)[O-])cc1F)N1CCOCC1 54058221 YITQJJGACFTTCN-UHFFFAOYSA-N 254.217 1.206 5 50 CDBA C[N+](C)(C)C[C@H](CC(=O)O)OC(=O)/C=C/c1ccccc1 138952709 IHFYXXVXPHBYPU-HBWSCVEGSA-O 292.355 1.793 5 50 CDBA CNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] 336652517 IMKAISKXGMJCSY-UHFFFAOYSA-N 285.108 1.810 5 50 CDBA CC(C)(F)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 408513744 PTMINNVWFCCUAF-UHFFFAOYSA-N 269.276 1.871 5 50 CDBA C[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)[C@@H](C(N)=O)C1 1615588186 YLTODGITGGNGHI-WCBMZHEXSA-N 264.285 1.080 5 50 CDBA O=[N+]([O-])c1ccc(N[C@@H](CO)Cc2nccs2)nc1 1615585699 AREOCSFZDWNVHG-MRVPVSSYSA-N 280.309 1.462 5 50 CDBA Cc1cn(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cn1 313615 HJKXCACVMJCTAX-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA Nc1nnc(COc2ccc([N+](=O)[O-])cc2)s1 322772 PBNXPSIRMVBKQH-UHFFFAOYSA-N 252.255 1.608 5 50 CDBA O=[N+]([O-])c1ccc(OCCCN2CCNCC2)cc1 4985740 AHZBYRKJWYHWEO-UHFFFAOYSA-N 265.313 1.269 5 50 CDBA C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 1000976 QDOJMFPATKMARA-SNVBAGLBSA-N 274.280 1.669 5 50 CDBA COC(=O)c1cnc(N2CCCC2)c([N+](=O)[O-])c1 95495993 INFVPPLMJDRDRY-UHFFFAOYSA-N 251.242 1.377 5 50 CDBA C[C@H]1CCCC[C@@]1(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 408520803 XQNKCPGWTLGUMK-GXFFZTMASA-N 280.328 1.876 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCC[C@@H](CO)C2)c1 23114972 YGSACGKXKWFRRP-GFCCVEGCSA-N 250.298 1.799 5 50 CDBA CO[C@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 170005775 KFNLKQYTYAGWNH-MFKMUULPSA-N 294.307 1.988 5 50 CDBA CCN(CCN(C)C)Cc1ccc([N+](=O)[O-])cc1 215712 KLLPNNXAYQIXKY-UHFFFAOYSA-N 251.330 1.978 5 50 CDBA CCN1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4984045 XMJXGMZBNFICRS-UHFFFAOYSA-N 253.277 1.876 5 50 CDBA in-vitro Cc1cc([N+](=O)[O-])nn1C[C@@H](O)c1ccccc1F 170078233 VJNFCSVQMKPDFP-LLVKDONJSA-N 265.244 1.972 5 50 CDBA CC(=O)c1ccc(Sc2nnnn2C)c([N+](=O)[O-])c1 337922 ILBTUJAYEYKEKY-UHFFFAOYSA-N 279.281 1.472 5 50 CDBA O=[N+]([O-])c1cc(Cl)c(NCCO)cc1NCCO 4582495 ZEARLPPIUCBHRP-UHFFFAOYSA-N 275.692 1.057 5 50 CDBA CC(C)NC(=S)NNc1ccc([N+](=O)[O-])cc1 4793252 UBNKDNJANOEMNI-UHFFFAOYSA-N 254.315 1.794 5 50 CDBA COC1(CNc2cc(N)c([N+](=O)[O-])cn2)CCOCC1 1336425051 BHEAHSZNIGQIDN-UHFFFAOYSA-N 282.300 1.180 5 50 CDBA Cc1cc(C(=O)N[C@H]2CCSC2=O)ccc1[N+](=O)[O-] 177067 XCHMUCGTSIINNI-VIFPVBQESA-N 280.305 1.665 5 50 CDBA COc1ccc(C(=O)O)cc1Cn1cc([N+](=O)[O-])cn1 4237611 SMTTWBNEGXXXDN-UHFFFAOYSA-N 277.236 1.546 5 50 CDBA COc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])c(OC)c1 3912599 DIVUSZWHUFVMIR-UHFFFAOYSA-N 291.267 1.728 5 50 CDBA CNC(=O)c1cccc([N+](=O)[O-])c1Br 142430654 DQWYQSKILSCKCS-UHFFFAOYSA-N 259.059 1.717 5 50 CDBA CN=c1[nH]ccc(C(=O)NCC2(C(C)C)CC2)c1[N+](=O)[O-] 408518239 XSVPFZLDVGFWIK-UHFFFAOYSA-N 292.339 1.619 5 50 CDBA O=c1c([N+](=O)[O-])cccn1Cc1cc(O)ccc1[N+](=O)[O-] 328596043 PEYKWSYRMDKUSX-UHFFFAOYSA-N 291.219 1.419 5 50 CDBA CCN1CCN(c2cc(NC)cc([N+](=O)[O-])c2)CC1 122709550 UPRLMEQCUIOPSB-UHFFFAOYSA-N 264.329 1.778 5 50 CDBA C[C@@H](C(=O)NC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 471662 KZPAKHJKISMATP-ZWNOBZJWSA-N 278.308 1.994 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCNCC2)cc1 226462122 MLYIIFTUOQGDLJ-SNVBAGLBSA-N 299.352 1.015 5 50 CDBA O=C(O)c1cc(Br)cc([N+](=O)[O-])c1O 4014522 JNYJGSJKQMVWRL-UHFFFAOYSA-N 262.015 1.761 5 50 CDBA in-vitro Cc1cccc(-n2c(=O)c(=O)[nH]c3cc([N+](=O)[O-])ccc32)c1 5490883 ZVEOQMWPUTWWCR-UHFFFAOYSA-N 297.270 1.896 5 50 CDBA CCCCCC(=O)O[C@@H](CC(=O)O)C[N+](C)(C)C 3995625 VVPRQWTYSNDTEA-NSHDSACASA-O 260.354 1.659 5 50 CDBA endogenous,in-man Cc1c(C[N+](C)(C)C)c(=O)n(-c2ccccc2)n1C 396388 KCHKCDHNKGXOCA-UHFFFAOYSA-N 260.361 1.691 5 50 CDBA COc1ccc(C(=O)Nc2cnccn2)cc1[N+](=O)[O-] 1054207 XKTSGOXUXZYWHF-UHFFFAOYSA-N 274.236 1.646 5 50 CDBA CC(C)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 4551785 UMWOXYJRLFRVOH-UHFFFAOYSA-N 267.241 1.889 5 50 CDBA CCNc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 670417726 MCHIAFPYMIVBFP-UHFFFAOYSA-N 255.186 1.633 5 50 CDBA Cc1cc(=O)nc(NC(=N)Nc2cccc([N+](=O)[O-])c2)[nH]1 18107030 AJUMTJKQYYPVAK-UHFFFAOYSA-N 288.267 1.445 5 50 CDBA Cn1cnnc1[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 952991615 BXMJGXRJVXMFJD-VIFPVBQESA-N 291.286 1.856 5 50 CDBA Cc1cc(OCC(=O)Nc2nncs2)ccc1[N+](=O)[O-] 1056281 FVFZGMCPOXRQRJ-UHFFFAOYSA-N 294.292 1.772 5 50 CDBA CCCCNc1nc(N2CCOCC2)nc(C)c1[N+](=O)[O-] 4802596 FPKXVMUDGPXOGW-UHFFFAOYSA-N 295.343 1.742 5 50 CDBA C[C@H](C(=O)NCc1ccco1)n1cc([N+](=O)[O-])cn1 1424775 JZJBDEVURRMFIO-MRVPVSSYSA-N 264.241 1.262 5 50 CDBA Cc1n[nH]c(SCc2ccc([N+](=O)[O-])cc2)nc1=O 96316548 PJNFTDAPKXTSQV-UHFFFAOYSA-N 278.293 1.674 5 50 CDBA Cc1[nH]cnc1CNC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] 269472672 IZCOISYIFYTERT-UHFFFAOYSA-N 292.299 1.403 5 50 CDBA O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c(F)c1 408463043 AZMHICIIVWCVIT-IXQJSDIHSA-N 279.271 1.334 5 50 CDBA CCc1cc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)[nH]n1 166162768 YAIIAZVDHWYPFG-UHFFFAOYSA-N 276.252 1.838 5 50 CDBA O=[N+]([O-])c1ncc(N2CCN3CCCC[C@H]2C3)cc1O 1776006740 ZGYFYHZHOMXQES-JTQLQIEISA-N 278.312 1.370 5 50 CDBA COc1cc(CNCC2(O)CCC2)c([N+](=O)[O-])cc1O 237131188 FTBLWEZYRZQGTM-UHFFFAOYSA-N 282.296 1.314 5 50 CDBA Cc1ccnc(N(C)CCN(C)CC(F)F)c1[N+](=O)[O-] 170619637 TWPUIMRQTJFPKS-UHFFFAOYSA-N 288.298 1.931 5 50 CDBA O=C(OCc1ccc([N+](=O)[O-])cc1)c1cnccn1 306655 KJQIVTIQHAUTJV-UHFFFAOYSA-N 259.221 1.742 5 50 CDBA CCOC(=O)C1=NN(c2cccc([N+](=O)[O-])c2C)CC1=O 2519713 HJTIHHPBBIOTMR-UHFFFAOYSA-N 291.263 1.211 5 50 CDBA Cn1c(=O)c([N+](=O)[O-])c(N2CCOCC2)c2ccccc21 3958336 OIXZHQVCLPYILW-UHFFFAOYSA-N 289.291 1.283 5 50 CDBA O=[N+]([O-])c1cccnc1NCC[S@](=O)C(F)(F)F 585092549 DLQRYYNJGPYOLG-SFHVURJKSA-N 283.231 1.670 5 50 CDBA CCN(CC(N)=O)Cc1ccc(C)c([N+](=O)[O-])c1 188060817 HTYMGEWFGUPOOD-UHFFFAOYSA-N 251.286 1.210 5 50 CDBA CCOC[C@H](O)COc1cc(C)c([N+](=O)[O-])cc1F 193835670 UXBZBFUNMKHGOQ-VIFPVBQESA-N 273.260 1.819 5 50 CDBA CNc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2nc1NC 8205139 QJPYARHRMNJIKM-UHFFFAOYSA-N 278.228 1.530 5 50 CDBA O=[N+]([O-])c1ccc2nc(N3CCNCC3)sc2c1 242027 RBZWYLUVTPLLOU-UHFFFAOYSA-N 264.310 1.614 5 50 CDBA COC(=O)c1ccc(Cn2c([N+](=O)[O-])cnc2C)cc1 1005806 CDQLGLQGLGSHTH-UHFFFAOYSA-N 275.264 1.935 5 50 CDBA COc1cc([N+](=O)[O-])cc(C=O)c1O[C@H](C)C(=O)O 6007863 MIQCEOGOTBKVCB-ZCFIWIBFSA-N 269.209 1.268 5 50 CDBA O=[N+]([O-])c1cccnc1NCC[S@@](=O)C(F)(F)F 585092548 DLQRYYNJGPYOLG-GOSISDBHSA-N 283.231 1.670 5 50 CDBA C[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)[C@H](C(N)=O)C1 1615588185 YLTODGITGGNGHI-SCZZXKLOSA-N 264.285 1.080 5 50 CDBA C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)CN(C)C 2824548 NHNBVPWRHORSMN-SNVBAGLBSA-N 265.313 1.522 5 50 CDBA NC(=O)c1ccc(Nc2ccc3nonc3c2[N+](=O)[O-])cc1 4030495 OKNORMALFRSNRP-UHFFFAOYSA-N 299.246 1.974 5 50 CDBA CCNC(=O)/N=c1\sc([N+](=O)[O-])cn1CC1CC1 71771645 ROEVKGGMILGALV-BENRWUELSA-N 270.314 1.498 5 50 CDBA CCc1[nH]nc(C(=O)N2CCSCC[C@H]2C)c1[N+](=O)[O-] 192937151 VEFICPSDPJYXLS-MRVPVSSYSA-N 298.368 1.848 5 50 CDBA O=[N+]([O-])c1cccc(CO)c1I 199475466 LZPYYIKBDKBSTA-UHFFFAOYSA-N 279.033 1.692 5 50 CDBA CC(=O)N[C@@H](CSc1ccc([N+](=O)[O-])cc1)C(=O)O 2567271 LOBKSYPZBSVLLE-JTQLQIEISA-N 284.293 1.276 5 50 CDBA in-vitro CN(C)CC(CN(C)C)OC(=O)c1ccc([N+](=O)[O-])cc1 71772747 IDOQIVCBQMDERR-UHFFFAOYSA-N 295.339 1.243 5 50 CDBA Cc1ccnc(N2CC[C@@H](n3ccnn3)C2)c1[N+](=O)[O-] 585092477 ZEXUUYLNFDNXPU-SNVBAGLBSA-N 274.284 1.341 5 50 CDBA O=[N+]([O-])c1cccnc1N1CC[C@@H](c2cc(O)n[nH]2)C1 585092769 NAHBUGYGHYFGTF-MRVPVSSYSA-N 275.268 1.412 5 50 CDBA CC(=O)N1CCO[C@]1(C)c1ccc([N+](=O)[O-])cc1 437803 NKSLLFHRRVNKHI-GFCCVEGCSA-N 250.254 1.646 5 50 CDBA NS(=O)(=O)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 2243201 JZDSLOPGYDEFOJ-UHFFFAOYSA-N 270.188 1.261 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cccc(O)c1 2883126 XUAPZAPRWWHJGW-UHFFFAOYSA-N 276.252 1.444 5 50 CDBA Cc1cnc(I)c([N+](=O)[O-])c1 167724021 MMWYUEMFUZVJGK-UHFFFAOYSA-N 264.022 1.903 5 50 CDBA O=[N+]([O-])c1cc([N+](=O)[O-])c2cccnc2c1NCCO 3877519 UQEAWZPAVCQZQU-UHFFFAOYSA-N 278.224 1.455 5 50 CDBA CNC(=O)[C@@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])nc1 345151236 QWWXKHCIZDPTQT-NXEZZACHSA-N 264.285 1.316 5 50 CDBA COc1ccc(NC(=O)N2CC[C@@H](CO)C2)c([N+](=O)[O-])c1 584906989 WFJOIAMAUUGHQO-SECBINFHSA-N 295.295 1.450 5 50 CDBA CCN(CC)C[C@H](O)COc1ccccc1[N+](=O)[O-] 4819644 DWQSWQCXMFRAFE-NSHDSACASA-N 268.313 1.676 5 50 CDBA O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCO1 83640 DOALYTJTUMQIEH-LBPRGKRZSA-N 264.281 1.433 5 50 CDBA CC(=O)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4998311 VUEVDSOEGUHZPY-UHFFFAOYSA-N 265.269 1.390 5 50 CDBA CCNC(=O)/N=c1\sc([N+](=O)[O-])cn1C(C)C 71771589 NPYICBPKVJGISB-LUAWRHEFSA-N 258.303 1.669 5 50 CDBA O=[N+]([O-])c1ccc2ncc(I)n2c1 89202008 FKFUCKXVHCGGOF-UHFFFAOYSA-N 289.032 1.847 5 50 CDBA Cn1nccc1-c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1 225586440 LZFUHEYZCIRSIB-UHFFFAOYSA-N 286.251 1.628 5 50 CDBA O=C(O)C[S@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 53995143 YRJUVGJXBGUUER-LJQANCHMSA-N 297.210 1.806 5 50 CDBA in-vitro CN1CCN(c2cc(N3CCCC3)ccc2[N+](=O)[O-])CC1 4455697 KJPRSFLHKDRLCX-UHFFFAOYSA-N 290.367 1.947 5 50 CDBA COc1ccc(CSc2nnnn2C)cc1[N+](=O)[O-] 63348 WCZPIPRYSNPQIK-UHFFFAOYSA-N 281.297 1.419 5 50 CDBA O=[N+]([O-])c1c(NCCCO)cc(Cl)c2nonc12 3882523 MEDGYQJLQCPHTI-UHFFFAOYSA-N 272.648 1.579 5 50 CDBA NC1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 157583272 LEGVBGYYIQRYHS-UHFFFAOYSA-N 277.324 1.477 5 50 CDBA O=C(O)c1ccc([N+](=O)[O-])c(N2CCOCC2)c1 34925736 QCUUEEDAOFTYRA-UHFFFAOYSA-N 252.226 1.130 5 50 CDBA in-vitro Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cccnc1 1428934 RFABJIXLPKVUAG-UHFFFAOYSA-N 261.241 1.133 5 50 CDBA O=[N+]([O-])c1cccnc1S(=O)(=O)c1ccccc1 1406482 QBXNQOWQGUPAEO-UHFFFAOYSA-N 264.262 1.823 5 50 CDBA CCOC(=O)c1cc(C(=O)OCC)cc([N+](=O)[O-])c1 2581980 PYBFOSCCWZPUSC-UHFFFAOYSA-N 267.237 1.948 5 50 CDBA Nc1nc([N+](=O)[O-])n(C23CC4CC(CC(C4)C2)C3)n1 4991805 PAFNCHIEEPASNO-UHFFFAOYSA-N 263.301 1.694 5 50 CDBA CC(C)[C@@H]1C(C#N)(C#N)C(C#N)=C(N)[C@@]1(C)[N+](=O)[O-] 22135329 MKNXHHJVJVVPHB-ONGXEEELSA-N 259.269 1.078 5 50 CDBA O=C(NCCNc1ccc([N+](=O)[O-])cn1)c1ccco1 19852990 HJSNRQNYSGVSRR-UHFFFAOYSA-N 276.252 1.425 5 50 CDBA CN1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 66588 ASWYGKDUTIDWPC-UHFFFAOYSA-N 278.337 1.956 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@@H]1O 16650579 LCTLIEHXUJWWHU-STQMWFEESA-N 278.308 1.970 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]([C@@H]2CCOC2)C1 408426465 UMRJEIOLAUHUNK-NXEZZACHSA-N 266.301 1.191 5 50 CDBA Cc1cc(NC[C@@H](O)c2cncs2)ncc1[N+](=O)[O-] 952993817 KKUZPPIIUVOCRX-SECBINFHSA-N 280.309 1.900 5 50 CDBA Cn1nc([N+](=O)[O-])nc1OCc1nc2ccccc2n1C 201641 ZSNPYJZCUUUWCA-UHFFFAOYSA-N 288.267 1.189 5 50 CDBA COc1ccc(Nc2ncnc(N)c2[N+](=O)[O-])cc1OC 3912600 RIRIDYAIMIBUMQ-UHFFFAOYSA-N 291.267 1.728 5 50 CDBA O=c1[nH]c(/C=C\c2cccc(F)c2)nc(O)c1[N+](=O)[O-] 9010332 XRZBOMUSLBFFEE-PLNGDYQASA-N 277.211 1.693 5 50 CDBA O=C(COc1ccc(/C=C\[N+](=O)[O-])cc1)N1CCOCC1 4476503 UKMFYHIIVBBYIA-WAYWQWQTSA-N 292.291 1.172 5 50 CDBA Nc1c(F)cc([N+](=O)[O-])cc1I 575726615 GJTOPFHTCCIELI-UHFFFAOYSA-N 282.012 1.921 5 50 CDBA COCCCNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 2932906 UALKLUQPEUUXDT-UHFFFAOYSA-N 296.279 1.148 5 50 CDBA COC[C@@H](Nc1ccc([N+](=O)[O-])cn1)[C@@H]1CCCO1 225714359 NBIGRCVIIPSXPU-MNOVXSKESA-N 267.285 1.596 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)n2cccn2)cc1 168712 NBWIABAYKSJVQT-UHFFFAOYSA-N 253.239 1.028 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)NCc1ccccc1 1070767 ZMHFMQQTIRFOHJ-UHFFFAOYSA-N 274.280 1.416 5 50 CDBA O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 225397944 RHTXPNZOIRDFBU-RBLKWDMZSA-N 277.280 1.172 5 50 CDBA COC(=O)C(C)(C(=O)OC)c1ccc([N+](=O)[O-])cc1 1399353 RFISOAYKEOMLCU-UHFFFAOYSA-N 267.237 1.199 5 50 CDBA O=C(O)CCCN1CCN(c2ccccc2[N+](=O)[O-])CC1 122377363 DLJGMHIGSYYXST-UHFFFAOYSA-N 293.323 1.582 5 50 CDBA COC(=O)[C@@](C)(O)CNc1ccc(Cl)cc1[N+](=O)[O-] 349252401 MBWQHNIMLMSYNZ-NSHDSACASA-N 288.687 1.584 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CCC(=O)Nc1nccs1 374503 SYADDCGAKKNHNE-UHFFFAOYSA-N 281.297 1.585 5 50 CDBA O=c1ccn(Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] 130841040 KPAVFZOKIIULLG-UHFFFAOYSA-N 296.286 1.991 5 50 CDBA CCCc1[nH]nc(C(=O)N2C[C@@H](CN)C[C@@H]2C)c1[N+](=O)[O-] 261900850 WPMQAIPRZJOIJU-DTWKUNHWSA-N 295.343 1.080 5 50 CDBA COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])o1 451968 RGZGSTBIAFBXGZ-SNVBAGLBSA-N 295.251 1.331 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCCN2CCN(C)CC2)c1 4868841 IRMDETIIFKBSPX-UHFFFAOYSA-N 293.367 1.920 5 50 CDBA Cc1nc([N+](=O)[O-])c(I)[nH]1 34925473 MFMHRKLNVLTIAV-UHFFFAOYSA-N 252.999 1.231 5 50 CDBA Cc1ccc(S(=O)(=O)n2ccc([N+](=O)[O-])c2)cc1 95910891 PHWKAWLXYVIHMU-UHFFFAOYSA-N 266.278 1.942 5 50 CDBA Cc1c([N+](=O)[O-])cc(C(=O)O)c([N+](=O)[O-])c1[N+](=O)[O-] 670425887 HMMJAHNUHPZZIS-UHFFFAOYSA-N 271.141 1.418 5 50 CDBA Cn1nnnc1SC/C=C/c1ccc([N+](=O)[O-])cc1 2500831 LRBYLQHHFWQXNZ-NSCUHMNNSA-N 277.309 1.924 5 50 CDBA N=C1NC(=O)/C(=C\c2cc3c(cc2[N+](=O)[O-])OCO3)S1 4953862 PCKPQIQQVUMWJQ-XNWCZRBMSA-N 293.260 1.462 5 50 CDBA O=C(CSCCO)Nc1ccc([N+](=O)[O-])cc1 5013892 SKMIQKKRNZTHTG-UHFFFAOYSA-N 256.283 1.259 5 50 CDBA CCOC(=O)COc1ncc(Cl)cc1[N+](=O)[O-] 5716914 RIGHEKDAFCNPND-UHFFFAOYSA-N 260.633 1.585 5 50 CDBA CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)C(=O)O 19093951 ZCZIHDVSTSPBPF-ZETCQYMHSA-N 283.236 1.658 5 50 CDBA Cc1ccc(NC(=O)N[C@@H](C)C(=O)O)c([N+](=O)[O-])c1 1775971269 QAMDATDNFXQLIY-ZETCQYMHSA-N 267.241 1.498 5 50 CDBA O=[N+]([O-])c1ncn(Cc2cccc(Br)c2)n1 454682 IVVDDPDKUYBVNJ-UHFFFAOYSA-N 283.085 1.997 5 50 CDBA C[C@H]1CCCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 483237 GFVWVGNMPYCJEO-QMMMGPOBSA-N 252.274 1.200 5 50 CDBA NCC(F)(F)CNc1ncc([N+](=O)[O-])cc1Cl 236187833 WPRXVRFGWRJROE-UHFFFAOYSA-N 266.635 1.649 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCNCCN(C)C)c1 5049777 AITAZLPFNQIDBX-UHFFFAOYSA-N 267.329 1.433 5 50 CDBA COCCCNc1ccc([N+](=O)[O-])cc1C(N)=O 5050796 AWQNDXUGDRWMQO-UHFFFAOYSA-N 253.258 1.142 5 50 CDBA O=C(O)c1ccc(Br)c(O)c1[N+](=O)[O-] 16384165 WZDACFAIFGWLTM-UHFFFAOYSA-N 262.015 1.761 5 50 CDBA CN1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4543479 HGWDCOBLBPWUHJ-UHFFFAOYSA-N 276.340 1.921 5 50 CDBA Cc1nc(N2CCC(C)CC2)nc(N(C)C)c1[N+](=O)[O-] 4951289 WSRDWQDUQSJDOQ-UHFFFAOYSA-N 279.344 1.996 5 50 CDBA O=[N+]([O-])c1cccc(OCCCN2CCOCC2)c1 20639448 AKDSKGYYVGNMDA-UHFFFAOYSA-N 266.297 1.696 5 50 CDBA CCOC(=O)[C@H]1CCCN(Cc2ccc([N+](=O)[O-])o2)C1 292224 VEQAQFMAAWUATB-JTQLQIEISA-N 282.296 1.963 5 50 CDBA CCCNC(=S)NC(=O)c1ccc(C)c([N+](=O)[O-])c1 2865631 LILXAWXWTWGLGD-UHFFFAOYSA-N 281.337 1.918 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CCCO1 4651096 IQRCPMXQFQPCRA-JTQLQIEISA-N 266.253 1.721 5 50 CDBA CCOC(=O)C(=O)OC[C@@H]1CCC[N@@+]2(C)CCCC[C@H]12 252441182 JPHOAYNPGBNGHY-WOSRLPQWSA-N 284.376 1.502 5 50 CDBA biogenic C[C@H]1[C@@H](C)N(C)CCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1 408085697 BZRBKCMUQPQJSH-ZJUUUORDSA-N 293.323 1.465 5 50 CDBA O=[N+]([O-])c1ccccc1CN1CCOC[C@]12CCOC2 193671658 YIPAQGFHALTRHT-CQSZACIVSA-N 278.308 1.586 5 50 CDBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCOCC1 3190749 LJCIHENDXKURCU-ZZXKWVIFSA-N 262.265 1.467 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@@H](O)CNC2CCCC2)cc1 5069400 GMKXDUGJTXJRHW-ZDUSSCGKSA-N 280.324 1.867 5 50 CDBA CN(CCOc1ccc([N+](=O)[O-])cc1)c1ccn(C)n1 285262583 ZTKFBCAQZBXZTA-UHFFFAOYSA-N 276.296 1.844 5 50 CDBA CN(C)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1 5060932 ANYKFKPTBDXMID-UHFFFAOYSA-N 252.274 1.278 5 50 CDBA O=C1CCCN1c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 12504793 WWDVYDJZGRUNNG-UHFFFAOYSA-N 267.197 1.335 5 50 CDBA CN1CCCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 295316 DQZALINDZMWWFT-UHFFFAOYSA-N 293.323 1.461 5 50 CDBA O=C(Cn1cnc([N+](=O)[O-])c1)NCCc1ccccc1 823957 FCQYHAXUZPPFGW-UHFFFAOYSA-N 274.280 1.150 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCN2CCN(C)CC2)c1 4842563 LCENFUGIKOOFAS-UHFFFAOYSA-N 279.340 1.529 5 50 CDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCOC[C@H]1C1CC1 119402817 WIMDLFXWPVBBEI-LBPRGKRZSA-N 292.291 1.551 5 50 CDBA Nc1c(C(=O)O)cc(C(F)(F)F)cc1[N+](=O)[O-] 144181681 GGLXUJWJTSSOIL-UHFFFAOYSA-N 250.132 1.894 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCc2ccccc2C1 1070299 BRUMXRFTVXAOLK-UHFFFAOYSA-N 286.291 1.376 5 50 CDBA CCOC(=O)c1cc(-n2cc([N+](=O)[O-])cn2)cnc1C 4820622 HJXLBMYLKMWLMD-UHFFFAOYSA-N 276.252 1.661 5 50 CDBA COC(=O)[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C[C@H]1C 276973478 UBSJOUWYXDDDBU-KOLCDFICSA-N 279.296 1.625 5 50 CDBA Cc1nc(N2C[C@H]3CCN(C)C[C@@H]3C2)ccc1[N+](=O)[O-] 1616021096 HJNNPIXNWKSRSK-VXGBXAGGSA-N 276.340 1.686 5 50 CDBA Cc1ccnc(N2CC[C@H](N3CCC3)C2)c1[N+](=O)[O-] 952883885 ZDSRDDPOJKANIA-NSHDSACASA-N 262.313 1.583 5 50 CDBA COc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 1233382 RKZOILOAZMEJEM-UHFFFAOYSA-N 285.199 1.897 5 50 CDBA CC[N@@+]1(C)[C@@H](c2ccc(OC)c(OC)c2)[C@@H](O)[C@H](O)[C@H]1C 252441331 QIVWXVZLBPQWKQ-DIWUDIOASA-N 296.387 1.335 5 50 CDBA biogenic COc1cccc(N[C@@H](C)C[S@@](C)=O)c1[N+](=O)[O-] 169041690 CJSOZBUGDNUKRV-ASCAZGACSA-N 272.326 1.782 5 50 CDBA Cc1nn(CC(=O)N2CCCCC2)c(C)c1[N+](=O)[O-] 432443 VMSOGQJYFNFWQL-UHFFFAOYSA-N 266.301 1.421 5 50 CDBA O=C(O)[C@@H]1CS[C@H](c2cccc([N+](=O)[O-])c2)N1 77923 SALHXESGFYVCIK-DTWKUNHWSA-N 254.267 1.383 5 50 CDBA O=[N+]([O-])c1ccc(OCCCN2CCOCC2)cc1 19607527 FWXCMZOZLKWFHZ-UHFFFAOYSA-N 266.297 1.696 5 50 CDBA O=CN1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 466861 RNTZJGIEGIYSPM-UHFFFAOYSA-N 297.698 1.162 5 50 CDBA COC(=O)COc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2684933 RXIWUACBCHMLAQ-UHFFFAOYSA-N 256.170 1.055 5 50 CDBA Nc1cc(F)c(I)cc1[N+](=O)[O-] 85107434 VYUKTTWGCYDBIV-UHFFFAOYSA-N 282.012 1.921 5 50 CDBA in-vitro CCOC(=O)c1c(O)c(=O)n(C)c2ccc([N+](=O)[O-])cc12 1857775548 OBVRAYVDWAOMOW-UHFFFAOYSA-N 292.247 1.329 5 50 CDBA COc1ccc(OC)c([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1 115948 CVLKDXLRWZVGRV-MFKMUULPSA-N 280.280 1.300 5 50 CDBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](C)(O)C1 276559 QCBVVHZUPZGHPN-LBPRGKRZSA-N 263.253 1.525 5 50 CDBA CC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 3877613 MPWLEWUMPDWNFL-ZETCQYMHSA-N 269.213 1.778 5 50 CDBA Cc1cn([C@H](C)C(=O)NCC(F)(F)F)nc1[N+](=O)[O-] 170619698 QXLRDKNNLSNRFS-ZCFIWIBFSA-N 280.206 1.339 5 50 CDBA CCN(CCNc1ccc([N+](=O)[O-])cn1)CC(F)F 170610806 ZQRHEPBOGGZODV-UHFFFAOYSA-N 274.271 1.989 5 50 CDBA COC(=O)Cn1c(=O)sc2cc([N+](=O)[O-])ccc21 5669570 FNWISMZJTTYKFW-UHFFFAOYSA-N 268.250 1.144 5 50 CDBA O=C(NCc1ccccn1)c1cccc([N+](=O)[O-])c1 272322 YFXIDEGFJPCTGO-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA CC(=O)NCCN(c1ccccc1[N+](=O)[O-])C(C)C 170597202 RRDNGFHQLPTCTF-UHFFFAOYSA-N 265.313 1.946 5 50 CDBA Cc1nn(CC(=O)N2CCCCCC2)c(C)c1[N+](=O)[O-] 197074 DFLQPVPZRIXOKU-UHFFFAOYSA-N 280.328 1.811 5 50 CDBA Nc1ncnc(Nc2ccc(F)cc2F)c1[N+](=O)[O-] 4059584 RWPWPWHDCMEJIF-UHFFFAOYSA-N 267.195 1.989 5 50 CDBA COC(=O)C(C(=O)OC)c1cc(F)ccc1[N+](=O)[O-] 19046053 BFQLFVFACPPWDX-UHFFFAOYSA-N 271.200 1.164 5 50 CDBA in-vitro COc1cc(CN2CCOCC2)cc([N+](=O)[O-])c1O 4988388 AQNJKECETFJYOT-UHFFFAOYSA-N 268.269 1.141 5 50 CDBA CCCc1[nH]nc(C(=O)N2C[C@H](CN)C[C@H]2C)c1[N+](=O)[O-] 261900848 WPMQAIPRZJOIJU-BDAKNGLRSA-N 295.343 1.080 5 50 CDBA O=c1ccnc(SCc2ccc([N+](=O)[O-])cc2)[nH]1 18152108 UNSOILCRMHBRPW-UHFFFAOYSA-N 263.278 1.970 5 50 CDBA C[C@@H]1CCCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 483238 GFVWVGNMPYCJEO-MRVPVSSYSA-N 252.274 1.200 5 50 CDBA CN1CCN(c2ccc(C(=O)O)cc2[N+](=O)[O-])CC1 3883227 OELXEJIGVMEIJK-UHFFFAOYSA-N 265.269 1.045 5 50 CDBA CC[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@H]1CCCO1 119372015 HYCGMXIDGBSXIK-ZWNOBZJWSA-N 294.307 1.988 5 50 CDBA NC(=O)C1=NO[C@H](CNc2ccc(Cl)cc2[N+](=O)[O-])C1 276637733 XFAGNAPMYIZYJJ-ZETCQYMHSA-N 298.686 1.290 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[C@H]1CCCO1 69500 WMAWDLWRKZLWPA-SECBINFHSA-N 276.248 1.370 5 50 CDBA CCOC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 157052 VNPCXITWHOOQAJ-UHFFFAOYSA-N 255.226 1.789 5 50 CDBA COC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879441 HRZZZJBSXMRSEP-UHFFFAOYSA-N 265.269 1.483 5 50 CDBA COc1cc([C@H]2NC(=O)NC(C)=C2[N+](=O)[O-])ccc1O 285073 DVOJAJQYIBUKRD-SNVBAGLBSA-N 279.252 1.263 5 50 CDBA COC(=O)[C@@H](CC(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1 860401 YALCHPSLBOUASK-GFCCVEGCSA-N 294.307 1.912 5 50 CDBA CCOC(=O)/C(O)=C\c1cc(OC)ncc1[N+](=O)[O-] 101132321 PAHPNPFDSJIXTJ-RUDMXATFSA-N 268.225 1.460 5 50 CDBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@]2(CCOC2)C1 155209713 QIUQNGPHHMMMKX-AWEZNQCLSA-N 292.291 1.553 5 50 CDBA Cc1nc(Oc2ccccc2[N+](=O)[O-])nc(N(C)C)n1 489522777 ZUYZUQGXWHIAIK-UHFFFAOYSA-N 275.268 1.947 5 50 CDBA CC(=O)N1CCCO[C@@H]1c1ccc([N+](=O)[O-])cc1 182919 RXPMFRZXNBTWRQ-GFCCVEGCSA-N 250.254 1.862 5 50 CDBA CS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1N1CCCCC1 575444396 NOBHPDRJLVEJBC-UHFFFAOYSA-N 299.352 1.957 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)N2CCCC2)c1 4369168 BUOYKAGBVRMTEO-UHFFFAOYSA-N 256.283 1.379 5 50 CDBA C[C@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CC=CCC1 331342539 KTFGPSIVGFDMON-LBPRGKRZSA-N 264.285 1.406 5 50 CDBA CC(C)(C)OC(=O)CNC(=O)Nc1ccncc1[N+](=O)[O-] 272728254 ORJSJXUXVCGELE-UHFFFAOYSA-N 296.283 1.453 5 50 CDBA O=[N+]([O-])c1ccc(CCN2CC[C@@]3(CNCCO3)C2)cc1 1616038531 NPJGMCCBDFVJRN-OAHLLOKOSA-N 291.351 1.202 5 50 CDBA NCCC1(O)CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 1616040815 FNXSWGNDDXSEPO-UHFFFAOYSA-N 293.367 1.313 5 50 CDBA CN(C)CCNC(=S)Nc1ccc([N+](=O)[O-])cc1 5041450 CGVUMRRPWSWRNS-UHFFFAOYSA-N 268.342 1.443 5 50 CDBA O=[N+]([O-])c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 5754357 JSGKLEGIFNLDJD-UHFFFAOYSA-N 288.300 1.909 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 407979784 AWMLDOKRYPQFHE-OPRDCNLKSA-N 278.312 1.698 5 50 CDBA Cc1cc(C(=O)N2CCN(C)CC2)ccc1[N+](=O)[O-] 20130305 GOYMFLDMEUPCBZ-UHFFFAOYSA-N 263.297 1.291 5 50 CDBA COC1(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)CCC1 119776472 KMHNAYXRECRJIT-UHFFFAOYSA-N 280.280 1.599 5 50 CDBA Cc1c(NC(=O)N[C@H]2C[C@@H](C)OC2=O)cccc1[N+](=O)[O-] 585119925 AFHKOTPAUVFMMQ-XCBNKYQSSA-N 293.279 1.729 5 50 CDBA O=C1C[C@@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 189724 SYLRVRWGYQCANJ-QMMMGPOBSA-N 251.267 1.030 5 50 CDBA CCOC(=O)C(=O)Nc1c(C)cc(C)cc1[N+](=O)[O-] 71772759 OZSMORJROCMVLQ-UHFFFAOYSA-N 266.253 1.713 5 50 CDBA C[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)C[C@@H](C2CC2)O1 408524589 VZRYRDJTRBUUJD-KCJUWKMLSA-N 278.312 1.576 5 50 CDBA Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cn1 476967 QHESUOIOGNWTNQ-UHFFFAOYSA-N 294.698 1.912 5 50 CDBA O=[N+]([O-])c1ccc(-c2nnnn2-c2ccccn2)cc1 33692 CORLKLAASROMEP-UHFFFAOYSA-N 268.236 1.633 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)N1CCc2ccccc21 371592 TXRDYHNAJJRMAI-UHFFFAOYSA-N 272.264 1.381 5 50 CDBA C[n+]1cn(-c2ccc([N+](=O)[O-])cn2)c2ccccc21 337789 ZDUWVRMYXRPPOX-UHFFFAOYSA-N 255.257 1.758 5 50 CDBA CC1(C(=O)O)COC(c2ccc([N+](=O)[O-])cc2)OC1 87581 RHBFUMRYUOSFNM-UHFFFAOYSA-N 267.237 1.731 5 50 CDBA O=C(O)CNc1c([N+](=O)[O-])c(=O)oc2ccccc12 3905406 GBUPCUONHLYFIU-UHFFFAOYSA-N 264.193 1.198 5 50 CDBA CN1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1 3880499 VHFFUHNPIHKHQP-UHFFFAOYSA-N 266.257 1.255 5 50 CDBA CN1C=CC(C(=O)NCCC[N+](C)(C)C)=CC1=CN=O 1857524717 LWHJSIZBXGUMTJ-UHFFFAOYSA-O 279.364 1.192 5 50 CDBA COC(=O)/C(C)=C/CNc1ccc([N+](=O)[O-])cn1 895511810 BRCALRLHVKHVAA-VMPITWQZSA-N 251.242 1.521 5 50 CDBA Cc1nn([C@H](C)C(=O)NCc2ccco2)c(C)c1[N+](=O)[O-] 1070546 BEOZSGVHJXIYFN-SNVBAGLBSA-N 292.295 1.879 5 50 CDBA O=[N+]([O-])c1ccccc1OCCn1cnc(Cl)n1 328593170 OXDJFYJMELHEQL-UHFFFAOYSA-N 268.660 1.919 5 50 CDBA O=[N+]([O-])c1ccc(N2CCNCC2)c2ncccc12 3877856 NOFLBEAANHNPIK-UHFFFAOYSA-N 258.281 1.553 5 50 CDBA CC(=O)NCCc1nc2cc([N+](=O)[O-])ccc2n1C 1056996 JQMGZLGOGZRJNO-UHFFFAOYSA-N 262.269 1.160 5 50 CDBA CNS(=O)(=O)c1c(Cl)cc([N+](=O)[O-])cc1Cl 309176834 DAXONBUYOCIWCJ-UHFFFAOYSA-N 285.108 1.810 5 50 CDBA Cn1cc([C@](C)(O)CNc2cc(F)ccc2[N+](=O)[O-])cn1 242001058 VCODUNIAQBWTGI-CYBMUJFWSA-N 294.286 1.787 5 50 CDBA CC(=O)c1ccc(N2C[C@H]3[C@H](N(C)C)[C@H]3C2)c([N+](=O)[O-])c1 385216080 SCZAYZXCYFEZES-JYAVWHMHSA-N 289.335 1.794 5 50 CDBA C[C@@H]1CCN[C@H](CNc2ncccc2[N+](=O)[O-])C1 585092926 UONVIZVMVUGPGJ-ZJUUUORDSA-N 250.302 1.790 5 50 CDBA COCCNc1cc(C)c(C(=O)OC)cc1[N+](=O)[O-] 145895693 SNTYTUDFTVLXOF-UHFFFAOYSA-N 268.269 1.748 5 50 CDBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4132292 JZOZDCYOYXBNHO-UHFFFAOYSA-N 267.260 1.402 5 50 CDBA Cc1cc(C)c(S(=O)(=O)n2cnc([N+](=O)[O-])c2)c(C)c1 6489927 PAKWZTBBQYPFSX-UHFFFAOYSA-N 295.320 1.954 5 50 CDBA N[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 124981367 RBTOVHWKCCAALK-NXEZZACHSA-N 299.352 1.143 5 50 CDBA O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H]1CC=CCC1 170674813 VHHFCBWSNAKLEZ-SNVBAGLBSA-N 279.300 1.199 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCN(c3ncccn3)CC2)cc1 19537544 RFGVMSMYKRYONH-UHFFFAOYSA-N 299.334 1.707 5 50 CDBA COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(C)C 307295 IRGWSRASMVFLNH-VIFPVBQESA-N 270.241 1.115 5 50 CDBA CC1=NNC(=O)[C@@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 4820993 AQOUJFSYFNWPLO-SECBINFHSA-N 290.279 1.435 5 50 CDBA COCCO[C@H]1CCN(c2cc(F)ccc2[N+](=O)[O-])C1 225725204 LGPOAJGTIYTILO-NSHDSACASA-N 284.287 1.976 5 50 CDBA CC1(C)CO[C@@H](c2ccc([N+](=O)[O-])cc2)NC1=O 253478037 IWLGIVWLJIQLTQ-JTQLQIEISA-N 250.254 1.766 5 50 CDBA C[C@@H]1OC[C@@H]2ON(C)[C@@H](c3ccc([N+](=O)[O-])cc3)[C@@H]2CO1 229791491 DJCIBOAHTWGRGS-VZLIPTOUSA-N 294.307 1.891 5 50 CDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 239128688 KQEVIRDFQKXDCH-RBJBARPLSA-N 284.271 1.906 5 50 CDBA Cc1cnc(CN=c2ccc([N+](=O)[O-])c(C)[nH]2)nc1 408523235 IBARLLZKJRHLOA-UHFFFAOYSA-N 259.269 1.431 5 50 CDBA O=C(NCc1cccnc1)c1cccc([N+](=O)[O-])c1 183248 JFGABHIGSPEHDX-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA Cc1n[nH]cc1NS(=O)(=O)c1csc([N+](=O)[O-])c1 120083788 WKAVGRZFFNXQFV-UHFFFAOYSA-N 288.310 1.489 5 50 CDBA C[C@@H]1[C@@H]2CCCN2CCN1Cc1ccc(O)c([N+](=O)[O-])c1 22078410 FTITUJQJYXKYKM-YPMHNXCESA-N 291.351 1.969 5 50 CDBA CN(CCO)C1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1 282297548 WUPNMEIRVYBPJB-UHFFFAOYSA-N 294.355 1.070 5 50 CDBA CN(C)[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cn2)C12CCC2 585117974 LEPUATLFOQZHGG-QWRGUYRKSA-N 277.328 1.670 5 50 CDBA O=[N+]([O-])c1cnc(NCc2cccnc2)c([N+](=O)[O-])c1 19757515 XWBWDBUMPUJSMN-UHFFFAOYSA-N 275.224 1.905 5 50 CDBA COc1cc(N2CCN(C(C)=O)CC2)ccc1[N+](=O)[O-] 118292140 GUTDYFMBYFDQBU-UHFFFAOYSA-N 279.296 1.272 5 50 CDBA C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 366264316 DIUFJAYKTWCHIX-SWLSCSKDSA-N 292.335 1.975 5 50 CDBA CS(=O)(=O)Nc1ccc(Br)cc1[N+](=O)[O-] 81570681 QIWORFNZDQMCIA-UHFFFAOYSA-N 295.114 1.729 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)NCc2cc3ccccc3[nH]2)n1 374437 JRFHUGBFGZKXEL-UHFFFAOYSA-N 299.290 1.740 5 50 CDBA CN(C)CCCNC(=O)c1ccccc1[N+](=O)[O-] 3660813 IKTLTNZOWPNINK-UHFFFAOYSA-N 251.286 1.276 5 50 CDBA CCOC(=O)COc1c(C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 40545148 FLYTYTLSOFMQGG-UHFFFAOYSA-N 284.224 1.753 5 50 CDBA Cn1nccc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N 170618704 VZCJRUMONWEVGI-UHFFFAOYSA-N 279.231 1.302 5 50 CDBA CC[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 368814 AFESPGHMFBWEIW-MRVPVSSYSA-N 258.299 1.672 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])cn(CC2(C)CCC2)c1=O 408525148 NEMTUBKNTHWXOB-UHFFFAOYSA-N 280.280 1.733 5 50 CDBA Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H](O)C1 191340019 ZXTBZBFYOVEGNL-JTQLQIEISA-N 279.296 1.810 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)NCC(F)F 123105292 RHEDNVYGRJZTDF-UHFFFAOYSA-N 275.211 1.990 5 50 CDBA COc1cc(N2CCN(C)CC2)ccc1[N+](=O)[O-] 74938184 MKTFAOFIZMORTQ-UHFFFAOYSA-N 251.286 1.355 5 50 CDBA O=[N+]([O-])c1c(O)cccc1I 91252305 DVEGEGXFFSZLBG-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA O=c1[nH]c(O)nc(/C=C/c2cccs2)c1[N+](=O)[O-] 4501632 KUXHZZSVSVVOEG-ONEGZZNKSA-N 265.250 1.616 5 50 CDBA Cc1nn(CC(=O)NCc2cccs2)c(C)c1[N+](=O)[O-] 196125 VKFXOIQDSLPZIA-UHFFFAOYSA-N 294.336 1.786 5 50 CDBA Cc1ccc(NC(=O)CCC(=O)O)cc1[N+](=O)[O-] 1739574 DCGVUJHKAFCGLU-UHFFFAOYSA-N 252.226 1.707 5 50 CDBA COC(=O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5569966 SLQCEFKHJIDSBB-JTQLQIEISA-N 295.251 1.645 5 50 CDBA O=[N+]([O-])c1cc(CO)ccc1I 97447153 ZWGWCTFCPPBPIN-UHFFFAOYSA-N 279.033 1.692 5 50 CDBA C[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 12747855 DNSKBCPNYHYFTR-PHIMTYICSA-N 278.308 1.773 5 50 CDBA CCc1nccn1S(=O)(=O)c1ccccc1[N+](=O)[O-] 77194 KXFRYLXSBBBCEW-UHFFFAOYSA-N 281.293 1.591 5 50 CDBA COc1ccc([N+](=O)[O-])c(SCCS(C)(=O)=O)c1 293002828 HLWPJXIETXHJGA-UHFFFAOYSA-N 291.350 1.740 5 50 CDBA CN1CC[C@H](Nc2ncccc2[N+](=O)[O-])CC1=O 170606508 DFSSBBWPANQMFZ-QMMMGPOBSA-N 250.258 1.023 5 50 CDBA Cc1cc([N+](=O)[O-])cc(C)c1OCC(=O)N1CCOCC1 122326 BYEPPQHPUKIUPM-UHFFFAOYSA-N 294.307 1.449 5 50 CDBA C[C@H](C(=O)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 471954 NDELAUIXFAFOTJ-JTQLQIEISA-N 264.281 1.557 5 50 CDBA CCOc1cc(Cn2nnnc2C)ccc1[N+](=O)[O-] 225419309 QDAWBZRXLURYEK-UHFFFAOYSA-N 263.257 1.337 5 50 CDBA O=[N+]([O-])c1ccc(NC2(CO)Cc3ccccc3C2)nc1 373741180 ADPSTTNFCJBQOV-UHFFFAOYSA-N 285.303 1.932 5 50 CDBA C[C@H](CC(=O)O)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 237637617 WAUBWLVWJDXHLQ-ZCFIWIBFSA-N 292.251 1.064 5 50 CDBA NC1(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCC1 595120162 PDDBAZNYPWKAQW-UHFFFAOYSA-N 299.352 1.145 5 50 CDBA CCOC(=O)CC(=O)Cc1ccccc1[N+](=O)[O-] 2387714 NEVSSHAHYYYAKX-UHFFFAOYSA-N 251.238 1.660 5 50 CDBA O=C1C=CC(=O)N1c1ccc(Br)cc1[N+](=O)[O-] 4121615 KPJKWKUDBQQILH-UHFFFAOYSA-N 297.064 1.787 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccncc2)c1 4706296 OQXBTGJQDWQQBY-UHFFFAOYSA-N 279.277 1.791 5 50 CDBA Nc1cc(N)nc(SCc2ccc([N+](=O)[O-])cc2)n1 4748551 YDVIJASIWHCTDN-UHFFFAOYSA-N 277.309 1.842 5 50 CDBA CO[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1OC 170612146 BHKUYZWWUFJVCM-BETUJISGSA-N 294.307 1.010 5 50 CDBA COc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-] 5027954 NNGSRBAFQSQTRS-UHFFFAOYSA-N 286.309 1.388 5 50 CDBA CC(C)C(=O)NC(=O)NCc1cccc([N+](=O)[O-])c1 437645 DUNUFMSPRSGCMM-UHFFFAOYSA-N 265.269 1.577 5 50 CDBA COc1cc(CN2C[C@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1O 4838235 BPBMXUKMXJKJNY-UWVGGRQHSA-N 296.323 1.918 5 50 CDBA Cn1ccnc1CNC(=O)Nc1cccc([N+](=O)[O-])c1 343744319 QQBJYWJZAABIAO-UHFFFAOYSA-N 275.268 1.650 5 50 CDBA CN(C[C@@H]1CCCO1)C(=O)c1cccc([N+](=O)[O-])c1O 132035190 WXPNVFSCAKPAKK-VIFPVBQESA-N 280.280 1.551 5 50 CDBA Cn1cnnc1[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 952991613 BXMJGXRJVXMFJD-SECBINFHSA-N 291.286 1.856 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)n1ccnc1C 178616 NEMMTQNKZIVLMU-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA Cc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)nc1 1009247 YSZNJHXHKGODTA-UHFFFAOYSA-N 275.268 1.524 5 50 CDBA CCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 6046601 VYMJIKBEFSXLPV-UHFFFAOYSA-N 263.297 1.373 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc2c(c1)OCO2 1428838 WDVNHBPKGFILAU-UHFFFAOYSA-N 290.235 1.159 5 50 CDBA N[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 125145907 OBCRDRKAYPZJNR-NXEZZACHSA-N 299.352 1.143 5 50 CDBA COc1nc(N)c([N+](=O)[O-])cc1I 90555681 XDIIICFSDWNEDS-UHFFFAOYSA-N 295.036 1.185 5 50 CDBA C[C@@H](c1cccc([N+](=O)[O-])c1)n1cc(COCCO)nn1 2325827282 BFABSPATFAYUFK-JTQLQIEISA-N 292.295 1.305 5 50 CDBA O=[N+]([O-])C1=C(Nc2ccccc2)CS(=O)(=O)C1 297290 LEUKGJYTDPQZPI-UHFFFAOYSA-N 254.267 1.015 5 50 CDBA CNc1nccc(C(=O)NC[C@@H](C)C[C@H](C)O)c1[N+](=O)[O-] 253417934 XSACCPYUQDSDFQ-IUCAKERBSA-N 296.327 1.168 5 50 CDBA Cc1ccc(N2C[C@@H](C(=O)O)CC2=O)c([N+](=O)[O-])c1 40451225 GIYVNRRHVAOLEB-QMMMGPOBSA-N 264.237 1.341 5 50 CDBA C[C@H](O)C[C@H]1CCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164994641 LHJPQOWTWRVOEQ-GXSJLCMTSA-N 294.307 1.676 5 50 CDBA O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC2CC3)nc1 1472900719 WEIWONFCKQMUKH-NSHDSACASA-N 262.313 1.744 5 50 CDBA O=C(NC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-] 272247 IZBCSUJISWFSPG-VIFPVBQESA-N 250.254 1.504 5 50 CDBA Cc1ccc(S(=O)(=O)NCc2ccco2)cc1[N+](=O)[O-] 4181548 SEBBVNQFSBGITG-UHFFFAOYSA-N 296.304 1.975 5 50 CDBA NC(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 4740997 XCBMIHVWZSDGEF-UHFFFAOYSA-N 284.703 1.449 5 50 CDBA CCOC(=O)c1cc(OC)c(OC)c(OC)c1[N+](=O)[O-] 219778098 BHXPZZHBPWNKIH-UHFFFAOYSA-N 285.252 1.797 5 50 CDBA Cc1ccc(Cn2nc([N+](=O)[O-])cc2C(=O)O)cc1 368960 BEWYIEFDAZKWCF-UHFFFAOYSA-N 261.237 1.846 5 50 CDBA CN1CCN(c2cc(F)c([N+](=O)[O-])cc2[N+](=O)[O-])CC1 60326448 SSBAFRIGYXRBRK-UHFFFAOYSA-N 284.247 1.394 5 50 CDBA in-vitro CCC(=O)NC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 952992761 CXCJDJZGWWZYOC-UHFFFAOYSA-N 292.339 1.793 5 50 CDBA CC(C)OCCCNc1c(C(N)=O)cccc1[N+](=O)[O-] 420581146 HCTMRBKEYDKUOC-UHFFFAOYSA-N 281.312 1.921 5 50 CDBA CC1CCN(C(=O)COc2ccc([N+](=O)[O-])c(N)c2)CC1 328591133 AREPMFXYCPTYQW-UHFFFAOYSA-N 293.323 1.814 5 50 CDBA Cc1[nH]nc(C(=O)N2CCC[C@@H]2[C@H]2CCCO2)c1[N+](=O)[O-] 285828157 OHRUMYODQUAMPG-NXEZZACHSA-N 294.311 1.410 5 50 CDBA Cc1nc(N(C)C[C@@H](C)c2nnn[nH]2)ccc1[N+](=O)[O-] 132898339 YCEJIRPLAADZJO-SSDOTTSWSA-N 277.288 1.051 5 50 CDBA O=C1C=C(c2ccc([N+](=O)[O-])cc2)Nc2nonc2N1 100339367 RXFDXRUXTWWMQG-UHFFFAOYSA-N 273.208 1.383 5 50 CDBA CCOc1cc2ncc(C(=O)O)c(=O)n2c2ccccc12 39344071 ALMYTMSGXZFQPU-UHFFFAOYSA-N 284.271 1.945 5 50 CDBA CCn1cc(S(=O)(=O)NC2CCCC2)c([N+](=O)[O-])n1 331232380 RDRSIBFYKYXFCQ-UHFFFAOYSA-N 288.329 1.032 5 50 CDBA O=[N+]([O-])c1ccc(N2CCNCC2)cc1NC1CC1 4182712 PLIVQOBEHAUGLU-UHFFFAOYSA-N 262.313 1.579 5 50 CDBA C[N+]1(CCCN2CCOCC2)C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2C1 101018867 XVZLAXSFVMDPLT-QAETUUGQSA-N 277.432 1.607 5 50 CDBA O=C(O)CCN1Cc2ccc([N+](=O)[O-])cc2C1=O 618596 IOYOGBORAPALCW-UHFFFAOYSA-N 250.210 1.025 5 50 CDBA COC(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1 4050815 VRPYNGMXXLTUOL-UHFFFAOYSA-N 279.296 1.133 5 50 CDBA O=[N+]([O-])c1nn(-c2ccccc2)[n+]([O-])c1NC1CCCC1 4813488 NCEPLELGWMFQGG-UHFFFAOYSA-N 289.295 1.768 5 50 CDBA Cc1nn(Cc2cnn(C)n2)c2ccc([N+](=O)[O-])cc12 289444357 ZHCTVBVLUYGVPB-UHFFFAOYSA-N 272.268 1.430 5 50 CDBA Cc1cnc(OCCN2CCO[C@H](C)C2)c([N+](=O)[O-])c1 170605614 WIFAJFWLJLFGEH-LLVKDONJSA-N 281.312 1.398 5 50 CDBA CCN(CC)C(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 483716 GPUMPRZGXUEJFB-UHFFFAOYSA-N 292.295 1.915 5 50 CDBA O=C(O)[C@@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] 40546069 SGIVVTVUZFXDFU-JTQLQIEISA-N 279.252 1.676 5 50 CDBA Cn1ncc2c1CN(c1ncc([N+](=O)[O-])cc1Cl)C2 585132587 BFIKKOOMRZYEOJ-UHFFFAOYSA-N 279.687 1.897 5 50 CDBA Nc1ncc(Br)c(Cl)c1[N+](=O)[O-] 35635968 BLGCPXIDEMLKMS-UHFFFAOYSA-N 252.455 1.988 5 50 CDBA in-vitro O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(F)c1 1423699 BMFCRWGZBZBFKY-UHFFFAOYSA-N 264.216 1.569 5 50 CDBA Nc1cc(N2CCNCC2)c([N+](=O)[O-])cc1Cl 4819294 CKENAFXDMPCJLA-UHFFFAOYSA-N 256.693 1.240 5 50 CDBA CCOCCCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 2821608 XMTCKXHPXTZRED-UHFFFAOYSA-N 282.296 1.760 5 50 CDBA CCN1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 22591566 FYAIIQGHSQLQAC-UHFFFAOYSA-N 293.323 1.461 5 50 CDBA CCOC(=O)c1cc2cc([N+](=O)[O-])cc(OC)c2oc1=O 467732 WDYMYDHPGNVKTN-UHFFFAOYSA-N 293.231 1.887 5 50 CDBA biogenic CC1(CNC(=O)c2ccc([N+](=O)[O-])cc2)CCNCC1 129060488 JBHDEZQYPZOFOW-UHFFFAOYSA-N 277.324 1.714 5 50 CDBA O=C(O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 167440 VFTSLMZECVJNRT-UHFFFAOYSA-N 278.264 1.532 5 50 CDBA O=C1CC(=O)N2N=C(c3ccc([N+](=O)[O-])cc3)SC2=N1 320802 KPCVNKXFMQGCKX-UHFFFAOYSA-N 290.260 1.118 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCOC[C@@H]1[C@H]1CCC[C@H]1O 521398444 HIJSRYWCRVMPAM-RAIGVLPGSA-N 293.323 1.356 5 50 CDBA C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1 273181265 GPHCUPINQYGKFJ-QMMMGPOBSA-N 250.254 1.782 5 50 CDBA Cc1cc(C)c([N+](=O)[O-])cc1NS(=O)(=O)N(C)C 165150551 MGCYTCTZHUQHER-UHFFFAOYSA-N 273.314 1.430 5 50 CDBA COc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl 272762 RMBQGNZNAQDDPQ-UHFFFAOYSA-N 281.655 1.803 5 50 CDBA CS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-] 82163961 MJIYRXLQEHKRLY-UHFFFAOYSA-N 280.099 1.761 5 50 CDBA CN(C(=O)c1cc([N+](=O)[O-])cnc1N)c1cccc(F)c1 170595239 VQPQVHNVSOZZOW-UHFFFAOYSA-N 290.254 1.988 5 50 CDBA O=C(N[C@@]12CCCN(CC1)C2)c1csc([N+](=O)[O-])c1 1288003641 AZNAEJULUGOCBJ-LBPRGKRZSA-N 281.337 1.624 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccccn2)c1 4182542 TXDLKPNUCIACMU-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA Cc1cc(OCCN2CCN(C)CC2)ccc1[N+](=O)[O-] 20117879 ZSFOKJYVTQSSKV-UHFFFAOYSA-N 279.340 1.529 5 50 CDBA Cc1[nH]nc(C(=O)N2CCC[C@@H]2[C@@H]2CCCO2)c1[N+](=O)[O-] 285828169 OHRUMYODQUAMPG-ZJUUUORDSA-N 294.311 1.410 5 50 CDBA CCOC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 48547954 WNIQNGVORSWYKE-UHFFFAOYSA-N 283.196 1.005 5 50 CDBA C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)CN(C)C 2824338 AQNLZXIGDUEOLO-JTQLQIEISA-N 265.313 1.522 5 50 CDBA Cc1ccc(NC(=O)/C=C\C(=O)O)c([N+](=O)[O-])c1 31777351 KPULDRWQUXVEGP-PLNGDYQASA-N 250.210 1.483 5 50 CDBA N[C@H]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 125145684 OBCRDRKAYPZJNR-UWVGGRQHSA-N 299.352 1.143 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccccc1 163922 CUUCCLJJOWSASK-UHFFFAOYSA-N 275.264 1.957 5 50 CDBA in-man C[C@H]1CC(=O)NN=C1c1ccc(N(C)C)c([N+](=O)[O-])c1 4178766 FBZBPTAIJMWJJO-QMMMGPOBSA-N 276.296 1.521 5 50 CDBA COCCNc1c([N+](=O)[O-])c(=O)n(C)c2ccccc12 4264088 RVUJWKHMGRHUDB-UHFFFAOYSA-N 277.280 1.505 5 50 CDBA CCN1CCN(C(=S)c2cccc([N+](=O)[O-])c2)CC1 55539430 RQDLZJHPQNQATH-UHFFFAOYSA-N 279.365 1.908 5 50 CDBA O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2O1 225397909 RHTXPNZOIRDFBU-CNVPUSNMSA-N 277.280 1.172 5 50 CDBA COC(=O)Cn1c(C)nc([N+](=O)[O-])c1Br 1076048 KZRXNPFXWRXYLR-UHFFFAOYSA-N 278.062 1.035 5 50 CDBA CCOC(=O)c1c([N+](=O)[O-])ccc(C)c1[N+](=O)[O-] 71772163 BJPLYIKOQVCSAK-UHFFFAOYSA-N 254.198 1.988 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1I 146226783 ITDKMCCPVBFBHU-UHFFFAOYSA-N 264.022 1.903 5 50 CDBA CCOC(=O)c1cc(N(C)C)c(F)cc1[N+](=O)[O-] 725261863 LEXOXDQZQPQYGC-UHFFFAOYSA-N 256.233 1.977 5 50 CDBA CC(=O)N1CC[n+]2cc(-c3cccc([N+](=O)[O-])c3)sc21 2597976 GCCQYKMCBUTNCD-UHFFFAOYSA-N 290.324 1.977 5 50 CDBA CN(C)CCOC(=O)Nc1cccc([N+](=O)[O-])c1 2171128 CGPVIASPYQJZNV-UHFFFAOYSA-N 253.258 1.705 5 50 CDBA Cc1cc(N[C@@H]2C[C@@H](O)[C@@H]2n2cccn2)ncc1[N+](=O)[O-] 1615003491 QAJRXWLCHCXWLA-IRUJWGPZSA-N 289.295 1.281 5 50 CDBA O=C(Nc1ccccc1[N+](=O)[O-])N1CCOCC1 5868690 JBKALUPUEFUREP-UHFFFAOYSA-N 251.242 1.459 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)N(CC(F)(F)F)C1CC1 194286556 GUZQEPSTHZFXRZ-UHFFFAOYSA-N 292.217 1.345 5 50 CDBA CC(=O)N/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)O 314815 WXJKFHSOMYAKSR-UXBLZVDNSA-N 250.210 1.156 5 50 CDBA N=C1NC(=O)[C@@H](CC(=O)Nc2ccccc2[N+](=O)[O-])S1 4535070 BGWSFUYHQPWBFM-MRVPVSSYSA-N 294.292 1.090 5 50 CDBA O=C(NOCCC(F)(F)F)c1ccc(O)c([N+](=O)[O-])c1 154984587 KWOUTMMSKVUXST-UHFFFAOYSA-N 294.185 1.914 5 50 CDBA C[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCCO1 310903080 BJGVTQDIMRORAI-QMMMGPOBSA-N 252.274 1.187 5 50 CDBA C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)O 6850616 AGHYCQKOMGHZNX-LURJTMIESA-N 253.214 1.189 5 50 CDBA CC(C)Oc1cc([N+](=O)[O-])ccc1S(C)(=O)=O 97743307 PAVQNKZKYSWUEB-UHFFFAOYSA-N 259.283 1.786 5 50 CDBA CCCCNCC(=O)Nc1ccc([N+](=O)[O-])cc1 4844663 XOEGNJHJICSFJV-UHFFFAOYSA-N 251.286 1.923 5 50 CDBA CC(C)(C)ONC(=O)c1cccc([N+](=O)[O-])c1O 156103917 CIJKLBXKZPVMGF-UHFFFAOYSA-N 254.242 1.760 5 50 CDBA CC(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4117035 RFUOYZLLYKICOI-UHFFFAOYSA-N 277.324 1.899 5 50 CDBA CC(C)N(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 78477897 PGJRTWMOAUOYCV-UHFFFAOYSA-N 258.299 1.624 5 50 CDBA O=C(O)[C@@H]1CS[C@@H](c2cccc([N+](=O)[O-])c2)N1 77921 SALHXESGFYVCIK-IUCAKERBSA-N 254.267 1.383 5 50 CDBA O=C1OCCN1CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4543830 IOMNZIGRVHQMEP-UHFFFAOYSA-N 296.239 1.367 5 50 CDBA COC(=O)[C@H]1CN(c2ccc(C)cc2[N+](=O)[O-])C[C@@H](C)O1 241160556 JYFPWOJNJHGKTI-ZWNOBZJWSA-N 294.307 1.670 5 50 CDBA CCOC(=O)C(C(=O)OCC)c1ccccc1[N+](=O)[O-] 6667362 ZOUAMWVPTIVCRF-UHFFFAOYSA-N 281.264 1.805 5 50 CDBA in-vitro C=CC(=O)N1CCC(Cn2nccc2[N+](=O)[O-])CC1 2325899140 QMYSVDADOQJBAU-UHFFFAOYSA-N 264.285 1.216 5 50 CDBA O=C(O)CCCC(=O)Nc1cccc([N+](=O)[O-])c1 155065 NZLOFCLTCZFBJU-UHFFFAOYSA-N 252.226 1.788 5 50 CDBA CCOC(=O)n1c(=O)sc2cc([N+](=O)[O-])ccc21 6206838 SLQDJFPUTGZVEM-UHFFFAOYSA-N 268.250 1.976 5 50 CDBA O=C(O)c1cc(I)cc([N+](=O)[O-])c1 1672185 GFGURBBHVJTXDU-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA biogenic CN(C)CCCNC(=S)Nc1ccc([N+](=O)[O-])cc1 4685200 UJOSQAMSLHLUEF-UHFFFAOYSA-N 282.369 1.833 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)/C=C\C(=O)O 4865751 GMNCTMJKDGTIJZ-PLNGDYQASA-N 266.209 1.183 5 50 CDBA C[C@H](C(=O)NCc1ccccc1)n1cc([N+](=O)[O-])cn1 1422071 BGEWXIBIZKNGFB-SNVBAGLBSA-N 274.280 1.669 5 50 CDBA CCOC(=O)CNc1ccc(C(C)=O)cc1[N+](=O)[O-] 78575664 WHIBUYVHXXZMIR-UHFFFAOYSA-N 266.253 1.772 5 50 CDBA O=C1NCc2cc(Br)c([N+](=O)[O-])cc21 238854451 NSZNCBCSKKEKTI-UHFFFAOYSA-N 257.043 1.601 5 50 CDBA CC(C)C1(C)CC[N+]2(CC1)CCS(=O)(=O)CC2 1615056169 HBMRHQUZPDRUIE-UHFFFAOYSA-N 260.423 1.688 5 50 CDBA COc1ccc([C@H]2NC(=O)N(C)C(C)=C2[N+](=O)[O-])cc1 283815 VKUFOWSTBQTLHR-LLVKDONJSA-N 277.280 1.900 5 50 CDBA CC1(C)NC(=O)N(CCOc2ccc([N+](=O)[O-])cc2)C1=O 614192 SCLOXJGUVQXENT-UHFFFAOYSA-N 293.279 1.304 5 50 CDBA Nc1nc(SCC(=O)c2cccc([N+](=O)[O-])c2)n[nH]1 8682380 BBGXNJOYTWMWNY-UHFFFAOYSA-N 279.281 1.270 5 50 CDBA CC[C@H]1CN(c2ccnc(F)c2[N+](=O)[O-])CCO1 585118454 PMJSJJDRQGVKOL-QMMMGPOBSA-N 255.249 1.744 5 50 CDBA CCOC(=O)[C@]1(C)Oc2ccc([N+](=O)[O-])cc2NC1=O 8729837 RARDOKXXQXTSKH-GFCCVEGCSA-N 280.236 1.248 5 50 CDBA in-vitro O=[N+]([O-])c1cc(CN2CCOCC2)c2cccnc2c1O 125078 QKKROWQKHDNSGW-UHFFFAOYSA-N 289.291 1.681 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccccc1 2761051 RUIFSNLJFQVWPT-UHFFFAOYSA-N 260.253 1.108 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](c3nnn[nH]3)C2)c1 161008890 VFABJXIHORRKJP-JTQLQIEISA-N 288.311 1.800 5 50 CDBA O=c1c(Br)cn([C@@H]2CCOC2)cc1[N+](=O)[O-] 408419953 QEVRCRHEKFDNBP-ZCFIWIBFSA-N 289.085 1.480 5 50 CDBA O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CCOCC1 47631 CYJXCQQZOLGHKA-SNAWJCMRSA-N 262.265 1.467 5 50 CDBA CCN(CC)CCSc1ncnc(O)c1[N+](=O)[O-] 670421066 NMVVRBXVYLIEGA-UHFFFAOYSA-N 272.330 1.524 5 50 CDBA CC(C)[C@H](O)Cn1cc(Br)c([N+](=O)[O-])n1 300883055 NBOHSVMQKALBAH-SSDOTTSWSA-N 278.106 1.571 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CCCO1 4651097 IQRCPMXQFQPCRA-SNVBAGLBSA-N 266.253 1.721 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2C[C@H]3C=C[C@H]2C3)cc1 211950853 SBQFRYVZSCKFQW-KWBADKCTSA-N 294.332 1.838 5 50 CDBA COC[C@@H]1CN(c2cc(OC)c(C)cc2[N+](=O)[O-])CCO1 408518525 LZAFUMHJQUVENF-NSHDSACASA-N 296.323 1.763 5 50 CDBA N[C@@H](CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 4517251 AYMDNNQPNXWIKK-QMMMGPOBSA-N 298.255 1.107 5 50 CDBA O=C(O)C(C(=O)O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 60005552 ZKODXRKLVQCMPQ-UHFFFAOYSA-N 293.153 1.866 5 50 CDBA Cc1cc([N+](=O)[O-])nn1C[C@H](O)c1ccccc1F 170078231 VJNFCSVQMKPDFP-NSHDSACASA-N 265.244 1.972 5 50 CDBA CC1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O 1426281 IGLOIBUWPRCLQJ-UHFFFAOYSA-N 263.253 1.425 5 50 CDBA in-vitro COc1ccc(CSC2=NCCN2)cc1[N+](=O)[O-] 179282 SWKTYZCCSUTJSP-UHFFFAOYSA-N 267.310 1.796 5 50 CDBA CCOC(=O)C1CCN(Cc2ccc([N+](=O)[O-])o2)CC1 4977612 KPKQHZSJYMUDTB-UHFFFAOYSA-N 282.296 1.963 5 50 CDBA O=[N+]([O-])c1ccc2c(S(=O)(=O)O)cccc2c1 2163987 ZTRNMLNZZWIBPF-UHFFFAOYSA-N 253.235 1.995 5 50 CDBA O=[N+]([O-])c1cccc(OCCNC[C@@H]2CCCO2)c1 4870230 AJPAIZDZBXRKKX-ZDUSSCGKSA-N 266.297 1.742 5 50 CDBA O=C1C=CC[C@@H]2[C@H]3CCC[N@@+]4([O-])CCC[C@@H](CN12)[C@@H]34 238809354 QMGGMESMCJCABO-KAHWEZKRSA-N 262.353 1.660 5 50 CDBA biogenic,in-vitro CS(=O)(=O)CCSc1ncc([N+](=O)[O-])cc1F 408521350 QDWLDJQSVCHSBL-UHFFFAOYSA-N 280.302 1.266 5 50 CDBA C[C@H]1CCCC[C@]1(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 408520802 XQNKCPGWTLGUMK-GWCFXTLKSA-N 280.328 1.876 5 50 CDBA O=[N+]([O-])c1ccc2[nH]c(-c3ccc(O)nn3)nc2c1 3681396 VLMJUYQJXCZRIL-UHFFFAOYSA-N 257.209 1.634 5 50 CDBA O=C(c1ccccc1[N+](=O)[O-])N1CCC2(CC1)OCCO2 4749700 NCOWXCCJOMOFKK-UHFFFAOYSA-N 292.291 1.574 5 50 CDBA CC(C)[C@H]1CCN1C(=O)Cn1cc([N+](=O)[O-])cn1 331828186 XOWISPFRIGAFST-SNVBAGLBSA-N 252.274 1.048 5 50 CDBA CCOC(=O)COc1cc(C(=O)OC)ccc1[N+](=O)[O-] 15021484 HFQWLHPOXJZYHI-UHFFFAOYSA-N 283.236 1.323 5 50 CDBA in-vitro CCNS(=O)(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 1875298405 ZRPXSOWQRWUFRM-UHFFFAOYSA-N 299.352 1.493 5 50 CDBA C[C@@H](C(=O)NC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 471664 KZPAKHJKISMATP-MFKMUULPSA-N 278.308 1.994 5 50 CDBA O=C(O)[C@@H]1CS[C@@H](c2ccc([N+](=O)[O-])s2)N1 99235 WNEKIYRMXWCTGY-FFWSUHOLSA-N 260.296 1.445 5 50 CDBA O=C(O)Cc1ccc(Br)cc1[N+](=O)[O-] 1705018 LBZPHZBNFDOCCR-UHFFFAOYSA-N 260.043 1.984 5 50 CDBA in-vitro CCOCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 2803726 JMDOSISSJYUIHR-UHFFFAOYSA-N 288.325 1.300 5 50 CDBA CCN(CC)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 2838692 ODTNONSAFZICDY-UHFFFAOYSA-N 265.269 1.402 5 50 CDBA CC1=NN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@](O)(C(F)F)C1 355647 SUVWTQNPRXWFDS-LBPRGKRZSA-N 299.233 1.770 5 50 CDBA COCCNc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 670417735 YFNBNBYRJBRPMO-UHFFFAOYSA-N 285.212 1.260 5 50 CDBA CC(=O)/N=S(\NC(C)=O)c1ccc([N+](=O)[O-])cc1 4566424 AMQWCRVZVZQYQV-UHFFFAOYSA-N 269.282 1.353 5 50 CDBA CCOC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1 44570487 VMECXIISUIPJEH-UHFFFAOYSA-N 266.253 1.278 5 50 CDBA COc1cc(CN2CCC[C@@H]2CO)c([N+](=O)[O-])cc1OC 16662678 OIDTUERXEMTVOY-LLVKDONJSA-N 296.323 1.569 5 50 CDBA C=CS(=O)(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 952848929 LHGMJUABRWDPPI-UHFFFAOYSA-N 284.293 1.482 5 50 CDBA CN(CC1CC(O)C1)C(=O)c1ccc(O)c([N+](=O)[O-])c1 135349181 OPAGLGOORUWEHU-UHFFFAOYSA-N 280.280 1.143 5 50 CDBA N[C@H]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 322155828 UPWCLTDDFJOOKP-MGCOHNPYSA-N 299.352 1.143 5 50 CDBA O=[N+]([O-])c1cc(I)ccc1O 94568720 RHWDEIXKHGCDOG-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA in-vitro CCOCCC(=O)Nc1ccc([N+](=O)[O-])cc1OC 4828802 JOJAQSUTESUTPO-UHFFFAOYSA-N 268.269 1.969 5 50 CDBA CC(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19634242 BWCOVLQYOTVGRM-UHFFFAOYSA-N 263.297 1.259 5 50 CDBA CCOC(=O)c1nc(C)n(-c2ccc([N+](=O)[O-])cc2)n1 1401295 VCTNAOBUERBFPF-UHFFFAOYSA-N 276.252 1.661 5 50 CDBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C)CC1 4708915 FERROHDBOLXRKT-UHFFFAOYSA-N 263.297 1.572 5 50 CDBA CNC(=O)[C@H]1CCCCN1c1ccc([N+](=O)[O-])cc1F 952992642 QRJLHKDKTNVVSX-GFCCVEGCSA-N 281.287 1.839 5 50 CDBA Cc1cn(S(=O)(=O)c2ccccc2[N+](=O)[O-])cn1 372110 ACPRMQFLVSKLOR-UHFFFAOYSA-N 267.266 1.337 5 50 CDBA C[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CC=CCC1 331342538 KTFGPSIVGFDMON-GFCCVEGCSA-N 264.285 1.406 5 50 CDBA Nc1cccc([N+](=O)[O-])c1C(=O)NCCC(F)(F)F 170593226 NJJQCFKXSAODKQ-UHFFFAOYSA-N 277.202 1.859 5 50 CDBA NC(=O)c1ccc[n+](Cc2ccc([N+](=O)[O-])cc2)c1 160602 IVRWOTYKLNQSTR-UHFFFAOYSA-O 258.257 1.030 5 50 CDBA Cc1ccc(OCCCCN2CCNCC2)c([N+](=O)[O-])c1 2839480 HUUDKJBFORKQHD-UHFFFAOYSA-N 293.367 1.967 5 50 CDBA N=C1NC(=O)[C@H](CC(=O)Nc2ccccc2[N+](=O)[O-])S1 4535071 BGWSFUYHQPWBFM-QMMMGPOBSA-N 294.292 1.090 5 50 CDBA O=[N+]([O-])c1cnc(N[C@H]2CCCC23OCCO3)nc1 585117992 NOINYRHSOVHCNR-VIFPVBQESA-N 266.257 1.092 5 50 CDBA Nc1nnc(-c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)s1 3160395 MGRAQFXAIJXZCK-UHFFFAOYSA-N 267.226 1.604 5 50 CDBA in-vitro O=c1nnc(SCc2ccc([N+](=O)[O-])cc2)c(O)[nH]1 69504 IATOGVGBVDKIIY-UHFFFAOYSA-N 280.265 1.071 5 50 CDBA O=C(O)[C@H]1CCC[C@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 314379 DAFGBJNYNSYTIU-WDEREUQCSA-N 299.304 1.622 5 50 CDBA C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1CCOC1 170005554 WBWSDNIYWQGRFV-SCZZXKLOSA-N 280.280 1.455 5 50 CDBA O=[N+]([O-])c1ccccc1CN1CCCC[C@H]1CO 23115257 RAIQBNQSSUCADQ-LBPRGKRZSA-N 250.298 1.942 5 50 CDBA C[C@@]1(C(N)=O)CCCCN1Cc1cccc([N+](=O)[O-])c1 185894767 DYJRIJUUJPBEQU-AWEZNQCLSA-N 277.324 1.825 5 50 CDBA Cc1cc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)no1 355956 YSUCXIVQVVZRGC-UHFFFAOYSA-N 265.229 1.185 5 50 CDBA Cc1c([N+](=O)[O-])c(C(=O)NC2CCCC2)nn1C 1019103 GVEGMMFKEXARDI-UHFFFAOYSA-N 252.274 1.309 5 50 CDBA CCOC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])cc1NC(C)=O 6668208 JDFBAXUKYYSTDS-QMMMGPOBSA-N 296.279 1.884 5 50 CDBA CC1=NN(c2ccccc2)C(=O)[C@@H]1[C@H](C)C[N+](=O)[O-] 100373888 MLRDEESSCJSTAE-BXKDBHETSA-N 261.281 1.938 5 50 CDBA C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 251977231 DTXBDFLFWSFQOT-GGZOMVNGSA-N 293.279 1.779 5 50 CDBA Cc1ccnc(NC[C@@H]2CCC(=O)O2)c1[N+](=O)[O-] 585092921 UJELESTWNLUKCE-QMMMGPOBSA-N 251.242 1.416 5 50 CDBA CCC(=O)NC(=S)Nc1ccc(F)c([N+](=O)[O-])c1 457318 XGLNEWMPVHANTI-UHFFFAOYSA-N 271.273 1.957 5 50 CDBA Cn1cnc([N+](=O)[O-])c1C(=O)Nc1cccc([N+](=O)[O-])c1 2088041 RCCVKBPRFQCVKQ-UHFFFAOYSA-N 291.223 1.489 5 50 CDBA C[C@@H](O)CNc1cc(N2CCCC2)ccc1[N+](=O)[O-] 4003291 SPSPZOVABAKXAR-SNVBAGLBSA-N 265.313 1.988 5 50 CDBA CNC(=O)[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])nc1 345151244 QWWXKHCIZDPTQT-ZJUUUORDSA-N 264.285 1.316 5 50 CDBA Cc1nnc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)s1 87856 CKKMUHNCERUBPK-UHFFFAOYSA-N 290.260 1.555 5 50 CDBA Cc1c([N+](=O)[O-])cc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] 2831445 RIUCGFYLENEJIF-UHFFFAOYSA-N 295.251 1.284 5 50 CDBA Cc1cnc(OCCN2CCO[C@@H](C)C2)c([N+](=O)[O-])c1 170605615 WIFAJFWLJLFGEH-NSHDSACASA-N 281.312 1.398 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCOC1 239351910 AAMLVLCWWNMYOL-UHFFFAOYSA-N 286.309 1.272 5 50 CDBA C[C@]1(O)CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 170610597 MSJAVJHSBXVZDP-LBPRGKRZSA-N 284.699 1.845 5 50 CDBA Nc1ccc[n+](-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 5427836 GAWKMFCTVAAKTF-UHFFFAOYSA-N 261.217 1.362 5 50 CDBA O=C(NCCCN1CCOCC1)c1ccc([N+](=O)[O-])cc1 19535683 ZEWOVHOFRWMQPJ-UHFFFAOYSA-N 293.323 1.047 5 50 CDBA Cc1nc(C2CN(c3nccc(C)c3[N+](=O)[O-])C2)n[nH]1 904217944 XUDBHQBXQBBUEK-UHFFFAOYSA-N 274.284 1.329 5 50 CDBA CC[N@@+]1(C)[C@@H](C)[C@@H](O)[C@H](O)[C@@H]1c1ccc(OC)c(OC)c1 252441333 QIVWXVZLBPQWKQ-NZLHIXKWSA-N 296.387 1.335 5 50 CDBA biogenic COCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2981356 LAHZCLZYPLIJOK-UHFFFAOYSA-N 270.197 1.306 5 50 CDBA Nc1cc(NC[C@@H]2CCCCO2)ncc1[N+](=O)[O-] 952991735 DQINHWCOMPDVGQ-QMMMGPOBSA-N 252.274 1.553 5 50 CDBA COc1ccc([N+](=O)[O-])c2c(=O)cc(C(=O)O)oc12 381744 LFEJMAXMQJDPLO-UHFFFAOYSA-N 265.177 1.408 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cccnc2)c1 4706281 WBSZDHRDZPKWND-UHFFFAOYSA-N 279.277 1.791 5 50 CDBA Cc1ccn(S(=O)(=O)c2ccccc2[N+](=O)[O-])n1 282288 KXCCFGVPZKQLMR-UHFFFAOYSA-N 267.266 1.337 5 50 CDBA CC(C)NC(=O)c1cc([N+](=O)[O-])ccc1-n1ccnc1 226818196 WOYIDXYLCCHLAC-UHFFFAOYSA-N 274.280 1.919 5 50 CDBA COC(=O)c1cc(OC)c(OC)c(OC)c1[N+](=O)[O-] 56612 HCEIEWYPDCDNNU-UHFFFAOYSA-N 271.225 1.407 5 50 CDBA in-vitro C[C@H]1[C@@H](C)OCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1 150905961 NFQCJWCIVXGNQD-DTWKUNHWSA-N 280.280 1.550 5 50 CDBA O=C(O)CSCC(=O)Nc1cccc([N+](=O)[O-])c1 464079 FIDVCAVYOKVBQL-UHFFFAOYSA-N 270.266 1.351 5 50 CDBA C[C@H](O[N+](=O)[O-])c1cc2c(cc1[N+](=O)[O-])OCCO2 4575224 PZPPQDGJMFOFCQ-LURJTMIESA-N 270.197 1.635 5 50 CDBA COc1cc2c(cc1OC)[C@H](C)[N@@+](C)(CCO)CC2 253389838 QTDLNPKJXHKAKD-MEDUHNTESA-N 266.361 1.760 5 50 CDBA biogenic COc1cc(CN2C[C@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1O 4838234 BPBMXUKMXJKJNY-AOOOYVTPSA-N 296.323 1.918 5 50 CDBA CN(c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-] 59229821 AGUIVNYEYSCPNI-UHFFFAOYSA-N 287.144 1.039 5 50 CDBA in-vitro Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1cccc(F)c1 1428149 UZNMXTFNUCEJEO-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA O=C(C[C@@H]1SC(=O)NC1=O)Nc1ccc([N+](=O)[O-])cc1 4151755 SYLMFFPTCCRYRW-QMMMGPOBSA-N 295.276 1.275 5 50 CDBA CCNc1nnc(CCn2cc([N+](=O)[O-])cn2)s1 1012013 HATUVLNGWOKJST-UHFFFAOYSA-N 268.302 1.317 5 50 CDBA O=C(Cn1ccnc1[N+](=O)[O-])N1CCC[C@@H]2CCCC[C@H]21 585133050 PJAJELDKOCFWJO-NWDGAFQWSA-N 292.339 1.973 5 50 CDBA CN1CCN(C(=S)c2ccc([N+](=O)[O-])cc2)CC1 19842019 LRSSLFRPVMFDRE-UHFFFAOYSA-N 265.338 1.518 5 50 CDBA Cc1nn(CC(=O)NCc2ccccn2)c(C)c1[N+](=O)[O-] 1069660 HRKFATHCMSODLF-UHFFFAOYSA-N 289.295 1.120 5 50 CDBA CN1CCN(NC(=S)Nc2ccc([N+](=O)[O-])cc2)CC1 3902512 KJIHJAQOCVEQMV-UHFFFAOYSA-N 295.368 1.044 5 50 CDBA Cc1nc([N+](=O)[O-])c(NCC[S@](=O)C(C)(C)C)n1C 169988375 GCIRKMGLVZAWAJ-IBGZPJMESA-N 288.373 1.596 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnc2ccnn12 191686550 FHVPMGLRIPBNMZ-UHFFFAOYSA-N 298.262 1.472 5 50 CDBA O=[N+]([O-])c1ncc(N2CCC[C@@H](CCO)C2)cc1O 952994606 RELXTGREMOVTEM-VIFPVBQESA-N 267.285 1.294 5 50 CDBA CC[C@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 186121 GTJHLKNZGZFMKV-QMMMGPOBSA-N 258.299 1.672 5 50 CDBA CCN(CC)CCNC(=O)c1ccc([N+](=O)[O-])cc1 1910367 XFFMPXFHVNRUKC-UHFFFAOYSA-N 265.313 1.666 5 50 CDBA CCOc1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 90821 RKKCAGBZQUVVPH-YPMHNXCESA-N 264.281 1.682 5 50 CDBA C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CN(C)C 4700909 VGNRVHHGEFDIGO-NSHDSACASA-N 279.340 1.451 5 50 CDBA CNc1ccc(CN[C@@H]2CCCCNC2=O)cc1[N+](=O)[O-] 169971088 RIAXMJKESIWHEA-GFCCVEGCSA-N 292.339 1.395 5 50 CDBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCCCO1 170603939 JSJHHHDCFURELP-UHFFFAOYSA-N 250.254 1.691 5 50 CDBA Cc1cn([C@@H](C)C(=O)NCC(F)(F)F)nc1[N+](=O)[O-] 170619697 QXLRDKNNLSNRFS-LURJTMIESA-N 280.206 1.339 5 50 CDBA COc1cc(C(=O)O)c([N+](=O)[O-])c(OC)c1OC 90714 VPVAFLFJAAPHKI-UHFFFAOYSA-N 257.198 1.319 5 50 CDBA in-vitro Cn1cnc(Cn2cc(Br)c([N+](=O)[O-])n2)c1 585118870 GFODZGGDRVCGSG-UHFFFAOYSA-N 286.089 1.336 5 50 CDBA COc1cc(C(=O)N[C@@H](C)[C@H](C)C(=O)O)ccc1[N+](=O)[O-] 164802216 PVEHFFINWSOWAG-YUMQZZPRSA-N 296.279 1.442 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)NC1CCCCC1 187440 QGJGUGULBHPTBK-UHFFFAOYSA-N 252.274 1.391 5 50 CDBA COC(=O)C1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 456850 CWRFVYRNVQCKNR-UHFFFAOYSA-N 292.291 1.620 5 50 CDBA COC(=O)c1cc(Br)cc([N+](=O)[O-])c1O 4014523 YGVJGAVKLPOPMS-UHFFFAOYSA-N 276.042 1.850 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCOC[C@@H]2c2ncno2)c1 328593701 ZYZWAJJYJKVOID-GFCCVEGCSA-N 290.279 1.551 5 50 CDBA O=C1CC2(CCNCC2)Oc2ccc([N+](=O)[O-])cc21 95495802 REHBKWIFSOCPQG-UHFFFAOYSA-N 262.265 1.682 5 50 CDBA Cc1cc(C(=O)NCCN(C)C)ccc1[N+](=O)[O-] 4818397 YVBFEOZUHCBARY-UHFFFAOYSA-N 251.286 1.195 5 50 CDBA O=[N+]([O-])c1c(NC[C@@H]2CCCO2)ccc2nonc12 4131794 RNTJBBPIEFZPLT-ZETCQYMHSA-N 264.241 1.722 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 2752879 GSKIGNVZHUYQIW-UHFFFAOYSA-N 286.291 1.376 5 50 CDBA CN1C[C@@H](C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC1=O 120907221 MGGRPFVVXCTALI-ZETCQYMHSA-N 281.243 1.151 5 50 CDBA N[C@H]1CC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 322161901 VRDNQBUFINZSTP-MGCOHNPYSA-N 299.352 1.143 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccccn1 272009 AXULDEPARWKQCB-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA CC1=CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 241368049 MJQJLXPUAJSEQU-UHFFFAOYSA-N 261.281 1.969 5 50 CDBA Cc1c(NC(=O)/C=C/C(=O)O)cccc1[N+](=O)[O-] 38715 VGTIHPBDEOOTNO-AATRIKPKSA-N 250.210 1.483 5 50 CDBA O=C(O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F 38721 MBXPMPSJKIGXDY-UHFFFAOYSA-N 256.189 1.537 5 50 CDBA O=C1OCCN1c1cc2c(cc1[N+](=O)[O-])OCO2 15083688 CLBIAIVJZNKTKZ-UHFFFAOYSA-N 252.182 1.280 5 50 CDBA CC(C)Nc1c([N+](=O)[O-])nn(-c2ccc(Cl)cc2)[n+]1[O-] 4823794 MCMDAFLAOYBUPS-UHFFFAOYSA-N 297.702 1.888 5 50 CDBA O=c1c(Br)cn([C@H]2CCOC2)cc1[N+](=O)[O-] 408419952 QEVRCRHEKFDNBP-LURJTMIESA-N 289.085 1.480 5 50 CDBA O=[N+]([O-])c1cc(Cl)ccc1NCC1CS(=O)(=O)C1 585092333 QBEMDLXRAWUOKD-UHFFFAOYSA-N 290.728 1.705 5 50 CDBA Cc1cc(NC[C@H](O)c2cncs2)ncc1[N+](=O)[O-] 952993818 KKUZPPIIUVOCRX-VIFPVBQESA-N 280.309 1.900 5 50 CDBA CCOCC(=O)Nc1cc([N+](=O)[O-])ccc1OC 2734938 SHVFOPFDBHBZOA-UHFFFAOYSA-N 254.242 1.578 5 50 CDBA O=C(NC1CC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 4632439 QQZIACIJEQLYAO-UHFFFAOYSA-N 272.264 1.673 5 50 CDBA C[C@@H](C(=O)N1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 22515624 AZVGXKXMYKNCQJ-LLVKDONJSA-N 277.324 1.472 5 50 CDBA CC(=O)c1ccc(N[C@H]2CCNC(=O)CC2)c([N+](=O)[O-])c1 521394810 FDPMKLLDOJMEGA-LLVKDONJSA-N 291.307 1.878 5 50 CDBA CN1CC[C@@H]2CN(c3ncccc3[N+](=O)[O-])C[C@@H]2C1 585092034 BOEAIWGIYYOBDZ-MNOVXSKESA-N 262.313 1.378 5 50 CDBA C[C@H](O)C[C@@H]1COCCN1c1ccccc1[N+](=O)[O-] 130037190 YRNJSECPAHPKBI-WDEREUQCSA-N 266.297 1.571 5 50 CDBA O=C(COc1ccccc1[N+](=O)[O-])NCc1cccnc1 306865 XSTQPJRWGFXKQG-UHFFFAOYSA-N 287.275 1.685 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])cc1NC1CCN(C)CC1 521395084 GNSQHOSSBUWSPD-UHFFFAOYSA-N 293.323 1.888 5 50 CDBA CC(C)S(=O)(=O)CCN(C)c1ccc([N+](=O)[O-])s1 2325707226 YQYASSGIWWAARD-UHFFFAOYSA-N 292.382 1.916 5 50 CDBA CC(C)(O)C(C)(C)NC(=O)Cc1ccc([N+](=O)[O-])cc1 221123833 WXJBXLCQYVACEJ-UHFFFAOYSA-N 280.324 1.803 5 50 CDBA O=C1CSC2=NCN(c3ccc([N+](=O)[O-])cc3)CN12 4183141 OCPABARQBJMRQE-UHFFFAOYSA-N 278.293 1.261 5 50 CDBA Cc1nn([C@H](C)C(=O)N2CCCC2)c(C)c1[N+](=O)[O-] 1068008 ODDAEHZXKFEBGC-SNVBAGLBSA-N 266.301 1.592 5 50 CDBA O=C1SCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 71772577 FWMDIASZXGRJCS-UHFFFAOYSA-N 288.306 1.452 5 50 CDBA C[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)CCN1 5017306 QQBBHAASIIEVMS-JTQLQIEISA-N 272.308 1.941 5 50 CDBA COC(=O)CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 288782 PIGAIOGZQGOJII-UHFFFAOYSA-N 272.644 1.151 5 50 CDBA COc1nn(Cc2ccc(F)cc2)cc1[N+](=O)[O-] 4838966 RPGNKHKZHBUGRB-UHFFFAOYSA-N 251.217 1.987 5 50 CDBA COC[C@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CCO1 266186843 AUXKQXDAAQKKSK-LLVKDONJSA-N 282.296 1.455 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N2C[C@H]3[C@@H](C2)OCCN3C)c1 408225224 JAQJNHZBVAEHHM-UONOGXRCSA-N 277.324 1.422 5 50 CDBA C[C@@H](CO)Nc1ccc([N+](=O)[O-])cc1OC(F)F 165410903 GRPVNUOVJQIWEN-LURJTMIESA-N 262.212 1.989 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NCCCC(=O)O 19410890 WNEXYSRMIICHHP-UHFFFAOYSA-N 254.242 1.880 5 50 CDBA COc1cc(CN2CCOCC2)c([N+](=O)[O-])cc1OC 19635064 LVWDWYROWZAPGG-UHFFFAOYSA-N 282.296 1.444 5 50 CDBA O=C(NC1CC1)c1cc(C(=O)NC2CC2)cc([N+](=O)[O-])c1 31341 CDWAYSLDUNOSGY-UHFFFAOYSA-N 289.291 1.379 5 50 CDBA COc1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] 180956 SVUWWFRUKSMTMN-NXEZZACHSA-N 294.307 1.853 5 50 CDBA O=[N+]([O-])c1cc([N+](=O)[O-])c(N2CCOCC2)cc1Cl 3880481 AJNDFFJTHXEWAU-UHFFFAOYSA-N 287.659 1.993 5 50 CDBA CC(=O)Nc1nc(Cn2cc([N+](=O)[O-])cn2)cs1 225502336 MSHCFJSMKXSOJU-UHFFFAOYSA-N 267.270 1.255 5 50 CDBA O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1Cc1ccc([N+](=O)[O-])cc1 100411208 UTHWUWYTBDEADO-AUZPSNTRSA-N 298.298 1.902 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2cc3c(cc2Cl)OCO3)N1 89575 ISQNUCJEUYXRGA-PELKAZGASA-N 298.682 1.665 5 50 CDBA CCOC(=O)C(=O)Nc1ccc(C)cc1[N+](=O)[O-] 4957356 VPBFYEDOCKCPSX-UHFFFAOYSA-N 252.226 1.405 5 50 CDBA COCCn1ccc2c(cnc3nc4ccccc4n32)c1=O 20733552 QJMDIAAPMGKICG-UHFFFAOYSA-N 294.314 1.844 5 50 CDBA O=C(O)[C@@H]1CCCN(c2ncccc2[N+](=O)[O-])C1 15443063 GEEPPMTYMYSFIS-MRVPVSSYSA-N 251.242 1.291 5 50 CDBA CCN(c1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1CCNC1=O 253427155 LJHVJGXDLIIIJK-MRVPVSSYSA-N 284.703 1.358 5 50 CDBA C[C@@H]1C[C@@H](O)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 408279331 ZAXGNRURCUUEQD-RDDDGLTNSA-N 283.259 1.721 5 50 CDBA COC(=O)c1cc(Br)c(N)c([N+](=O)[O-])c1 8729705 PRTLMEWWYBJZPN-UHFFFAOYSA-N 275.058 1.726 5 50 CDBA in-vitro Cc1nc(C2CN(c3cc(C)c([N+](=O)[O-])cn3)C2)n[nH]1 904217717 OPSLXLVUHNYNRG-UHFFFAOYSA-N 274.284 1.329 5 50 CDBA CC(=O)N1[C@@H](C[N+](=O)[O-])C[C@H](C)N1c1ccccc1 4603359 DCQAFYPIDRLVIK-GXFFZTMASA-N 263.297 1.694 5 50 CDBA CC[C@]1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 135443635 WJPWMMYPGWBZLK-CQSZACIVSA-N 294.307 1.942 5 50 CDBA Cc1cc([N+](=O)[O-])nn1Cc1noc(C(C)(C)C)n1 170619295 NAJFYDYFJKWZMK-UHFFFAOYSA-N 265.273 1.829 5 50 CDBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1ccccn1 50914 ITXNPEMUMFGTLL-UHFFFAOYSA-N 269.216 1.790 5 50 CDBA C[N+]1(CCCN2CCOCC2)C[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 101018872 XVZLAXSFVMDPLT-MWDXBVQZSA-N 277.432 1.607 5 50 CDBA COC(=O)c1ccnc(N2CCC(OC)CC2)c1[N+](=O)[O-] 408518790 ZZVNYOVTULLYDL-UHFFFAOYSA-N 295.295 1.392 5 50 CDBA NC(=O)[C@@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-] 1775988649 VVTQEAAYKDTNAA-QMMMGPOBSA-N 284.703 1.487 5 50 CDBA O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCOCC1 159826 KFAOBRKSOXRWLJ-UHFFFAOYSA-N 270.672 1.721 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)O)cc1 188521 WULKBRCOTMQQIY-UHFFFAOYSA-N 290.235 1.279 5 50 CDBA COc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1 3898356 HLACZWQBYVTMFZ-QPJJXVBHSA-N 289.247 1.563 5 50 CDBA CC(=O)N=c1ccn(CC(=O)c2cccc([N+](=O)[O-])c2)cc1 334156997 CANQOTTXLVSUQQ-UHFFFAOYSA-N 299.286 1.726 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@H](C(N)=O)C1 192612513 STDZBWOIXMYQIP-UWVGGRQHSA-N 295.343 1.576 5 50 CDBA CN(C)[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cn2)C12CCC2 585117975 LEPUATLFOQZHGG-WDEREUQCSA-N 277.328 1.670 5 50 CDBA CC(=O)Nc1nnc(Cc2ccc([N+](=O)[O-])cc2)s1 12379817 WRSBLZNUHIVTKU-UHFFFAOYSA-N 278.293 1.996 5 50 CDBA O=[N+]([O-])c1cc[n+]([O-])cc1N1CC2(CCCCC2)C1 1150405268 LYCYYADLLUYIBS-UHFFFAOYSA-N 263.297 1.999 5 50 CDBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](C)CN1C 408074619 XDYRQSUTZXVFFP-NXEZZACHSA-N 280.328 1.098 5 50 CDBA COCOCCCN=c1[nH]ccc(C)c1[N+](=O)[O-] 585092073 DGSLHTWBHMWPQR-UHFFFAOYSA-N 255.274 1.143 5 50 CDBA C[C@@H](CC(=O)O)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 237462923 WAUBWLVWJDXHLQ-LURJTMIESA-N 292.251 1.064 5 50 CDBA O=[N+]([O-])c1cc(Br)c2c(c1)[C@@H](O)CN2 169725904 GVVZGKQCCDWUPF-ZETCQYMHSA-N 259.059 1.816 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCCC2)cc1 128941 XDPAFNJUKBYWBZ-UHFFFAOYSA-N 270.310 1.769 5 50 CDBA in-vitro CO[C@H]1CCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1O 160573804 PQMFYKCBFMUTTC-KOLCDFICSA-N 280.280 1.598 5 50 CDBA NCCNc1cc(N2CCCC2)ccc1[N+](=O)[O-] 4131909 YSKNZJMLYJQBGE-UHFFFAOYSA-N 250.302 1.566 5 50 CDBA O=C(O)[C@H]1CS[C@@H](c2ccc([N+](=O)[O-])cc2)N1 77892 WHEHQPOUIXMETN-BDAKNGLRSA-N 254.267 1.383 5 50 CDBA C[C@@H]1OC[C@@H]2ON(C)[C@@H](c3cccc([N+](=O)[O-])c3)[C@@H]2CO1 229791464 LEEHOBZPJJDMHG-VZLIPTOUSA-N 294.307 1.891 5 50 CDBA Cc1cc(C(C(=O)O)C(=O)O)c([N+](=O)[O-])cc1[N+](=O)[O-] 97757458 ZCFIDQZHERQBEI-UHFFFAOYSA-N 284.180 1.064 5 50 CDBA C[C@@H](CN(C)C)Nc1cc2[nH]ncc2cc1[N+](=O)[O-] 1875276377 UJDWQQSUHYTWAO-QMMMGPOBSA-N 263.301 1.833 5 50 CDBA O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccnc2O)c1 2325869038 WWPQVEIBFCAJSU-ZDUSSCGKSA-N 289.291 1.519 5 50 CDBA Cc1cc(C(=O)N[C@@H]2CCSC2=O)ccc1[N+](=O)[O-] 177069 XCHMUCGTSIINNI-SECBINFHSA-N 280.305 1.665 5 50 CDBA CCOC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1Cl 2870988 DMSYZAAJYIRKSM-UHFFFAOYSA-N 286.671 1.541 5 50 CDBA CC1(C)CC2(CCC2)C[N+]12CCS(=O)(=O)CC2 1775988897 ONKYXSFJVLLEND-UHFFFAOYSA-N 258.407 1.584 5 50 CDBA COc1cc([C@@H]2NC(=O)NC(C)=C2[N+](=O)[O-])ccc1O 285074 DVOJAJQYIBUKRD-JTQLQIEISA-N 279.252 1.263 5 50 CDBA C[C@@H](C(=O)NCc1ccccc1)n1cc([N+](=O)[O-])cn1 1422070 BGEWXIBIZKNGFB-JTQLQIEISA-N 274.280 1.669 5 50 CDBA NS(=O)(=O)c1ccc(Cl)c(Cl)c1[N+](=O)[O-] 263625010 WAHPHFKOTIFLPG-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA Cc1cc(N)nc(COc2ccc([N+](=O)[O-])cc2)n1 615133 BDYYFEKXUDXMMW-UHFFFAOYSA-N 260.253 1.854 5 50 CDBA CC(C)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 4151057 QIEVLZQUEZLVSY-UHFFFAOYSA-N 258.299 1.529 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)CCC(=O)O 4258686 XYWMNJQKQDHIOR-UHFFFAOYSA-N 268.225 1.407 5 50 CDBA Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)O 2160315 YDUCLWWEAHQIAE-UHFFFAOYSA-N 251.647 1.803 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)Cn1ncsc1=O 170606272 IHVQADCHJFLZED-UHFFFAOYSA-N 294.292 1.160 5 50 CDBA O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCO1 83634 DOALYTJTUMQIEH-GFCCVEGCSA-N 264.281 1.433 5 50 CDBA O=[N+]([O-])c1ccc(OCCCCNCCO)cc1 2901351 GCCFLMCOKKMAJW-UHFFFAOYSA-N 254.286 1.336 5 50 CDBA O=C(O)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1cscn1 1875339485 LROXXRSTYJEHDW-NSHDSACASA-N 293.304 1.967 5 50 CDBA Cc1c([N+](=O)[O-])cc(-c2nnc(N)s2)cc1[N+](=O)[O-] 4237769 VNGUGCPYUJBOKR-UHFFFAOYSA-N 281.253 1.912 5 50 CDBA O=[N+]([O-])C1[C@@H]2C[C@@H]3C4C2C2C4[C@@H](C[C@H]21)C3[N+](=O)[O-] 257357053 LVAWNZCHNHYYFC-FHDSUCFKSA-N 250.254 1.055 5 50 CDBA CN1CCN(c2ncccc2[N+](=O)[O-])CC1(C)C 594873595 APMYQCDIKNQYIG-UHFFFAOYSA-N 250.302 1.520 5 50 CDBA CCOC(=O)c1cc([N+](=O)[O-])c2ccccn2c1=O 35287398 XUAURMWEQKYGBV-UHFFFAOYSA-N 262.221 1.384 5 50 CDBA CN(C[C@H]1CCCCO1)C(=O)c1ccc(O)c([N+](=O)[O-])c1 164332767 FGMVWXROVCPLPK-LLVKDONJSA-N 294.307 1.942 5 50 CDBA CNC(=O)[C@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C 194928810 JNWGQLARTPBZJV-GFCCVEGCSA-N 293.323 1.404 5 50 CDBA O=C1CCC[C@@H]2[C@H]3CCC[N@+]4([O-])CCC[C@H](CN12)[C@@H]34 255281946 XVPBINOPNYFXID-PGRBJRSLSA-N 264.369 1.884 5 50 CDBA CCOC(=O)COc1cc(/C=C\[N+](=O)[O-])ccc1OC 5059375 CENLDNYJKYMETB-SREVYHEPSA-N 281.264 1.885 5 50 CDBA Cc1c(C(=O)N[C@H]2CCSC2=O)cccc1[N+](=O)[O-] 211122 DEQRGPSFELFOPP-VIFPVBQESA-N 280.305 1.665 5 50 CDBA Cc1nccn1-c1c([N+](=O)[O-])c(=O)n(C)c2ccccc12 250969 YPSGXYSSHQXIET-UHFFFAOYSA-N 284.275 1.941 5 50 CDBA O=[N+]([O-])c1cc(S(=O)(=O)O)cc([N+](=O)[O-])c1Cl 1555313 ALVPDCHBQRCKRQ-UHFFFAOYSA-N 282.617 1.403 5 50 CDBA CSc1ccc(C(=O)N2C[C@@H](O)C[C@H]2C)cc1[N+](=O)[O-] 170089367 BNPXOOAGPKGZSI-SCZZXKLOSA-N 296.348 1.912 5 50 CDBA C[C@H](C(=O)NC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 471663 KZPAKHJKISMATP-GWCFXTLKSA-N 278.308 1.994 5 50 CDBA COC(=O)c1ccc(Oc2nc([N+](=O)[O-])nn2C)cc1 528926 PWEABZNIAACHQB-UHFFFAOYSA-N 278.224 1.302 5 50 CDBA CN(CC(F)F)C(=O)c1cc([N+](=O)[O-])ccc1N 157156936 SQXDPJXAZHXWMS-UHFFFAOYSA-N 259.212 1.514 5 50 CDBA CCCCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 204579598 PJMIXAFQRSYEFA-UHFFFAOYSA-N 252.274 1.492 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN3CCC[C@H]3C2)c([N+](=O)[O-])c1 239386696 QAWKMLWGDOMDTO-NSHDSACASA-N 292.295 1.787 5 50 CDBA CCOC(=O)NOc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2149517 IFJVFZXMHAKZIG-UHFFFAOYSA-N 271.185 1.543 5 50 CDBA O=[N+]([O-])c1ccc(NC[C@@H]2CCOC2)c2cn[nH]c12 1775998383 BBOWDWJTVGUMEH-QMMMGPOBSA-N 262.269 1.920 5 50 CDBA C[C@H]1OCC[C@@]12CN(Cc1cccc([N+](=O)[O-])c1)CCO2 280520178 RUUBJRNFDVDGFS-IUODEOHRSA-N 292.335 1.975 5 50 CDBA COc1cc([N+](=O)[O-])cnc1N1CCN(C(C)C)CC1 863949047 BCABBWAGTKEKSP-UHFFFAOYSA-N 280.328 1.529 5 50 CDBA Cc1nc(N2CCC[C@@H](C3=NCCN3)C2)ccc1[N+](=O)[O-] 1775992106 XJYAZWAFYPLPMI-LLVKDONJSA-N 289.339 1.516 5 50 CDBA CCc1nc(Cn2c(C)ccc([N+](=O)[O-])c2=O)no1 170679200 OLGYOKUNKIFPDR-UHFFFAOYSA-N 264.241 1.059 5 50 CDBA O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1CC=CCC1 170674809 VHHFCBWSNAKLEZ-JTQLQIEISA-N 279.300 1.199 5 50 CDBA CC(C)OCCCNc1ncnc(N)c1[N+](=O)[O-] 3912501 ONBDGRALEWDPPW-UHFFFAOYSA-N 255.278 1.194 5 50 CDBA O=[N+]([O-])c1ccc2c(O)c([N+](=O)[O-])c(O)nc2c1 12375211 LVOGPGRZRLTBCB-UHFFFAOYSA-N 251.154 1.462 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCCC1 301475 AACRWZVDRSTLKY-UHFFFAOYSA-N 270.310 1.769 5 50 CDBA C[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 614275 MYGGJOBCAZKDDS-QWRGUYRKSA-N 294.307 1.609 5 50 CDBA Cc1nn([C@H](C)C(=O)NC[C@H]2CCCO2)c(C)c1[N+](=O)[O-] 1071179 ZBVIZKKEENXYKH-GHMZBOCLSA-N 296.327 1.264 5 50 CDBA C[N+](C)(CCCS(=O)(=O)O)Cc1ccccc1 1529121 MEJASPJNLSQOAG-UHFFFAOYSA-O 258.363 1.541 5 50 CDBA in-vitro O=[N+]([O-])c1cc(C(=S)N2CCOCC2)ccc1O 4637319 JMOTZNZFPYISJB-UHFFFAOYSA-N 268.294 1.308 5 50 CDBA O=C(NCC(F)(F)CO)c1ccc([N+](=O)[O-])cc1F 186100715 PAUQOWHKMOCCFC-UHFFFAOYSA-N 278.186 1.091 5 50 CDBA NC(=O)c1cc([N+](=O)[O-])c(Cl)c([N+](=O)[O-])c1Cl 1699266 UBMOQSTZFCSCEV-UHFFFAOYSA-N 280.023 1.909 5 50 CDBA CNc1ccc([N+](=O)[O-])cc1NC(=O)CCCC(=O)O 22060011 IEBOWQSCVIKQHZ-UHFFFAOYSA-N 281.268 1.830 5 50 CDBA in-vitro CC(C)[C@@H]1CCN1C(=O)Cn1cc([N+](=O)[O-])cn1 331828183 XOWISPFRIGAFST-JTQLQIEISA-N 252.274 1.048 5 50 CDBA C[N+](C)(C)CCS(=O)(=O)CCc1ccccc1 71785285 APVWSQKXTLRAPQ-UHFFFAOYSA-N 256.391 1.350 5 50 CDBA Cc1cc(N2CCC[C@H]2c2nc[nH]n2)ncc1[N+](=O)[O-] 952881814 JWBOHCZVCQCEGB-VIFPVBQESA-N 274.284 1.758 5 50 CDBA CCOC(=O)/C=C(\C)NNc1ccc([N+](=O)[O-])cc1 670421241 RQZHWODSCAGOOJ-CMDGGOBGSA-N 265.269 1.978 5 50 CDBA C[C@@H]1[C@@H](NC(=O)c2nn(C)cc2[N+](=O)[O-])CCC[C@H]1C 239073287 GWKGSCMXUZSZSH-UTLUCORTSA-N 280.328 1.883 5 50 CDBA O[C@@H]1COC[C@@H]1N=c1ccc2ccc3cccnc3c2[nH]1 1875295239 UWIYBVJQLRRPOS-QWHCGFSZSA-N 281.315 1.377 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N[C@H]2C(=O)NCC[C@@H]2C)c1 193521106 DPMHQENPDNDFIP-JOYOIKCWSA-N 263.297 1.840 5 50 CDBA COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(C)C 299112 HTXNPHLKZGDNLC-NSHDSACASA-N 280.280 1.522 5 50 CDBA O=C1Nc2ccc([N+](=O)[O-])cc2[C@@]1(O)N1CCCCC1 4155872 YNAYNLVTESDOLF-ZDUSSCGKSA-N 277.280 1.178 5 50 CDBA CN1CCCN(c2c([N+](=O)[O-])ccc3c2CCN3)CC1=O 225516325 HGAVCTHYZGARFP-UHFFFAOYSA-N 290.323 1.231 5 50 CDBA O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)c(F)c1 408463047 AZMHICIIVWCVIT-JQDIXDHISA-N 279.271 1.334 5 50 CDBA O=[N+]([O-])c1cccnc1NCc1cc2n(n1)CCC2 585092800 OFCKDHMZTFQLRK-UHFFFAOYSA-N 259.269 1.745 5 50 CDBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCO1 4777418 RIGKPBKPPIVLOS-MFKMUULPSA-N 294.307 1.657 5 50 CDBA CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccn1 585088249 QYQSVBHTINQPSV-NSHDSACASA-N 289.295 1.454 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccco1 40319 LBLWSOOAELDQCS-UHFFFAOYSA-N 282.277 1.666 5 50 CDBA Cc1cc(N2CCC([C@@H](F)C(N)=O)CC2)ccc1[N+](=O)[O-] 585132668 KLQNDLCKJCGJOO-CYBMUJFWSA-N 295.314 1.943 5 50 CDBA C[C@]1(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CCCO1 166119196 FMRWWWRRKMXOFA-GFCCVEGCSA-N 266.253 1.808 5 50 CDBA CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1[N+](=O)[O-] 252495684 OWFMTTDOFPVFBH-UHFFFAOYSA-N 284.215 1.985 5 50 CDBA CCN1CCN(Cc2ccc(O)c([N+](=O)[O-])c2)CC1 19608683 SXMPDLXIWDMVBH-UHFFFAOYSA-N 265.313 1.438 5 50 CDBA O=[N+]([O-])c1cc(Cl)ccc1N1CCC(NCCO)CC1 225560648 GKVNBNYDJKUJMZ-UHFFFAOYSA-N 299.758 1.799 5 50 CDBA COC[C@H](C)NC(=O)c1ccc(C)c([N+](=O)[O-])c1 456652 VMFYAPIJHGBIKZ-VIFPVBQESA-N 252.270 1.668 5 50 CDBA COC(=O)c1cc(C)c(NC(C)=O)c([N+](=O)[O-])c1 585672361 BURRVTIEEYTFOA-UHFFFAOYSA-N 252.226 1.648 5 50 CDBA in-vitro CCN(CC)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 1061535 ZNAYOCJALLRFKC-UHFFFAOYSA-N 272.326 1.766 5 50 CDBA C[C@@H](N)[C@@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 135237017 KLUNMTGYVKYXBY-DGCLKSJQSA-N 291.351 1.723 5 50 CDBA CCOC(=O)CN(C)C1CN(c2ccc([N+](=O)[O-])cc2)C1 170598768 UTEMQOACPVFVQP-UHFFFAOYSA-N 293.323 1.278 5 50 CDBA Cc1nc(N2CCOCC2)nc(OC(C)C)c1[N+](=O)[O-] 4143222 AKANHPUOYWFHKK-UHFFFAOYSA-N 282.300 1.317 5 50 CDBA CC1(C)C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 161458809 QQLMYGKCRDSRCT-VIFPVBQESA-N 294.307 1.988 5 50 CDBA COC(=O)c1c([N+](=O)[O-])cc(F)c(OC)c1[N+](=O)[O-] 675052038 VLWQCPHZKNTYCO-UHFFFAOYSA-N 274.160 1.437 5 50 CDBA CCN(CC)C[C@@H](O)COc1ccccc1[N+](=O)[O-] 4819645 DWQSWQCXMFRAFE-LLVKDONJSA-N 268.313 1.676 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 407979778 AWMLDOKRYPQFHE-AEJSXWLSSA-N 278.312 1.698 5 50 CDBA Nc1ccc(I)c([N+](=O)[O-])c1 1726238 RIKZQOSCKSWUPH-UHFFFAOYSA-N 264.022 1.782 5 50 CDBA C[C@@H]1C[C@@H]1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 585079408 KBCPPFFEVMKFFM-KCJUWKMLSA-N 263.249 1.977 5 50 CDBA NC(=O)c1ccccc1NC(=O)c1ccccc1[N+](=O)[O-] 436102 QAIPVRZSDNCLFO-UHFFFAOYSA-N 285.259 1.946 5 50 CDBA COCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl 2870997 LFBYANZCVJLDQF-UHFFFAOYSA-N 258.661 1.624 5 50 CDBA CNC(=O)NCCNc1ccc(C(C)=O)cc1[N+](=O)[O-] 408524762 YXUYMKNCXWOWNU-UHFFFAOYSA-N 280.284 1.138 5 50 CDBA O=C1C=CC(=O)N1c1ccc(Cl)cc1[N+](=O)[O-] 5016504 SPZIAMZQVVMQHQ-UHFFFAOYSA-N 252.613 1.678 5 50 CDBA Cn1c2cc(=NCCO)ccc-2nc2ccccc21 334157010 UFFSSWFJZSCGMP-UHFFFAOYSA-N 253.305 1.571 5 50 CDBA O=[N+]([O-])c1ccc(N2CCC[C@@H](c3cnn[nH]3)C2)nc1 1775987678 RBHCGKAASFWVAT-SECBINFHSA-N 274.284 1.492 5 50 CDBA Cc1c(C(=O)NCCN(C)C)cccc1[N+](=O)[O-] 4785017 OJALNFMIPLBMKK-UHFFFAOYSA-N 251.286 1.195 5 50 CDBA COc1ccc(OC)c([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1 115953 CVLKDXLRWZVGRV-ZWNOBZJWSA-N 280.280 1.300 5 50 CDBA Cc1ccc(OCCCN2CCNCC2)c([N+](=O)[O-])c1 2840255 UCACXQHFIUGJCS-UHFFFAOYSA-N 279.340 1.577 5 50 CDBA Cc1cc(N2CCC[C@@H](c3nc[nH]n3)C2)ncc1[N+](=O)[O-] 363607786 YFAUHQIZVRIPOI-SNVBAGLBSA-N 288.311 1.800 5 50 CDBA Nc1c([N+](=O)[O-])cc(Br)cc1[N+](=O)[O-] 5331263 IIUAAKYBFINVAD-UHFFFAOYSA-N 262.019 1.848 5 50 CDBA in-vitro CCOC(=O)c1cn(-c2ccccc2[N+](=O)[O-])cn1 1772572562 ZYTDZMSDPAVUGS-UHFFFAOYSA-N 261.237 1.957 5 50 CDBA C[C@H]1OC[C@H]2[C@H](CO1)ON(C)[C@H]2c1cccc([N+](=O)[O-])c1 248018508 LEEHOBZPJJDMHG-HBEIAFGSSA-N 294.307 1.891 5 50 CDBA C[N+]1(CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)CCCCC1 239328995 KACLEKGODJDZPY-IGQOVBAYSA-N 275.372 1.382 5 50 CDBA C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ncnn1C 170608516 BYTGQUXCTKEACQ-ZCFIWIBFSA-N 281.297 1.276 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1 1062305 MYKJFTJBTHVJLE-UHFFFAOYSA-N 264.216 1.569 5 50 CDBA C[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C1CCOCC1 119225117 UJBQCBNNZYBYRB-SECBINFHSA-N 294.307 1.845 5 50 CDBA COC(=O)Nc1nc(O)c2cc([N+](=O)[O-])ccc2n1 5080486 OLJPKHKFCROJHD-UHFFFAOYSA-N 264.197 1.422 5 50 CDBA CC(C)CNC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1 2898926 KIBUUOZPOUKSGI-UHFFFAOYSA-N 281.337 1.855 5 50 CDBA Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(C(F)(F)F)ccc21 6659219 KCDITQBGZLRTBX-UHFFFAOYSA-N 296.208 1.140 5 50 CDBA Cc1nc([N+](=O)[O-])c(C(=O)OCc2ccccc2)n1C 118632 IBVDLOZMHHTJIF-UHFFFAOYSA-N 275.264 1.994 5 50 CDBA O=[N+]([O-])c1ccc(N[C@H](CO)[C@H]2CCCO2)cc1 253428417 QAIPMTZFOJDKBW-VXGBXAGGSA-N 252.270 1.547 5 50 CDBA CO[C@@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H]1OC 234757371 CJNSEXMRGCUQSS-VXGBXAGGSA-N 298.270 1.220 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@@H]([C@@H](O)C(F)(F)F)C2)cn1 450885805 VICVZIUQHRHQKJ-GMSGAONNSA-N 291.229 1.739 5 50 CDBA O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCc2ccncc21 544535079 HIPWIJATXGCIHA-UHFFFAOYSA-N 258.237 1.521 5 50 CDBA Cc1cc(C)nc(Sc2nc([N+](=O)[O-])nn2C)n1 89991 SHRYOSKQELSJJJ-UHFFFAOYSA-N 266.286 1.281 5 50 CDBA N[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)C1CC1 236313295 URQYODJTKSOZCP-SECBINFHSA-N 256.693 1.792 5 50 CDBA CC(C)(C)Nc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 675010499 SNTFLJOXLHFLGP-UHFFFAOYSA-N 282.256 1.812 5 50 CDBA CN(C[C@@H]1CCCCO1)C(=O)c1ccc(O)c([N+](=O)[O-])c1 164332647 FGMVWXROVCPLPK-NSHDSACASA-N 294.307 1.942 5 50 CDBA COC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C1CC1 124474270 UDCLLDJBPDFGPB-JTQLQIEISA-N 280.280 1.455 5 50 CDBA Cc1nc2c([N+](=O)[O-])cc(Br)cc2c(=O)[nH]1 83568 WRKADMPGCJFMBM-UHFFFAOYSA-N 284.069 1.902 5 50 CDBA Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1OCC(=O)O 1597736 VCXFZNLPLWKKFI-UHFFFAOYSA-N 256.170 1.275 5 50 CDBA CCN(CC)C1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4414333 YPTHWVGBJQUCBJ-UHFFFAOYSA-N 283.309 1.386 5 50 CDBA O=[N+]([O-])c1cccn1S(=O)(=O)c1ccccc1 138335686 SSWMTXYLBAFLCJ-UHFFFAOYSA-N 252.251 1.633 5 50 CDBA O=C1C=CC[C@@H]2[C@@H]3CCC[N@+]4([O-])CCC[C@H](CN12)[C@@H]34 253618086 QMGGMESMCJCABO-JINKPPJBSA-N 262.353 1.660 5 50 CDBA biogenic Cc1nnn2c1SCC(c1cccc([N+](=O)[O-])c1)=N2 5792725 ILCGHDYEGDYPPZ-UHFFFAOYSA-N 275.293 1.853 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCC[C@H](CO)C2)c1 23114974 YGSACGKXKWFRRP-LBPRGKRZSA-N 250.298 1.799 5 50 CDBA COc1ccccc1Oc1ncnc(N)c1[N+](=O)[O-] 3912707 NKKFECWNBURART-UHFFFAOYSA-N 262.225 1.768 5 50 CDBA Cc1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)no1 463989 PCKFSOULYIFDMM-UHFFFAOYSA-N 277.236 1.909 5 50 CDBA O=C1CSCC(=O)N1c1ccccc1[N+](=O)[O-] 25558196 VPNPMJXYWIRNFB-UHFFFAOYSA-N 252.251 1.201 5 50 CDBA O=c1ncccn1CCCNc1ncccc1[N+](=O)[O-] 585092196 IYJXJAVQUPBODE-UHFFFAOYSA-N 275.268 1.049 5 50 CDBA C[C@@H](N)[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 135237054 KLUNMTGYVKYXBY-YPMHNXCESA-N 291.351 1.723 5 50 CDBA C[N@+]1(CCCN2CCOCC2)C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 247693428 XVZLAXSFVMDPLT-CWLGOENISA-N 277.432 1.607 5 50 CDBA COc1cc(CN2CCC[C@H](O)C2)cc([N+](=O)[O-])c1O 16310454 ZZCQBVDHHFPMKV-JTQLQIEISA-N 282.296 1.266 5 50 CDBA CCOC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 2860093 URAYMAONOUOAOQ-UHFFFAOYSA-N 286.671 1.541 5 50 CDBA biogenic,in-vitro Cc1ccc(S(=O)(=O)/N=c2/cccc[nH]2)cc1[N+](=O)[O-] 3832978 WJZMWXPOPYYVGC-UHFFFAOYSA-N 293.304 1.521 5 50 CDBA CC(=O)NCC(=O)OCc1ccc([N+](=O)[O-])cc1Cl 4832266 MNRVQBJDAISTGY-UHFFFAOYSA-N 286.671 1.428 5 50 CDBA O=C1NCCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 1075489 RORGBHAMQUCTTP-UHFFFAOYSA-N 269.644 1.414 5 50 CDBA CC(=O)Nc1cc(N2CCN(C)CC2)ccc1[N+](=O)[O-] 4187419 HGVAOTSORBBXKB-UHFFFAOYSA-N 278.312 1.305 5 50 CDBA CCC[C@H](N)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 124893278 YPTJWENIOWLSKT-VIFPVBQESA-N 287.341 1.001 5 50 CDBA O=C(N[C@H]1CC12CCCCC2)c1cc([N+](=O)[O-])[nH]n1 285690734 CBYKPFIZZLIUKI-VIFPVBQESA-N 264.285 1.771 5 50 CDBA COc1ccc(C(=O)N(CC#N)CC#N)cc1[N+](=O)[O-] 103428 TWMLROPXCKDJAO-UHFFFAOYSA-N 274.236 1.093 5 50 CDBA O=[N+]([O-])c1cnn(Cc2nnc3n2CCCCC3)c1 72334099 AFYYRLQUTPSZJW-UHFFFAOYSA-N 262.273 1.158 5 50 CDBA CN1CCC(NC(=S)Nc2cccc([N+](=O)[O-])c2)CC1 5041944 UUGLFJMOUQLIAA-UHFFFAOYSA-N 294.380 1.975 5 50 CDBA COc1ccc(C(=O)CSc2ncn[nH]2)cc1[N+](=O)[O-] 106201 JHRAJGPAOCEIKC-UHFFFAOYSA-N 294.292 1.697 5 50 CDBA N[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 721867988 VRDNQBUFINZSTP-AOOOYVTPSA-N 299.352 1.143 5 50 CDBA CC(C)(C)OC(=O)N1CC[C@@H](n2cc([N+](=O)[O-])cn2)C1 74938176 VYHFLIFNGPQXEV-SECBINFHSA-N 282.300 1.973 5 50 CDBA in-vitro COc1cccc(NCC(F)(F)CO)c1[N+](=O)[O-] 185732865 OOQHWJYSEGGJCL-UHFFFAOYSA-N 262.212 1.643 5 50 CDBA C[C@@H]1CCC[C@@H](C)C1NC(=O)Cn1cc([N+](=O)[O-])cn1 193266174 SLHPTAZLMFPPJZ-NXEZZACHSA-N 280.328 1.732 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1Oc1cncc(C(N)=O)c1 253419345 POJXLTPXQFPRQF-UHFFFAOYSA-N 274.236 1.584 5 50 CDBA CN1C=CC(C(=O)NCCC[N+](C)(C)C)=C/C1=C/N=O 135882935 LWHJSIZBXGUMTJ-QBFSEMIESA-O 279.364 1.192 5 50 CDBA Cc1ccccc1Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1427098 FKMFWSJEBQZBIX-UHFFFAOYSA-N 260.253 1.247 5 50 CDBA O=C1CCSc2nc(-c3cccc([N+](=O)[O-])c3)nn21 501940 KPOMMFMBFLCHGV-UHFFFAOYSA-N 276.277 1.989 5 50 CDBA CC(C)CCOC(=O)c1[nH]nc([N+](=O)[O-])c1[N+](=O)[O-] 3833180 DWNWQUYOGAAFOB-UHFFFAOYSA-N 272.217 1.429 5 50 CDBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3904019 BFJUQMBGFYEDMF-UHFFFAOYSA-N 263.297 1.653 5 50 CDBA Cc1ccc(=N)n(CC(=O)Nc2ccccc2[N+](=O)[O-])c1 409415874 USWNDMQRADPGRA-UHFFFAOYSA-N 286.291 1.823 5 50 CDBA CC(=O)c1csc(C(=O)Nc2c([N+](=O)[O-])cnn2C)c1 170603808 FNWXZZGXOFTISD-UHFFFAOYSA-N 294.292 1.845 5 50 CDBA COC(=O)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5569968 SLQCEFKHJIDSBB-SNVBAGLBSA-N 295.251 1.645 5 50 CDBA CSc1ccccc1NC(=O)Cn1cnc([N+](=O)[O-])n1 197104 KOBMMHXDHWYRKZ-UHFFFAOYSA-N 293.308 1.547 5 50 CDBA Cc1ccc(NC(=O)N2CCOCC2)cc1[N+](=O)[O-] 2172213 JFXOSKRBSBZRAX-UHFFFAOYSA-N 265.269 1.767 5 50 CDBA Cc1ccc(N2C[C@H](C(=O)O)CC2=O)c([N+](=O)[O-])c1 40451224 GIYVNRRHVAOLEB-MRVPVSSYSA-N 264.237 1.341 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=S)NC(C)=O 615328 CHGZWYQWCWDKRU-UHFFFAOYSA-N 269.282 1.436 5 50 CDBA O=[N+]([O-])c1cccc(Cl)c1NCCNCCO 4142137 FVOVJFXIDAGBNK-UHFFFAOYSA-N 259.693 1.242 5 50 CDBA CN1CC[C@]2(CCCN(c3ncccc3[N+](=O)[O-])C2)C1 585092011 AMFUOWBTZWBSGJ-CQSZACIVSA-N 276.340 1.912 5 50 CDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)C(C)C 194982288 JSOFRFCPUPTJMD-SNVBAGLBSA-N 268.317 1.684 5 50 CDBA NNc1cc(Br)c(F)cc1[N+](=O)[O-] 113836600 UECNBEKERZHWCF-UHFFFAOYSA-N 250.027 1.782 5 50 CDBA in-vitro C[C@@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 1540366041 JVGKBAWLHUSIKT-ZCFIWIBFSA-N 272.692 1.843 5 50 CDBA Cc1cc(C)nc(Sc2ncnc(N)c2[N+](=O)[O-])n1 3892556 HANKTRCKJCDBRQ-UHFFFAOYSA-N 278.297 1.525 5 50 CDBA CCOc1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 90825 RKKCAGBZQUVVPH-DGCLKSJQSA-N 264.281 1.682 5 50 CDBA COC(=O)c1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 103420 UVXBSXLPWBAFPP-CMPLNLGQSA-N 278.264 1.070 5 50 CDBA CC(=O)N1[C@H](C(=O)O)CS[C@@H]1c1ccc([N+](=O)[O-])cc1 369595 DPFVSVGVJVQKSP-WDEREUQCSA-N 296.304 1.642 5 50 CDBA CCOC(=O)CCNc1ccc(C(=O)O)cc1[N+](=O)[O-] 35287369 HSWVJLUGKAOGSC-UHFFFAOYSA-N 282.252 1.658 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1NCc1nc(CO)cs1 225458105 CGZWXUOTRPQUBF-UHFFFAOYSA-N 297.340 1.681 5 50 CDBA Cc1nn([C@@H]2CCN(C3CC3)C2=O)c(C)c1[N+](=O)[O-] 408345424 ANZSGOKZFITCTC-SNVBAGLBSA-N 264.285 1.344 5 50 CDBA Cc1c(NC(=O)NN2CCOCC2)cccc1[N+](=O)[O-] 585119781 UEYKSIBIXWIZNP-UHFFFAOYSA-N 280.284 1.272 5 50 CDBA Cc1cc(C)c(S(=O)(=O)Nc2nnc[nH]2)cc1[N+](=O)[O-] 191902011 WFEQYVAIEOOCAE-UHFFFAOYSA-N 297.296 1.131 5 50 CDBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCO1 452654 QSRBFRAQLAMYPZ-LJLILKBBSA-N 276.292 1.903 5 50 CDBA Nc1nc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n[nH]1 13497384 MFCVRIKTZQSBOJ-UHFFFAOYSA-N 279.281 1.270 5 50 CDBA NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 58357 FANLHXKNWWSLIG-UHFFFAOYSA-N 285.259 1.946 5 50 CDBA Cc1ccccc1NC1=C([N+](=O)[O-])CS(=O)(=O)C1 297861 WUXFUGYIJQAFEJ-UHFFFAOYSA-N 268.294 1.324 5 50 CDBA O=[N+]([O-])c1cccc(CC(=S)N2CCOCC2)c1 1716399 OOUMTCXSCRABRX-UHFFFAOYSA-N 266.322 1.797 5 50 CDBA Cc1cc([N+](=O)[O-])nn1COc1ccc(C=O)cc1 2535215 KMWNAZMTCWXYRF-UHFFFAOYSA-N 261.237 1.949 5 50 CDBA in-vitro Cc1ccc(OCCCN2CCN(C)CC2)c([N+](=O)[O-])c1 3003518 SKLCLUKYEUBFIC-UHFFFAOYSA-N 293.367 1.920 5 50 CDBA Cc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)no1 4674053 PMWZRSPEYFJPMK-UHFFFAOYSA-N 283.265 1.692 5 50 CDBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCO1 4777419 RIGKPBKPPIVLOS-GXFFZTMASA-N 294.307 1.657 5 50 CDBA Cc1cccc([N+](=O)[O-])c1NCCC(=O)N1CCOCC1 134510302 ZEIYXWVDKPXTDR-UHFFFAOYSA-N 293.323 1.564 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N(C)C[C@H](O)C(F)(F)F 192742317 GYUZGZITLQXCAN-ZETCQYMHSA-N 296.249 1.479 5 50 CDBA CCN(CC(C)(C)O)C(=O)c1cccc([N+](=O)[O-])c1O 156049723 FFUFCKCQIFEDBL-UHFFFAOYSA-N 282.296 1.533 5 50 CDBA O=C(O)[C@@H]1CCC[C@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 314376 DAFGBJNYNSYTIU-GHMZBOCLSA-N 299.304 1.622 5 50 CDBA Cc1c([N+](=O)[O-])c(C(=O)NC2CCCCC2)nn1C 355606 RBNJWLPDTPQWTL-UHFFFAOYSA-N 266.301 1.699 5 50 CDBA COc1cc(N)c([N+](=O)[O-])cc1I 96029248 LFEDHUMOJYMWQN-UHFFFAOYSA-N 294.048 1.790 5 50 CDBA O=C(N[C@@H]1CCC[C@@H]1CCO)c1ccc([N+](=O)[O-])s1 170601322 UVOOHKTUCANRIB-RKDXNWHRSA-N 284.337 1.937 5 50 CDBA COc1ccc(C(=O)N2CCCC2)cc1[N+](=O)[O-] 103433 ZLFBGCVFGDVWAD-UHFFFAOYSA-N 250.254 1.839 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCN(C2CCOCC2)CC1 266992208 ANYJACQJKMLFIS-UHFFFAOYSA-N 292.339 1.291 5 50 CDBA COc1cccc(NC[C@]2(O)CCOC2)c1[N+](=O)[O-] 185630556 SAAISXYAVHFXBH-GFCCVEGCSA-N 268.269 1.167 5 50 CDBA COc1cc(C(=O)NCC(C)C)c([N+](=O)[O-])cc1OC 445392 FGISLJZCCGIIIM-UHFFFAOYSA-N 282.296 1.998 5 50 CDBA CNc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)cn1 295032811 OBGSNEBGKPBGCV-UHFFFAOYSA-N 290.283 1.257 5 50 CDBA O=C(CCCn1cc([N+](=O)[O-])cn1)n1cc(Cl)cn1 1422049 OQQLBHAWCWXIEQ-UHFFFAOYSA-N 283.675 1.762 5 50 CDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)c2)C[C@@H](C)N1 5275390 OTASVJFNJXDROV-RKDXNWHRSA-N 250.302 1.364 5 50 CDBA O=C1CCC(=O)N1OCCOc1cccc([N+](=O)[O-])c1 5049566 AGXKZBRJOGQGSY-UHFFFAOYSA-N 280.236 1.054 5 50 CDBA Cc1ccc(OCCCn2cncn2)c([N+](=O)[O-])c1 5013313 OMFSRKHSJPHJHE-UHFFFAOYSA-N 262.269 1.964 5 50 CDBA CC(=O)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 1423689 LMQSYTYRGMKSJS-UHFFFAOYSA-N 288.263 1.633 5 50 CDBA COC(=O)/C=C(\C)COc1cccnc1[N+](=O)[O-] 585119070 ORPQDAHYMVCRFN-SOFGYWHQSA-N 252.226 1.488 5 50 CDBA O=C(O)[C@@H]1C[C@H](O)CN1Sc1ccccc1[N+](=O)[O-] 43505244 DVIHNYNLBLNACY-CBAPKCEASA-N 284.293 1.122 5 50 CDBA NCCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 44075725 MXSODYDMEQMTKP-UHFFFAOYSA-N 287.341 1.002 5 50 CDBA C[C@@]1(COc2ccccc2)C[N+]23CCO[B-]2(OCC3)O1 195810370 RPEUXZOKVJBTSP-FHERZECASA-N 277.129 1.167 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN3C[C@@H](F)C[C@H]3C2)nc1 952992341 KCWOBRMEUWHAPX-ONGXEEELSA-N 266.276 1.222 5 50 CDBA Cc1nn(CC[C@@H]2CCNC2=O)c2ccc([N+](=O)[O-])cc12 574823313 KXELQGXMOCTYPX-JTQLQIEISA-N 288.307 1.779 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 300571 GINFXBXLTYPPSE-SNVBAGLBSA-N 286.309 1.052 5 50 CDBA COCCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2959587 WWOKZXLABFECHP-AATRIKPKSA-N 250.254 1.371 5 50 CDBA COC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)o1 549197 NKMLPDFXBCJEHK-UHFFFAOYSA-N 279.252 1.836 5 50 CDBA COc1cccc(N[C@H](C)C[S@@](C)=O)c1[N+](=O)[O-] 169041784 CJSOZBUGDNUKRV-CVJBHZAOSA-N 272.326 1.782 5 50 CDBA O=[N+]([O-])c1cnc(N[C@@H]2CCO[C@@]3(CCOC3)C2)c(F)c1 408472289 USVSLHIGJNJNQK-RNCFNFMXSA-N 297.286 1.879 5 50 CDBA CC(C)(C)C1=CC[N+]2(CC1)CCS(=O)(=O)CC2 1615057586 UDYVFTDAPUUPCK-UHFFFAOYSA-N 258.407 1.608 5 50 CDBA O=C(CSCCO)Nc1cccc([N+](=O)[O-])c1 4949396 UDENOPONBLHTTB-UHFFFAOYSA-N 256.283 1.259 5 50 CDBA O=C(NC[C@@H]1CCSC1)c1cc([N+](=O)[O-])ccc1O 279731319 JIBHPVYRZOPRNO-QMMMGPOBSA-N 282.321 1.783 5 50 CDBA C[C@]1(CNC(=O)c2cccc([N+](=O)[O-])c2O)CCCO1 158779197 NQAOBXQUPGNTSB-CYBMUJFWSA-N 280.280 1.599 5 50 CDBA Cc1cc(C)n(C(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])n1 63253 MDXMVQLISGFXMR-UHFFFAOYSA-N 289.247 1.795 5 50 CDBA COc1ncc(CCNc2ncc(C)cc2[N+](=O)[O-])cn1 585123387 QNLMWBKMBYOLLM-UHFFFAOYSA-N 289.295 1.751 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-] 81289 DUGMRWWBMORGRS-SNVBAGLBSA-N 290.275 1.645 5 50 CDBA CCC1=C([N+](=O)[O-])[C@H](c2ccc3c(c2)OCO3)NC(=O)N1 248093 ZHPLGDGVANEAJZ-NSHDSACASA-N 291.263 1.668 5 50 CDBA CC(C)C[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1 4262395 AXZJHDNQDSVIDR-NSHDSACASA-N 251.286 1.907 5 50 CDBA in-vitro O=[N+]([O-])c1cc(Br)cnc1-n1cccn1 15021228 KCPFCBVFDMEAHH-UHFFFAOYSA-N 269.058 1.938 5 50 CDBA in-vitro NC(=O)C1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 4987010 FUISRMQQWUOIIV-HWKANZROSA-N 289.335 1.805 5 50 CDBA CCCN(CCO)Cc1cc(OC)c(O)c([N+](=O)[O-])c1 23281310 ZOAVJKSVTUEEKF-UHFFFAOYSA-N 284.312 1.513 5 50 CDBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCc1cc[nH]n1 170088048 AVVUBVAJPXJZOZ-UHFFFAOYSA-N 296.308 1.334 5 50 CDBA O=[N+]([O-])c1ccccc1CN1CCCC[C@@H]1CO 23115259 RAIQBNQSSUCADQ-GFCCVEGCSA-N 250.298 1.942 5 50 CDBA O=C(O)CCCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 267562 DVNZSMVITJTPOD-UHFFFAOYSA-N 278.220 1.056 5 50 CDBA O=[N+]([O-])c1ccc(N2CCC[C@H](OCCO)C2)s1 169987443 BULXOSXXWAQSOG-VIFPVBQESA-N 272.326 1.634 5 50 CDBA CC1(C)CC(=O)NCCN1Cc1ccc([N+](=O)[O-])cc1 585133734 SQADCVKEVUQFBB-UHFFFAOYSA-N 277.324 1.695 5 50 CDBA O=C(NC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 124898 ZIDAIXFZQZFHDE-NSHDSACASA-N 250.254 1.504 5 50 CDBA CC(=O)Nc1ncc([N+](=O)[O-])cc1Br 38537124 RWVNUCGTBLHJFL-UHFFFAOYSA-N 260.047 1.711 5 50 CDBA in-vitro C=CC(=O)N1CCC(Cn2ccc([N+](=O)[O-])n2)CC1 2325898620 OHBIWAQRCVARCH-UHFFFAOYSA-N 264.285 1.216 5 50 CDBA O=C1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4084015 KPSIWNFRUYLTEF-UHFFFAOYSA-N 251.198 1.630 5 50 CDBA O=c1[nH]c(O)nc(/C=C/c2ccccc2O)c1[N+](=O)[O-] 3898357 ZRWFODUHPFTRCH-AATRIKPKSA-N 275.220 1.260 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/C(=O)O 4992015 XNBQISQCUQYJKW-SNAWJCMRSA-N 250.210 1.483 5 50 CDBA C[C@H]1[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCN1C 408085695 BZRBKCMUQPQJSH-UWVGGRQHSA-N 293.323 1.465 5 50 CDBA O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2NC1CCCC1 5074102 XHIMAFBWNBXULN-UHFFFAOYSA-N 295.320 1.576 5 50 CDBA CCOCCCNC(=O)c1ccc([N+](=O)[O-])cc1 2820787 UNYRTCIWTHUNOP-UHFFFAOYSA-N 252.270 1.751 5 50 CDBA CCCCn1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)n1 2865907 QYGAJZHWJBYFBL-UHFFFAOYSA-N 290.283 1.634 5 50 CDBA Cc1cc2nc3ccc(=[N+](C)C)cc-3[nH]c2cc1N 100078854 KPTCDDDZAJVXHD-UHFFFAOYSA-O 253.329 1.590 5 50 CDBA COC(=O)COc1c(F)cc([N+](=O)[O-])cc1[N+](=O)[O-] 40545132 SJDHVQVSVLATHA-UHFFFAOYSA-N 274.160 1.194 5 50 CDBA O=C(NC[C@@H]1CCCO1)c1ccc(O)c([N+](=O)[O-])c1 163959888 ONYUVNJUOBFYIN-VIFPVBQESA-N 266.253 1.209 5 50 CDBA C[C@]1(NC(=O)COc2ccc([N+](=O)[O-])cc2)CCCOC1 357959126 AZYIGIGGZBRQTO-AWEZNQCLSA-N 294.307 1.659 5 50 CDBA O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 407999926 WOSTXSXFKBYHFD-IPHMSRQVSA-N 290.319 1.502 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])cc(C)c1N1CCC(O)CC1 170613096 MDGMDGBHCYMSDR-UHFFFAOYSA-N 294.307 1.651 5 50 CDBA CCCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 4748877 OPGONQFFJYAICO-UHFFFAOYSA-N 277.324 1.763 5 50 CDBA C[C@H]1Cc2ccccc2N1C(=O)Cn1cc([N+](=O)[O-])cn1 998869 QCAVJAWZOZRKJA-JTQLQIEISA-N 286.291 1.769 5 50 CDBA CCCc1[nH]nc(C(=O)N2C[C@@H](CN)C[C@H]2C)c1[N+](=O)[O-] 261900854 WPMQAIPRZJOIJU-RKDXNWHRSA-N 295.343 1.080 5 50 CDBA COC(=O)[C@@H](C)NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 32626940 PISQBNDMQJLRAL-ZCFIWIBFSA-N 286.671 1.540 5 50 CDBA in-vitro CCc1[nH]nc(C(=O)N2C[C@H]3[C@H](C2)C3(C)C)c1[N+](=O)[O-] 174244050 QOTLZGMKRNWDKL-YUMQZZPRSA-N 278.312 1.608 5 50 CDBA O=[N+]([O-])c1nn(-c2ccccc2)[n+]([O-])c1N1CCCC1 4826692 IDVFWSWPRWBZJN-UHFFFAOYSA-N 275.268 1.014 5 50 CDBA O=c1cc(O)nc(SCc2ccc([N+](=O)[O-])cc2)[nH]1 4903811 XUCHLOGAECOZPC-UHFFFAOYSA-N 279.277 1.676 5 50 CDBA CCOC(=O)[C@H](C(C)=O)C(=O)c1ccccc1[N+](=O)[O-] 101174385 ISECNKUEXSBEIK-LLVKDONJSA-N 279.248 1.546 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3C=C[C@@H](C3)C2)cc1 137408028 GFFPSRGETZZPRF-QWRGUYRKSA-N 294.332 1.791 5 50 CDBA CCOC[C@@H](O)COc1cc(C)c([N+](=O)[O-])cc1F 193835690 UXBZBFUNMKHGOQ-SECBINFHSA-N 273.260 1.819 5 50 CDBA Nc1onc2c1CN(c1ccc([N+](=O)[O-])cc1F)CC2 1615605817 IQJJLWGPBUAFIL-UHFFFAOYSA-N 278.243 1.867 5 50 CDBA Cc1c(C(=O)N2CCOCC2)ccc([N+](=O)[O-])c1[N+](=O)[O-] 25579658 YGNOXVPCCTULDH-UHFFFAOYSA-N 295.251 1.284 5 50 CDBA C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccccc1 197135 LHWRJMCFAVKUSE-SECBINFHSA-N 275.268 1.064 5 50 CDBA O=[N+]([O-])c1ccc(I)c(O)c1 60007417 KUACYTMKOLNBNK-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA C[C@H](NC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)O 40545253 XSCVYCGATHCQFJ-LURJTMIESA-N 253.214 1.189 5 50 CDBA biogenic,in-vitro O=C1C=CC[C@@H]2[C@@H]3CCC[N@+]4([O-])CCC[C@@H](CN12)[C@H]34 253618087 QMGGMESMCJCABO-MQZQPLMUSA-N 262.353 1.660 5 50 CDBA biogenic C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](C)CN1C 408074627 XDYRQSUTZXVFFP-VHSXEESVSA-N 280.328 1.098 5 50 CDBA CC(C)(C)C1CCC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 170624120 MXIPLZZAXFWZAV-HFXYEQLZSA-N 298.383 1.735 5 50 CDBA CC(=O)OCCn1cc(Br)c([N+](=O)[O-])n1 585118816 CUQHFQBTBWXQQP-UHFFFAOYSA-N 278.062 1.117 5 50 CDBA O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc([N+](=O)[O-])c(O)c1 225419895 FZNSNTCNOVLVPY-KBVBSXBZSA-N 278.264 1.350 5 50 CDBA COCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1 5060904 FNJAPOQSGPPNDK-UHFFFAOYSA-N 253.258 1.753 5 50 CDBA Cc1ccc(OCC(=O)Nc2ccon2)c([N+](=O)[O-])c1 6690900 USDVBCAOIYHVBZ-UHFFFAOYSA-N 277.236 1.909 5 50 CDBA CC(=O)OC(OC(C)=O)c1ccccc1[N+](=O)[O-] 122381 PMZHONATLZBKIL-UHFFFAOYSA-N 253.210 1.720 5 50 CDBA in-vitro N=C1NC(=O)[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S1 18137552 VJSSGAAKNJWHBT-MRVPVSSYSA-N 294.292 1.090 5 50 CDBA Cc1ccc([C@@H]2N[C@@H](C(=O)O)CS2)cc1[N+](=O)[O-] 32989 XCCZFOBFTQIDBX-PSASIEDQSA-N 268.294 1.691 5 50 CDBA CCOc1cc([N+](=O)[O-])cc(C=O)c1O[C@@H](C)C(=O)O 4803512 RJBBXGKMBBIBSC-ZETCQYMHSA-N 283.236 1.658 5 50 CDBA COC(=O)CCC(=O)Nc1ccc(C)cc1[N+](=O)[O-] 22015237 UMCCCGCOQSCBDJ-UHFFFAOYSA-N 266.253 1.795 5 50 CDBA CC1(NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCNCC1 229627761 UTDZGQLLNKDHTA-UHFFFAOYSA-N 299.352 1.015 5 50 CDBA O=C1CCCN1c1cc2c(cc1[N+](=O)[O-])OCO2 15083649 GJSNCZAYCGUOEH-UHFFFAOYSA-N 250.210 1.450 5 50 CDBA O=C(O)c1cc([N+](=O)[O-])c(Br)c([N+](=O)[O-])c1 3160586 CEKRKRORVUEWMI-UHFFFAOYSA-N 291.013 1.964 5 50 CDBA COc1cccc(NC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 185630572 SAAISXYAVHFXBH-LBPRGKRZSA-N 268.269 1.167 5 50 CDBA C[N+](C)(C)CCOC(=O)[C@H]1OCCc2ccccc21 490961 GKJYAGYYOTXPNJ-AWEZNQCLSA-N 264.345 1.550 5 50 CDBA biogenic O=[N+]([O-])c1ccccc1OCCOCCN1CCOCC1 19637748 SJSNLIURYBPPED-UHFFFAOYSA-N 296.323 1.322 5 50 CDBA CCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2564841 LTJACLQPFWDXMR-UHFFFAOYSA-N 253.214 1.643 5 50 CDBA O=C1N[C@H]2c3ccc([N+](=O)[O-])cc3C(=O)N2c2ccccc21 252496682 POMWWGHFRPIOAK-CYBMUJFWSA-N 295.254 1.997 5 50 CDBA Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@](C)(O)C1CC1 585089764 TVOANFMNLIQPJX-AWEZNQCLSA-N 296.298 1.933 5 50 CDBA CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](C)(O)C1 67157 TZYDUQBFBRCHEN-LBPRGKRZSA-N 263.253 1.525 5 50 CDBA O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@@]2(CCOC2)C1 159431951 PRUHQEWBLZWGAH-CQSZACIVSA-N 292.291 1.553 5 50 CDBA COC(=O)[C@H]1C[C@H](O)CN1Cc1cccc([N+](=O)[O-])c1C 169033859 FHKDRSCIMSELFL-WCQYABFASA-N 294.307 1.011 5 50 CDBA COC(=O)C(C(=O)OC)c1ccc(Cl)cc1[N+](=O)[O-] 80785 XNQGJNNDVKLNQO-UHFFFAOYSA-N 287.655 1.678 5 50 CDBA in-vitro CCN1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 4819519 ZSHXOBLXFDDREA-UHFFFAOYSA-N 277.324 1.681 5 50 CDBA CC(=O)c1ccc(N[C@@H]2CCNC(=O)CC2)c([N+](=O)[O-])c1 521394811 FDPMKLLDOJMEGA-NSHDSACASA-N 291.307 1.878 5 50 CDBA COC(=O)C(C(=O)OC)c1cc(Cl)ccc1[N+](=O)[O-] 34734360 QDIDUMPXQHXGQW-UHFFFAOYSA-N 287.655 1.678 5 50 CDBA Cc1cc(NC[C@H](O)c2cnc[nH]2)ccc1[N+](=O)[O-] 1353362812 ZYZIMPYCCKZOFJ-LBPRGKRZSA-N 262.269 1.772 5 50 CDBA CN(C)CCCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 2912989 DHSIHHZFKCWDGL-UHFFFAOYSA-N 285.731 1.930 5 50 CDBA COC(=O)c1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 103417 UVXBSXLPWBAFPP-JQWIXIFHSA-N 278.264 1.070 5 50 CDBA Cc1ccc(NC(=O)c2c([N+](=O)[O-])ncn2C)cc1 139502 GYYFMBMQUDVADS-UHFFFAOYSA-N 260.253 1.889 5 50 CDBA O=[N+]([O-])C1=C/C(=C2\C=C([N+](=O)[O-])C=C[N+]2=O)N(O)C=C1 135908754 WXNZXNOYJCKSDV-KTKRTIGZSA-N 279.188 1.044 5 50 CDBA COC(=O)/C=C(\C)NC(=O)c1ccc([N+](=O)[O-])cc1 16662239 BWYKWONYWDQIHW-BQYQJAHWSA-N 264.237 1.401 5 50 CDBA O=C(NCCNc1ccc([N+](=O)[O-])cn1)C(F)(F)F 19913491 JSAHYHFTTUERBS-UHFFFAOYSA-N 278.190 1.080 5 50 CDBA COC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1Cl 255463 AYAQJPNOVZPGJO-UHFFFAOYSA-N 272.644 1.151 5 50 CDBA biogenic,in-vitro CC(C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 1604728 HDBVLHIQSYYAII-UHFFFAOYSA-N 253.214 1.641 5 50 CDBA CNc1ccc(CN[C@H]2CCCCNC2=O)cc1[N+](=O)[O-] 169971092 RIAXMJKESIWHEA-LBPRGKRZSA-N 292.339 1.395 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1nccs1 251108 AZBFJMQLIITNQR-UHFFFAOYSA-N 275.245 1.852 5 50 CDBA O=[N+]([O-])c1cc(Cl)cc([N+](=O)[O-])c1S(=O)(=O)O 2170647 ZASUMZAIIASPCF-UHFFFAOYSA-N 282.617 1.403 5 50 CDBA NS(=O)(=O)c1c([N+](=O)[O-])ccc(Cl)c1Cl 263624316 PGVTVDRJQSVXQY-UHFFFAOYSA-N 271.081 1.549 5 50 CDBA O=[N+]([O-])c1cccc(I)c1O 34099924 UGDVZTHIEZAYRU-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA in-vitro CC(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 4818994 OQNVGEQCXHXBMG-UHFFFAOYSA-N 267.260 1.402 5 50 CDBA COC(=O)c1ccc(/C=C/N(C)C)c([N+](=O)[O-])c1 55526907 RTGNZFSMKJWWKA-VOTSOKGWSA-N 250.254 1.914 5 50 CDBA Cc1c(Br)c([N+](=O)[O-])nn1CCCC(=O)O 34928890 URSLCWIGOHLECM-UHFFFAOYSA-N 292.089 1.727 5 50 CDBA COc1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c(OC)c1 89594 BGHATRKYYKUFPI-GWCFXTLKSA-N 280.280 1.300 5 50 CDBA Cc1nc(N2CCC(C)CC2)nc(NCCO)c1[N+](=O)[O-] 4918446 LGGUUQMOXCOEOM-UHFFFAOYSA-N 295.343 1.334 5 50 CDBA Cc1nc([N+](=O)[O-])c(-c2noc(C3CCOCC3)n2)n1C 225554140 ZYSBLHTWOHKPAY-UHFFFAOYSA-N 293.283 1.581 5 50 CDBA Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2O)no1 120279720 MBKHEQNDRCDXJK-UHFFFAOYSA-N 263.209 1.849 5 50 CDBA O=[N+]([O-])c1ncn(CCc2ccc3c(c2)CCO3)n1 150909111 UUAMCKBJARXHHK-UHFFFAOYSA-N 260.253 1.364 5 50 CDBA Cc1cc(NC[C@@H](O)c2cnc[nH]2)ccc1[N+](=O)[O-] 1353362811 ZYZIMPYCCKZOFJ-GFCCVEGCSA-N 262.269 1.772 5 50 CDBA CCCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 4195988 SXPXWCUVVZOBMN-UHFFFAOYSA-N 268.269 1.752 5 50 CDBA CC(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 4549175 RITCHQBCPMURTL-UHFFFAOYSA-N 257.677 1.796 5 50 CDBA Nc1nc(I)ccc1[N+](=O)[O-] 141594007 OFNGNLQJHMFYLB-UHFFFAOYSA-N 265.010 1.177 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@H](c3ccon3)C2)nc1 1775989424 NUINCVUDQHEAPX-VIFPVBQESA-N 260.253 1.972 5 50 CDBA CCOc1ccc([C@@H](O)C[N+](=O)[O-])cc1OCC 140326 GLOGSVOPMKZAKV-JTQLQIEISA-N 255.270 1.794 5 50 CDBA CCN(CC)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 3995699 UZUBNVCFONLFSW-UHFFFAOYSA-N 288.325 1.634 5 50 CDBA CC1(C)N=C(Nc2ccccc2[N+](=O)[O-])N=C(N)N1 4846221 DLVJSVJORVDPHD-UHFFFAOYSA-N 262.273 1.017 5 50 CDBA COC[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 113435625 DETKWRJPNPQDRP-JTQLQIEISA-N 294.307 1.799 5 50 CDBA Cc1nn([C@@H](C)C(=O)NCc2ccco2)c(C)c1[N+](=O)[O-] 1070545 BEOZSGVHJXIYFN-JTQLQIEISA-N 292.295 1.879 5 50 CDBA NC(=O)[C@H](F)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 585133192 AIILPQCDILBKEV-CYBMUJFWSA-N 295.314 1.630 5 50 CDBA C[C@H](O)CNCCNc1ccc([N+](=O)[O-])c2cccnc12 4045818 KYGLWXLOXYFWLV-JTQLQIEISA-N 290.323 1.525 5 50 CDBA Cc1ccn(Cc2cscn2)c(=O)c1[N+](=O)[O-] 225473926 XHYBZFDNPKLJSW-UHFFFAOYSA-N 251.267 1.570 5 50 CDBA Nc1cc(=O)n(C(=O)c2cc([N+](=O)[O-])ccc2Cl)o1 253413535 VAVKPBCNDOAYDH-UHFFFAOYSA-N 283.627 1.274 5 50 CDBA O=C(Cn1ccnc1[N+](=O)[O-])N1CCC[C@H]2CCCC[C@@H]21 585133049 PJAJELDKOCFWJO-NEPJUHHUSA-N 292.339 1.973 5 50 CDBA CN1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1 19608817 YJDIRYPVQLQGHR-UHFFFAOYSA-N 251.286 1.048 5 50 CDBA CC(C)Nc1cc(N2CCNCC2)ccc1[N+](=O)[O-] 4740957 RWQXJALRNBCRMX-UHFFFAOYSA-N 264.329 1.825 5 50 CDBA COC(=O)c1cnc(NC2CSC2)c([N+](=O)[O-])c1 585117990 NMJNRDAGMPPGLR-UHFFFAOYSA-N 269.282 1.304 5 50 CDBA CN1CCN(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 31623081 VGUWZCUCNQXGBU-UHFFFAOYSA-N 274.324 1.824 5 50 CDBA Cc1ccc2nnc(CNc3ccc([N+](=O)[O-])c(C)n3)n2n1 170606556 LGAHYGSOBHFZMQ-UHFFFAOYSA-N 299.294 1.656 5 50 CDBA COc1cc([C@@H](CC(=O)O)C(=O)O)c([N+](=O)[O-])cc1OC 4689827 HFPBTJCGXNRHNB-SSDOTTSWSA-N 299.235 1.255 5 50 CDBA CN(CCCn1ccnc1)c1cc(N)ccc1[N+](=O)[O-] 193480292 HZVWVKGJGDKPPB-UHFFFAOYSA-N 275.312 1.900 5 50 CDBA Cc1ccc([C@@H]2N[C@H](C(=O)O)CS2)cc1[N+](=O)[O-] 32991 XCCZFOBFTQIDBX-WCBMZHEXSA-N 268.294 1.691 5 50 CDBA O=C(O[C@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 4829344 MJOVTDWCYHURGZ-MNOVXSKESA-N 251.238 1.665 5 50 CDBA Cc1cc(C(=O)NCc2cnn(C)c2C)ccc1[N+](=O)[O-] 484458 QNYKZMNJLSYXAV-UHFFFAOYSA-N 288.307 1.875 5 50 CDBA Cc1occc1CN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 193455095 COFIZAPMGHAPPB-UHFFFAOYSA-N 291.263 1.869 5 50 CDBA COc1cc(CN2CCC[C@@H](O)C2)c([N+](=O)[O-])cc1OC 16310490 YAIJYIGMLNESNY-LLVKDONJSA-N 296.323 1.569 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccc([N+](=O)[O-])cc1 256302 XVIOCUMPZRUXAE-LLVKDONJSA-N 290.275 1.645 5 50 CDBA CNC(=O)[C@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])nc1 345151239 QWWXKHCIZDPTQT-UWVGGRQHSA-N 264.285 1.316 5 50 CDBA CNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 21816052 DIZFYBKFPSKWRH-UHFFFAOYSA-N 250.663 1.156 5 50 CDBA CC(=O)N1CC(Nc2ccc(Cl)cc2[N+](=O)[O-])C1 521395282 TXOUZWRWRPMYNN-UHFFFAOYSA-N 269.688 1.891 5 50 CDBA O=C(c1ccc[nH]1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188573155 LDEWZYJFNKNTEZ-UHFFFAOYSA-N 287.275 1.826 5 50 CDBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1cccnc1 237465 QKVCZIRQPPOYKW-UHFFFAOYSA-N 269.216 1.790 5 50 CDBA Cn1c(=O)c([N+](=O)[O-])c(-n2ccnc2)c2ccccc21 250961 WUBVJSYRHXOQIJ-UHFFFAOYSA-N 270.248 1.632 5 50 CDBA CCCn1cc(CNc2cc(C)c([N+](=O)[O-])cn2)nn1 952993490 YLLVDIUSSBLZJL-UHFFFAOYSA-N 276.300 1.912 5 50 CDBA COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(C)C 307296 IRGWSRASMVFLNH-SECBINFHSA-N 270.241 1.115 5 50 CDBA CCOC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1C 4506180 DMNGKTUPPZQNHF-UHFFFAOYSA-N 252.226 1.405 5 50 CDBA CO[C@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 170005766 KFNLKQYTYAGWNH-GWCFXTLKSA-N 294.307 1.988 5 50 CDBA C[C@H]1OCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)[C@@H]1C 150905923 NFQCJWCIVXGNQD-RKDXNWHRSA-N 280.280 1.550 5 50 CDBA CCOC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])cc1NC(C)=O 6668207 JDFBAXUKYYSTDS-MRVPVSSYSA-N 296.279 1.884 5 50 CDBA Nc1nnc(S/C=C/c2ccc([N+](=O)[O-])o2)[nH]1 253415837 GCPYRNWDRYLBEF-ONEGZZNKSA-N 253.243 1.651 5 50 CDBA COC(=O)c1cc(OC)c([N+](=O)[O-])cc1C(=O)OC 85224259 ZGASGVVPYSDBEA-UHFFFAOYSA-N 269.209 1.177 5 50 CDBA C[C@H]1C[C@H](O)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 408279329 ZAXGNRURCUUEQD-CPCISQLKSA-N 283.259 1.721 5 50 CDBA O=C(O)c1cc(-n2cccn2)c(F)cc1[N+](=O)[O-] 42684299 XYFAPGQLTCVZOK-UHFFFAOYSA-N 251.173 1.618 5 50 CDBA in-vitro COC(=O)C(C)(C)c1cc([N+](=O)[O-])ccc1[N+](=O)[O-] 1772575856 WXNHJGRIHKUGSG-UHFFFAOYSA-N 268.225 1.954 5 50 CDBA O=c1[nH]c(O)nc(/C=C/c2cccc(F)c2)c1[N+](=O)[O-] 15009203 AEWZUNRDZSLGDO-SNAWJCMRSA-N 277.211 1.693 5 50 CDBA CN1CCN(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 4996843 VJOUFXWCCFEHEH-UHFFFAOYSA-N 298.730 1.140 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCNC1=O 858978 CYFYOBYYOJJASG-VIFPVBQESA-N 293.279 1.068 5 50 CDBA CC[C@H](CO)N1CCN(c2cccc(C)c2[N+](=O)[O-])CC1 225459344 PCBWIYGNDQQUPR-CYBMUJFWSA-N 293.367 1.796 5 50 CDBA O=C(CSc1ncn[nH]1)c1cccc([N+](=O)[O-])c1 13154479 NEODFQWDNHLXRI-UHFFFAOYSA-N 264.266 1.688 5 50 CDBA O=C(O)[C@@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 19979726 POEMRFUPSCRXHF-SECBINFHSA-N 293.279 1.923 5 50 CDBA CCN(CC)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3157520 BQWBSYSXEQYXJI-UHFFFAOYSA-N 267.241 1.985 5 50 CDBA Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 1421783 HICMGWSIDYMLKV-UHFFFAOYSA-N 261.241 1.133 5 50 CDBA O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCO1 19991903 CTAHUEVTRDBKHX-JTQLQIEISA-N 252.226 1.418 5 50 CDBA CCn1c2nc(=O)n(C)c(=O)c-2nc2cc(C)c(C)cc21 217024973 FMSUGHVGTYMDRD-UHFFFAOYSA-N 284.319 1.232 5 50 CDBA O=C(O)CN1C(=O)C(F)(F)c2cc([N+](=O)[O-])ccc21 238856138 UXXGCAUSTWKSJP-UHFFFAOYSA-N 272.163 1.118 5 50 CDBA O=C(O)[C@H]1CCCN(c2ncccc2[N+](=O)[O-])C1 15443065 GEEPPMTYMYSFIS-QMMMGPOBSA-N 251.242 1.291 5 50 CDBA Cc1cc(N2CCN(C)CC2)c(F)cc1[N+](=O)[O-] 4498756 GXCCKNZQWKVUKR-UHFFFAOYSA-N 253.277 1.794 5 50 CDBA CN(C)[S@](C)(=O)=NC(=O)Cc1ccccc1[N+](=O)[O-] 1615059073 ZKIGJEHBATYFGX-LJQANCHMSA-N 285.325 1.238 5 50 CDBA C[C@@H](O)C[C@H]1COCCN1c1ccccc1[N+](=O)[O-] 130037754 YRNJSECPAHPKBI-MNOVXSKESA-N 266.297 1.571 5 50 CDBA CN(CCO)c1ccc(Br)cc1[N+](=O)[O-] 40418940 FJVONVWURLPBSR-UHFFFAOYSA-N 275.102 1.786 5 50 CDBA CCn1ccnc1CNC(=O)Nc1ccncc1[N+](=O)[O-] 297772700 NBUNCTLOSZSERB-UHFFFAOYSA-N 290.283 1.528 5 50 CDBA COC(=O)CCCC(=O)Nc1ccc([N+](=O)[O-])cc1 4593063 NUVFURVLBHSEDZ-UHFFFAOYSA-N 266.253 1.877 5 50 CDBA C[C@@H]1OC[C@@H]2ON(C)[C@H](c3cccc([N+](=O)[O-])c3)[C@@H]2CO1 230051871 LEEHOBZPJJDMHG-GSVCSZOMSA-N 294.307 1.891 5 50 CDBA COC(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1N 5569960 QVXGXKQYZXVOJG-UHFFFAOYSA-N 270.270 1.230 5 50 CDBA CC(=O)Nc1ncc(Br)cc1[N+](=O)[O-] 3894098 DHYOFFIZCYGNSE-UHFFFAOYSA-N 260.047 1.711 5 50 CDBA O=C1CC(=O)N2N=C(c3cccc([N+](=O)[O-])c3)SC2=N1 437459 CTLPCLPKMCAAPY-UHFFFAOYSA-N 290.260 1.118 5 50 CDBA O=c1c([N+](=O)[O-])c(/C=C/c2ccccc2)nc2nc[nH]n12 110433889 RRYZRSFGPGRNEA-VOTSOKGWSA-N 283.247 1.496 5 50 CDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](c2ccccc2)C1 229788168 IOOHKUMRLSBHLM-JHJVBQTASA-N 260.293 1.668 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N(C)C[C@@H](O)C(F)(F)F 192742334 GYUZGZITLQXCAN-SSDOTTSWSA-N 296.249 1.479 5 50 CDBA O=[N+]([O-])c1cccnc1N[C@@H](CO)Cc1nccs1 1615587668 PSIKAWTWRBMECJ-MRVPVSSYSA-N 280.309 1.462 5 50 CDBA O=[N+]([O-])c1cccc(Cl)c1N1CCN(CCO)CC1 19735911 CQHQAWQOONUNCR-UHFFFAOYSA-N 285.731 1.363 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)n1cccn1 460590 QSBFESOEAMCIGV-UHFFFAOYSA-N 253.239 1.028 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 4591365 OYVAZIUYLSDOTR-SNVBAGLBSA-N 286.309 1.052 5 50 CDBA O=C(O)Cc1c(Br)cccc1[N+](=O)[O-] 75629387 LOWAAWMXRXSOPA-UHFFFAOYSA-N 260.043 1.984 5 50 CDBA N=c1nc(O)c2cc([N+](=O)[O-])cc(Br)c2[nH]1 498049419 UEYHERHEDJXYTM-UHFFFAOYSA-N 285.057 1.419 5 50 CDBA O=[N+]([O-])c1ccc(CSc2nnc3[nH]cnn23)cc1 5731122 PVRDQCYQVDDFPR-UHFFFAOYSA-N 276.281 1.653 5 50 CDBA Nc1nc(SCc2cccc([N+](=O)[O-])c2)n[nH]1 3620665 NFTSRDVKUPZNRW-UHFFFAOYSA-N 251.271 1.587 5 50 CDBA O=C(O)COc1ccc([N+](=O)[O-])cc1-c1ccno1 25758146 SLDQASAMTFSQEE-UHFFFAOYSA-N 264.193 1.713 5 50 CDBA CC(C)(CNc1ncc([N+](=O)[O-])cn1)n1cccn1 585117995 OYDVHPLOARSCOY-UHFFFAOYSA-N 262.273 1.429 5 50 CDBA COC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(C)c1 456304 HSUUOKOYUOOBBJ-VIFPVBQESA-N 252.270 1.668 5 50 CDBA Cc1c(NC(=O)NOC(C)(C)CO)cccc1[N+](=O)[O-] 297458462 MUJTXTHRMLVDJH-UHFFFAOYSA-N 283.284 1.727 5 50 CDBA C[C@@]1(O)CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 153832987 UMXDHNHXCGCUHR-CYBMUJFWSA-N 280.280 1.287 5 50 CDBA Nc1nncn1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 466866 UUQOISRLLWGKML-UHFFFAOYSA-N 267.632 1.110 5 50 CDBA CCOc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 1423799 IONZVMIKZQHJRZ-UHFFFAOYSA-N 290.279 1.829 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2ccc3c(c2)OCO3)N1 103381 FKMJJAMPPJQKFX-QPUJVOFHSA-N 264.237 1.012 5 50 CDBA CC(C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 441500 OMTDFLIRLUVIQE-UHFFFAOYSA-N 272.326 1.919 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@@H](C)C[C@@H](C)N)c1[N+](=O)[O-] 520815204 BFTCFEAQEGJFPY-SFYZADRCSA-N 283.332 1.126 5 50 CDBA Cc1csc(NC(=O)c2nn(C)c(C)c2[N+](=O)[O-])n1 376098 BYARPFFMMXJBGV-UHFFFAOYSA-N 281.297 1.654 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1CCCO[C@@H](C)C1 408522945 FHLQZHSVSQJGMI-JTQLQIEISA-N 294.307 1.997 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@H](C(N)=O)C1 192612495 STDZBWOIXMYQIP-VHSXEESVSA-N 295.343 1.576 5 50 CDBA COC(=O)C1=C(C)N(c2ccc([N+](=O)[O-])cc2)C(=O)C1 5059509 QHHCAELLSQVVQA-UHFFFAOYSA-N 276.248 1.779 5 50 CDBA Cn1cnnc1SCC(=O)c1ccc([N+](=O)[O-])cc1 1111209 ARMXFYPJWFLAGR-UHFFFAOYSA-N 278.293 1.698 5 50 CDBA Cc1cc(C)nc(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)n1 1432073 MDBYQYNHUWHPIK-SECBINFHSA-N 290.283 1.398 5 50 CDBA O=C(O)[C@H]1CS[C@@H](c2ccc([N+](=O)[O-])s2)N1 99232 WNEKIYRMXWCTGY-FBCQKBJTSA-N 260.296 1.445 5 50 CDBA CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@@H]1CCCO1 152533719 XTIQBODKKHSVEP-JQWIXIFHSA-N 294.307 1.988 5 50 CDBA CCOC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cn1 95630340 GHPOKHBQTJQLBX-UHFFFAOYSA-N 270.270 1.433 5 50 CDBA in-vitro COc1cc(CCN=c2ccc([N+](=O)[O-])c(C)[nH]2)ccn1 408523810 NRCAKUZAUUTLNB-UHFFFAOYSA-N 288.307 1.778 5 50 CDBA O=c1c2c(O)cc(O)cc2oc2c(O)ccc(O)c12 6092269 MPXAWSABMVLIBU-UHFFFAOYSA-N 260.201 1.769 5 50 CDBA biogenic,in-vitro O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccccc1F 1428138 IUUWAYSLJXXXDK-UHFFFAOYSA-N 264.216 1.569 5 50 CDBA CCN(c1cc(C)c([N+](=O)[O-])cn1)[C@H]1CCNC1=O 225646229 SWMLPXPIFLPXGA-VIFPVBQESA-N 264.285 1.013 5 50 CDBA C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc([N+](=O)[O-])cn1 998870 QCAVJAWZOZRKJA-SNVBAGLBSA-N 286.291 1.769 5 50 CDBA C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)[C@@H](C(N)=O)C1 952993332 WVACXDXSYNAGJK-QPUJVOFHSA-N 281.287 1.824 5 50 CDBA CSc1ccc(C(=O)N2C[C@H](O)C[C@H]2C)cc1[N+](=O)[O-] 170089371 BNPXOOAGPKGZSI-PSASIEDQSA-N 296.348 1.912 5 50 CDBA O=C(N[C@H]1CCC[C@H]1CCO)c1ccc([N+](=O)[O-])s1 170601325 UVOOHKTUCANRIB-IUCAKERBSA-N 284.337 1.937 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(F)c(F)c1 1428116 CNGCRKJCXYVOOF-UHFFFAOYSA-N 282.206 1.708 5 50 CDBA CSCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1 4899518 PLBWRAWSHVJPTL-JTQLQIEISA-N 269.326 1.614 5 50 CDBA Cc1cccc(NC2=C([N+](=O)[O-])CS(=O)(=O)C2)c1 297196 AFIWSEJUYWCWFJ-UHFFFAOYSA-N 268.294 1.324 5 50 CDBA O=C(Nc1ccc2c[nH]nc2c1)c1cc([N+](=O)[O-])cnc1O 192682899 UNMUVDVZAJHQNO-UHFFFAOYSA-N 299.246 1.824 5 50 CDBA O=[N+]([O-])c1ccc(/C=C/S(=O)(=O)N2CCOCC2)cc1 236665 JALYXQMJMKUPGC-BJMVGYQFSA-N 298.320 1.228 5 50 CDBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1 4179349 MKUHRNFZJODRNV-QMMMGPOBSA-N 266.257 1.301 5 50 CDBA in-vitro NC(=O)c1nn(Cc2ccccc2Cl)cc1[N+](=O)[O-] 1424630 NKLKCVNBMAHZHV-UHFFFAOYSA-N 280.671 1.592 5 50 CDBA C[C@@]1(NC(=O)COc2ccc([N+](=O)[O-])cc2)CCCOC1 357959127 AZYIGIGGZBRQTO-CQSZACIVSA-N 294.307 1.659 5 50 CDBA O=C(NC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-] 2741615 IZBCSUJISWFSPG-SECBINFHSA-N 250.254 1.504 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCCNC[C@@H](C)O)c1 2881345 PKRFDBXKSFOLDB-LLVKDONJSA-N 268.313 1.643 5 50 CDBA COC[C@H](O)COc1ccc([N+](=O)[O-])c(Cl)c1 180782983 LLYUBICUSCZNHP-ZETCQYMHSA-N 261.661 1.634 5 50 CDBA NC(=O)[C@H]1CCCCN1c1ncc(Cl)cc1[N+](=O)[O-] 1775988648 VVTQEAAYKDTNAA-MRVPVSSYSA-N 284.703 1.487 5 50 CDBA O=C(c1ccon1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188583668 LDKSCYRHRQWBIO-UHFFFAOYSA-N 289.247 1.486 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)NCc1ccccc1 317725 BZBIPJWTUJTNKJ-UHFFFAOYSA-N 274.280 1.416 5 50 CDBA O=[N+]([O-])c1c(NCCO)cc(Cl)c2nonc12 3882521 NNUHMROEIBTAEX-UHFFFAOYSA-N 258.621 1.189 5 50 CDBA in-vitro CCCN(CCO)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] 4988668 JPYKXDBPDQTHAK-UHFFFAOYSA-N 298.339 1.816 5 50 CDBA COCCCNc1c([N+](=O)[O-])cc(C(=O)O)cc1[N+](=O)[O-] 585655901 MDDNZXOVVPQAJN-UHFFFAOYSA-N 299.239 1.650 5 50 CDBA CCOC(=O)c1c(N)c2cc([N+](=O)[O-])cnc2n1C 3878298 NAEFISQWKNCPNW-UHFFFAOYSA-N 264.241 1.240 5 50 CDBA O=C(Oc1ccccc1[N+](=O)[O-])N1CCOCC1 472760 WHDQTDGAASCPQF-UHFFFAOYSA-N 252.226 1.426 5 50 CDBA Cc1cc(C)n(C(=O)c2ccc([N+](=O)[O-])cc2N)n1 618979 QVTAMBGEIFVIMY-UHFFFAOYSA-N 260.253 1.679 5 50 CDBA CCCCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4006701 UMSNAWAFKANFKL-UHFFFAOYSA-N 272.326 1.982 5 50 CDBA COC(CNc1ccc2nonc2c1[N+](=O)[O-])OC 4131804 JMAICKXCVRNZME-UHFFFAOYSA-N 268.229 1.162 5 50 CDBA CN(C)C1CCN(c2cc([N+](=O)[O-])ccc2C=O)CC1 169725210 USCOQTXHISCFJZ-UHFFFAOYSA-N 277.324 1.938 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 4591363 OYVAZIUYLSDOTR-JTQLQIEISA-N 286.309 1.052 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)/C=C\C(=O)O 4582646 XNBQISQCUQYJKW-PLNGDYQASA-N 250.210 1.483 5 50 CDBA CC(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4687406 WIDJJQLIZCFKDT-UHFFFAOYSA-N 283.715 1.917 5 50 CDBA O=[N+]([O-])c1cccnc1N1CC[C@@H](c2ncc[nH]2)C1 585092658 IPNVVVDGAUVNRH-SECBINFHSA-N 259.269 1.707 5 50 CDBA CS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 2515993 ZRANEAXTVRBKGK-UHFFFAOYSA-N 280.099 1.761 5 50 CDBA in-vitro COc1ccc(CSc2nnc(N)o2)cc1[N+](=O)[O-] 3094665 UMUYWYUREJDYNJ-UHFFFAOYSA-N 282.281 1.861 5 50 CDBA C[N+]1([C@H]2CC[C@H]3CCC[C@H]2C32OCCO2)CCOCC1 101022209 VRVCNBSRFRKSAW-KFWWJZLASA-N 282.404 1.785 5 50 CDBA Cc1cc(N2CC[C@@]3(CCCN3C)C2)ncc1[N+](=O)[O-] 952880566 BZMXHTIYBHUXQP-AWEZNQCLSA-N 276.340 1.973 5 50 CDBA CN1CC[C@H]2CC[C@H](C1)N2c1ncccc1[N+](=O)[O-] 585092446 XCMQQNHNFUZJAA-GHMZBOCLSA-N 262.313 1.663 5 50 CDBA O=C1NC(=O)/C(=C2\C(=O)Nc3ccc([N+](=O)[O-])cc32)S1 13124983 CHFDKPMDYFIDBA-BQYQJAHWSA-N 291.244 1.241 5 50 CDBA C[C@@H](C(=O)N1CCCCC1)n1cc([N+](=O)[O-])cn1 1432070 YFEGEPZGZFHFOA-VIFPVBQESA-N 252.274 1.365 5 50 CDBA CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)C(=O)O 2546070 ZCZIHDVSTSPBPF-SSDOTTSWSA-N 283.236 1.658 5 50 CDBA O=C(Nc1ncccn1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2902583 QMNNSQZQRZDWHI-UHFFFAOYSA-N 289.207 1.545 5 50 CDBA COc1cc(CN2CCN(C)CC2)c([N+](=O)[O-])cc1OC 4990140 FPFADJLVZGXUIJ-UHFFFAOYSA-N 295.339 1.359 5 50 CDBA O=[N+]([O-])c1ccc(N[C@@H](CO)[C@@H]2CCCO2)cc1 253428414 QAIPMTZFOJDKBW-RYUDHWBXSA-N 252.270 1.547 5 50 CDBA Cc1c([N+](=O)[O-])ncn1CCO[C@H]1CCCCO1 1775990273 WPPUDRPDDYLHNH-JTQLQIEISA-N 255.274 1.643 5 50 CDBA CC(C)(C)OC(=O)N1CC[C@H](n2cc([N+](=O)[O-])cn2)C1 74938174 VYHFLIFNGPQXEV-VIFPVBQESA-N 282.300 1.973 5 50 CDBA in-vitro CN(c1cnccn1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 170619595 FGZCEWPGPCEVGH-UHFFFAOYSA-N 294.292 1.210 5 50 CDBA NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4708921 JJFOZTXLHDSNSE-UHFFFAOYSA-N 284.703 1.449 5 50 CDBA O=[N+]([O-])c1ccc(NCCCN2CCOCC2)c(F)c1 20136723 ATYYTVBJPXUSHU-UHFFFAOYSA-N 283.303 1.868 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)NCCc1ccccc1 91423 ZEXQVJWFSDFLEP-UHFFFAOYSA-N 288.307 1.459 5 50 CDBA C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1 273181263 GPHCUPINQYGKFJ-MRVPVSSYSA-N 250.254 1.782 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC(O)(C2CC2)C1 373718394 DKMWXBWMOOMYKN-UHFFFAOYSA-N 291.307 1.892 5 50 CDBA O=C(O)CSc1nc2cc([N+](=O)[O-])ccc2[nH]1 5687395 SMTHPGGRKWIUEJ-UHFFFAOYSA-N 253.239 1.648 5 50 CDBA CCOCC(=O)Nc1cc([N+](=O)[O-])ccc1OCC 252492129 MDMXVMHYPJHMNT-UHFFFAOYSA-N 268.269 1.969 5 50 CDBA Cc1cc(N2CCN(C[C@H](C)O)C[C@@H]2C)ncc1[N+](=O)[O-] 230243219 RRKMGSZRNLSUQH-RYUDHWBXSA-N 294.355 1.190 5 50 CDBA COc1ccc(C(=O)NC[C@H]2CCCO2)cc1[N+](=O)[O-] 284736 FAFSASGZBUPDLR-SNVBAGLBSA-N 280.280 1.512 5 50 CDBA C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)[C@H](C(N)=O)C1 952993335 WVACXDXSYNAGJK-UFBFGSQYSA-N 281.287 1.824 5 50 CDBA CNC(=O)NCCNc1ccc(Cl)cc1[N+](=O)[O-] 397435392 NNMRWBGMTOJSFF-UHFFFAOYSA-N 272.692 1.589 5 50 CDBA O=C([C@H]1C[C@H]1[N+](=O)[O-])N1CCC(OC2CCCCC2)CC1 170603137 KVFFXOATKBIEIB-UONOGXRCSA-N 296.367 1.992 5 50 CDBA CCOCC(=O)Nc1ccc([N+](=O)[O-])cc1OC 4700490 IQQDHXRKNSFBEG-UHFFFAOYSA-N 254.242 1.578 5 50 CDBA CN1CCC(NC(=O)c2ccccc2[N+](=O)[O-])CC1 4749756 APUPKPHYWRRQGK-UHFFFAOYSA-N 263.297 1.419 5 50 CDBA C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H]1O 170604767 XKNRRKQPKBVCKI-QPUJVOFHSA-N 279.296 1.020 5 50 CDBA CC(=O)N[C@H](CC(=O)O)c1ccc([N+](=O)[O-])cc1 112632 IGXJPNSMMOYCOC-SNVBAGLBSA-N 252.226 1.247 5 50 CDBA CCC(=O)OCCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 437797 HORVQOMOHYPQFC-UHFFFAOYSA-N 292.247 1.144 5 50 CDBA O=[N+]([O-])c1c(N2CCCC2)ncnc1N1CCCC1 3902291 ASLQXTGHJIYHMT-UHFFFAOYSA-N 263.301 1.585 5 50 CDBA CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1Cl 4591772 YMWIAGSWTQADPZ-UHFFFAOYSA-N 286.671 1.541 5 50 CDBA NC(=O)Cc1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1 253417497 GSZGUGITOWAYCV-UHFFFAOYSA-N 272.264 1.761 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])c(C(=O)OC)cc1Cl 5248398 SOWILPWTOKVAII-UHFFFAOYSA-N 273.628 1.821 5 50 CDBA COCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1 2829495 SCCDOXARSVNDAJ-UHFFFAOYSA-N 252.270 1.290 5 50 CDBA O=C(O)[C@@H]1CS[C@@H](c2ccc([N+](=O)[O-])cc2)N1 77898 WHEHQPOUIXMETN-IUCAKERBSA-N 254.267 1.383 5 50 CDBA CN(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 317874 KSBLEPFZGOZNGQ-UHFFFAOYSA-N 262.221 1.403 5 50 CDBA COC(=O)Cc1cc(O)n(-c2ccc([N+](=O)[O-])cc2)n1 100129714 WPWBFDCVMKGIHE-UHFFFAOYSA-N 277.236 1.202 5 50 CDBA COc1cccc([N+](=O)[O-])c1NC(=O)[C@H]1CCCO1 585124877 XPXNYMJQHXRUDU-SNVBAGLBSA-N 266.253 1.721 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1NCc1cc(C(N)=O)co1 192802941 OJOFEPKJPFRQCH-UHFFFAOYSA-N 293.283 1.424 5 50 CDBA CC[C@H](CO)NC(=O)OCc1ccc([N+](=O)[O-])cc1 5666138 HWPPBNKNJGFQDB-SNVBAGLBSA-N 268.269 1.592 5 50 CDBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1 100321446 KQEVIRDFQKXDCH-VDUILEQBSA-N 284.271 1.906 5 50 CDBA O=[N+]([O-])c1ccc(CS(=O)(=O)c2ncc[nH]2)cc1 138539473 DDNOMYSIAIOPCW-UHFFFAOYSA-N 267.266 1.292 5 50 CDBA CN[C@@H](C)CNc1ncc([N+](=O)[O-])cc1Br 261575816 JWQQAHWVOITFSQ-LURJTMIESA-N 289.133 1.772 5 50 CDBA COc1c([N+](=O)[O-])c(=O)oc2ccc([N+](=O)[O-])cc12 2831225 NNPYXJPYVFOZML-UHFFFAOYSA-N 266.165 1.618 5 50 CDBA COc1ccc(S(=O)(=O)n2ccc(C)n2)cc1[N+](=O)[O-] 1775967677 HYBWHUHTFXMGJL-UHFFFAOYSA-N 297.292 1.345 5 50 CDBA CCCCONS(=O)(=O)c1cccc([N+](=O)[O-])c1 5466071 OULRMTAIEJIDCM-UHFFFAOYSA-N 274.298 1.605 5 50 CDBA Cn1cc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cn1 373004 VAOXPAMUQDAJAL-UHFFFAOYSA-N 294.698 1.912 5 50 CDBA O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1O 1507325 YIKCQUUQMXHEEU-UHFFFAOYSA-N 271.172 1.594 5 50 CDBA O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCO1 445609 VZXPHIWIOIILJY-NSHDSACASA-N 264.281 1.433 5 50 CDBA Cc1cc(N[C@@H]2C[C@H](O)[C@@H]2n2cccn2)ncc1[N+](=O)[O-] 1615003493 QAJRXWLCHCXWLA-SUZMYJTESA-N 289.295 1.281 5 50 CDBA COc1ccc(CNc2ncnc(N)c2[N+](=O)[O-])cc1 3912523 RPLIUEJEMNYZHK-UHFFFAOYSA-N 275.268 1.588 5 50 CDBA Cc1nn(C)c(NC2CCC3(CC2)OCCO3)c1[N+](=O)[O-] 169986929 RKQHKBCRDLVTJH-UHFFFAOYSA-N 296.327 1.734 5 50 CDBA CC(C)N1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 5059443 JUGCYVQAMIGXEP-SNVBAGLBSA-N 291.307 1.790 5 50 CDBA Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)N1CCCC1 197069 MDUCDUWNLXGGLC-UHFFFAOYSA-N 272.692 1.376 5 50 CDBA Cc1cc(OCC(=O)n2cccn2)ccc1[N+](=O)[O-] 4750355 ZTBUGQOZOODODI-UHFFFAOYSA-N 261.237 1.819 5 50 CDBA Cc1nc2c(c(-n3cc([N+](=O)[O-])cn3)n1)CCCC2 242273604 YEJAVKDEQDWKSR-UHFFFAOYSA-N 259.269 1.758 5 50 CDBA CN(c1ncccn1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 193310958 KFHWAEUPAHKSTI-UHFFFAOYSA-N 294.292 1.210 5 50 CDBA CC(C)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 166073074 LGIHLLRFCLQNKM-UHFFFAOYSA-N 258.299 1.769 5 50 CDBA Cc1cc(N2CCC[C@H](c3nc[nH]n3)C2)ncc1[N+](=O)[O-] 363607785 YFAUHQIZVRIPOI-JTQLQIEISA-N 288.311 1.800 5 50 CDBA CN(C)[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cn2)C12CCC2 585117972 LEPUATLFOQZHGG-GHMZBOCLSA-N 277.328 1.670 5 50 CDBA N=C1NC(=O)[C@H](Cc2cccc([N+](=O)[O-])c2)S1 5649395 SYPXWTNWDSTSJP-QMMMGPOBSA-N 251.267 1.304 5 50 CDBA COc1cccc(NC(=O)c2c([N+](=O)[O-])cnn2C)c1 193300 ACXXJAGOLQARMB-UHFFFAOYSA-N 276.252 1.589 5 50 CDBA C[C@@H](C(=O)N1CCOCC1)c1ccc([N+](=O)[O-])cc1 471955 NDELAUIXFAFOTJ-SNVBAGLBSA-N 264.281 1.557 5 50 CDBA CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N 3878381 ZBTRNFSFYVUVJS-UHFFFAOYSA-N 282.256 1.614 5 50 CDBA O=C(O)c1ccc(NC[C@@H]2CCCO2)c([N+](=O)[O-])c1 4978109 XZOJOADZBOXPHS-VIFPVBQESA-N 266.253 1.884 5 50 CDBA CCOC(=O)C(=O)CC(=O)c1ccc([N+](=O)[O-])cc1 100025755 NHCJSIZCCDVCLU-UHFFFAOYSA-N 265.221 1.300 5 50 CDBA COC(=O)c1cc(SCCO)ccc1[N+](=O)[O-] 116877758 FIMFWUMYKVBIJF-UHFFFAOYSA-N 257.267 1.466 5 50 CDBA CCCCNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 585084119 VOIUUTDGLKYANM-UHFFFAOYSA-N 273.314 1.454 5 50 CDBA CCOC(=O)Cn1c(=O)sc2cc([N+](=O)[O-])ccc21 5592182 ORAITXJSGMWCNV-UHFFFAOYSA-N 282.277 1.534 5 50 CDBA CC1=NNC(=O)[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 4820992 AQOUJFSYFNWPLO-VIFPVBQESA-N 290.279 1.435 5 50 CDBA COC(=O)C[C@@H](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1O 565189549 HKUVVFRDZKQTCH-QMMMGPOBSA-N 296.279 1.828 5 50 CDBA C[C@@H]1CCCN(c2ccc(-n3cnnn3)cc2[N+](=O)[O-])C1 5042285 JXBRTBRZDUMSAH-SNVBAGLBSA-N 288.311 1.807 5 50 CDBA CCc1ccc(OC[C@@H]2C[N+]34CCO[B-]3(OCC4)O2)cc1 195790755 BOORSZFOUGVWOZ-GTPINHCMSA-N 291.156 1.339 5 50 CDBA O=C(O)[C@@H]1CS[C@H](c2ccc([N+](=O)[O-])cc2)N1 77901 WHEHQPOUIXMETN-DTWKUNHWSA-N 254.267 1.383 5 50 CDBA O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCCC1 3878128 GWHHZJIMCOFPBI-UHFFFAOYSA-N 281.224 1.801 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](C)S(=O)(=O)CC1 170613561 TVXNMMIRYHIIEF-SNVBAGLBSA-N 299.352 1.312 5 50 CDBA NC(=O)c1[nH]c2cc([N+](=O)[O-])ccc2c1CCCC(=O)O 1775971533 SPODKJMFAPDVEI-UHFFFAOYSA-N 291.263 1.582 5 50 CDBA CC(C)c1ccc(C2OCC(CO)([N+](=O)[O-])CO2)cc1 313912 VUAUXYNDYVDJQE-UHFFFAOYSA-N 281.308 1.863 5 50 CDBA C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)CN(C)C 2824547 NHNBVPWRHORSMN-JTQLQIEISA-N 265.313 1.522 5 50 CDBA C[C@H]1[C@H]2CCCN2CCN1Cc1ccc(O)c([N+](=O)[O-])c1 22078419 FTITUJQJYXKYKM-WCQYABFASA-N 291.351 1.969 5 50 CDBA Cc1nn(C)c2c1C(c1cccc([N+](=O)[O-])c1)=NCCN2 28107521 HSAHLQYQPJCQGX-UHFFFAOYSA-N 285.307 1.900 5 50 CDBA O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCCSC1 1775984910 PATZIABCJNEATJ-ZCFIWIBFSA-N 256.287 1.400 5 50 CDBA O=C(O)Cc1cccc(Br)c1[N+](=O)[O-] 202458066 YZHIDRWIMKSVGV-UHFFFAOYSA-N 260.043 1.984 5 50 CDBA COC(=O)c1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc1 103425 UVXBSXLPWBAFPP-ZYHUDNBSSA-N 278.264 1.070 5 50 CDBA CCOC(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC 2134166 IAIRUUSVIORZQM-UHFFFAOYSA-N 296.279 1.885 5 50 CDBA Cc1cc(C(=O)NCCCn2ccnc2)ccc1[N+](=O)[O-] 2729688 ZLESHAUNJDFPKM-UHFFFAOYSA-N 288.307 1.920 5 50 CDBA CC(C)[C@H]1C(C#N)(C#N)C(C#N)=C(N)[C@@]1(C)[N+](=O)[O-] 22135328 MKNXHHJVJVVPHB-KOLCDFICSA-N 259.269 1.078 5 50 CDBA COC(=O)c1ccc(Cn2cc([N+](=O)[O-])c(C)n2)cc1 181824781 DIKXEDGGRLXZRC-UHFFFAOYSA-N 275.264 1.935 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)Oc1ccccn1 1875302111 AFVOKAKKXISDRT-UHFFFAOYSA-N 280.261 1.758 5 50 CDBA CC1=NN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(=O)C1 5296594 OTABPJFJMIHGIH-UHFFFAOYSA-N 264.197 1.616 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ncccn2)cc1 116946 CHSAAUUVOROZET-UHFFFAOYSA-N 280.265 1.186 5 50 CDBA COc1cc([C@H](CC(=O)O)C(=O)O)c([N+](=O)[O-])cc1OC 4416582 HFPBTJCGXNRHNB-ZETCQYMHSA-N 299.235 1.255 5 50 CDBA Cc1cc(N2CCCC2=O)c([N+](=O)[O-])cc1[N+](=O)[O-] 4603039 YHLYJZGPEYFLNF-UHFFFAOYSA-N 265.225 1.938 5 50 CDBA CC(C)(N)CC(=O)Nc1cc([N+](=O)[O-])ccc1O 232555022 NCIOAPXKCWHRPR-UHFFFAOYSA-N 253.258 1.366 5 50 CDBA CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 5291465 DYQUOBYQMFRMHM-UHFFFAOYSA-N 252.226 1.715 5 50 CDBA in-vitro CN1C[C@H]2CN(c3cc(N)ccc3[N+](=O)[O-])C[C@H]2C1 193536960 IEKNBCDHXFAFHD-AOOOYVTPSA-N 262.313 1.175 5 50 CDBA COc1ccccc1Oc1nc([N+](=O)[O-])nn1C 528474 FFFRLEPETMZHKD-UHFFFAOYSA-N 250.214 1.524 5 50 CDBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1S(C)(=O)=O 4045600 RMCUBOLBZPKZKY-JTQLQIEISA-N 299.352 1.065 5 50 CDBA Cc1ccc(O)c(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 4811039 JFFUXQYBIAANKB-UHFFFAOYSA-N 276.252 1.444 5 50 CDBA CN(C)/C=C/S(=O)(=O)c1ccc([N+](=O)[O-])cc1 22781326 PFAPDNPPULYCRZ-BQYQJAHWSA-N 256.283 1.401 5 50 CDBA O=C(NC1[C@H]2CCC[C@H]1CN(C1CC1)C2)[C@H]1C[C@@H]1[N+](=O)[O-] 252514052 AZKOFPSZWVRPFJ-UKJIMTQDSA-N 293.367 1.031 5 50 CDBA O=C1O[C@H](Cn2nccc2[N+](=O)[O-])CN1c1ccccc1 163653686 UASYPDZHDQKMCT-NSHDSACASA-N 288.263 1.817 5 50 CDBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCO1 452652 QSRBFRAQLAMYPZ-OQHXTRMZSA-N 276.292 1.903 5 50 CDBA NC(=O)[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 55292076 QHVKVJIMPMTVOI-NSHDSACASA-N 263.297 1.292 5 50 CDBA CSc1ccc(C(=O)N2C[C@@H](O)C[C@@H]2C)cc1[N+](=O)[O-] 170089369 BNPXOOAGPKGZSI-WPRPVWTQSA-N 296.348 1.912 5 50 CDBA COC(=O)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1 3612916 CTTJNXYJPRENFI-LBPRGKRZSA-N 292.291 1.763 5 50 CDBA O=c1c([N+](=O)[O-])cccn1Cc1cnn(-c2ccccc2)c1 225533570 MMFXABDBWBQNMV-UHFFFAOYSA-N 296.286 1.991 5 50 CDBA O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccccc1[N+](=O)[O-] 100216048 PBVHTBPFNZTURL-WTTBSCSTSA-N 284.271 1.906 5 50 CDBA O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCOCC1 106103503 XXEHJHIJRXBOAI-UHFFFAOYSA-N 254.217 1.206 5 50 CDBA C[C@@H]1CCOCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 119727012 ULJTUDBKOKGTEZ-SECBINFHSA-N 280.280 1.551 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cn1 1423491 FXFOCNKRCUFZSQ-UHFFFAOYSA-N 281.659 1.478 5 50 CDBA CC(=O)c1ccc(NC[C@H]2COCO2)c([N+](=O)[O-])c1 521395250 IRHCNKYAFMHANO-JTQLQIEISA-N 266.253 1.582 5 50 CDBA CN(C)CCNCCOc1cccc([N+](=O)[O-])c1 5049470 OIIPCYRFKSQRSI-UHFFFAOYSA-N 253.302 1.125 5 50 CDBA COc1cc(CN=c2ccc([N+](=O)[O-])c(C)[nH]2)on1 583651917 VZBFOHYZBCSYJJ-UHFFFAOYSA-N 264.241 1.329 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccco2)cc1 229688 ZVUFLKFUSZRKAU-UHFFFAOYSA-N 282.277 1.666 5 50 CDBA CCOc1c(OC(C)=O)ccc(C=O)c1[N+](=O)[O-] 465963 XJLWDOMUATYANB-UHFFFAOYSA-N 253.210 1.731 5 50 CDBA C[C@H]1C[C@@H]1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 585079409 KBCPPFFEVMKFFM-KWQFWETISA-N 263.249 1.977 5 50 CDBA Cc1c(NC(=O)N[C@H]2CCOC2=O)cccc1[N+](=O)[O-] 585119968 CXZWNPXMMSNQCX-VIFPVBQESA-N 279.252 1.340 5 50 CDBA CCOC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4881781 DRMNLUNMWNYMQU-UHFFFAOYSA-N 279.296 1.873 5 50 CDBA in-vitro COc1cccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1 122554 KFYLNOYLFXNMLQ-ZYHUDNBSSA-N 250.254 1.292 5 50 CDBA CC1=NN(c2ccccc2)C(=O)[C@@H]1[C@@H](C)C[N+](=O)[O-] 100373883 MLRDEESSCJSTAE-JOYOIKCWSA-N 261.281 1.938 5 50 CDBA Cc1ccnc(N2CCCN(C)CCC2)c1[N+](=O)[O-] 1776006524 XCFXLOGPYRXQSA-UHFFFAOYSA-N 264.329 1.830 5 50 CDBA O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1cccnc1 5090802 CTOUCHAACPYFCW-UHFFFAOYSA-N 286.291 1.832 5 50 CDBA O=[N+]([O-])c1cc(Br)cnc1N1CCOCC1 19913947 WWQJIRVJWYMVDK-UHFFFAOYSA-N 288.101 1.589 5 50 CDBA CCOC(=O)C(C(=O)OCC)c1ccc([N+](=O)[O-])cc1 31776979 VTWDYQVTRGDDEE-UHFFFAOYSA-N 281.264 1.805 5 50 CDBA CC(C)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1F 81567990 DOAWDYMLEWIUMO-UHFFFAOYSA-N 262.262 1.421 5 50 CDBA Cn1ncnc1CCCNc1ncccc1[N+](=O)[O-] 585092278 MTLVMHIVBLPQRV-UHFFFAOYSA-N 262.273 1.163 5 50 CDBA C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 12417959 FJYZQTKHFHDBEO-AOOOYVTPSA-N 264.281 1.844 5 50 CDBA O=C(Nc1cccc([N+](=O)[O-])c1)N1CCOCC1 2164513 QRSMQQFYGBYQMQ-UHFFFAOYSA-N 251.242 1.459 5 50 CDBA N[C@H]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 125145461 OBCRDRKAYPZJNR-VHSXEESVSA-N 299.352 1.143 5 50 CDBA O=[N+]([O-])c1ccc2c(c1)OCCOCCOCCO2 74721 UUQRTEFANVWPTD-UHFFFAOYSA-N 269.253 1.399 5 50 CDBA Cn1cnc([N+](=O)[O-])c1Sc1ncnc2nc[nH]c12 4258316 LMEKQMALGUDUQG-UHFFFAOYSA-N 277.269 1.146 5 50 CDBA fda CCN1C(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)NC1=S 4845929 BDWCOXVKNJGBQY-YVMONPNESA-N 293.304 1.378 5 50 CDBA C[C@H]1COCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164177684 OTOVZGUSDNKXGG-QMMMGPOBSA-N 266.253 1.161 5 50 CDBA O=[N+]([O-])c1ccc(/C=C/N2CCOCC2)c([N+](=O)[O-])c1 19286878 XSZWGVFIDMJNIH-ONEGZZNKSA-N 279.252 1.806 5 50 CDBA CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1 4091611 NIFARQYLHAFETC-UHFFFAOYSA-N 253.283 1.818 5 50 CDBA CCN1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 55082792 UACONXXWPQMFNU-VMPITWQZSA-N 289.335 1.772 5 50 CDBA CCOC(=O)CNC(=O)n1ncc2ccc([N+](=O)[O-])cc21 25667098 YXPDXDFSPGZJSL-UHFFFAOYSA-N 292.251 1.065 5 50 CDBA C[C@@]1(CO)CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 123524742 SOQOKPJREONSQL-CQSZACIVSA-N 294.307 1.535 5 50 CDBA O=C(O)[C@H]1CCCN1C(=O)Nc1ccccc1[N+](=O)[O-] 40546067 SGIVVTVUZFXDFU-SNVBAGLBSA-N 279.252 1.676 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@@H](C)c2cn[nH]c2)c1[N+](=O)[O-] 270556919 ZWSXTSVEIUSAKN-ZETCQYMHSA-N 292.299 1.485 5 50 CDBA NC(=O)c1cc(Br)c(N)c([N+](=O)[O-])c1 82046475 LWMPRBCMKLSQEP-UHFFFAOYSA-N 260.047 1.038 5 50 CDBA in-vitro C[C@@H]1[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCN1C 408085694 BZRBKCMUQPQJSH-NXEZZACHSA-N 293.323 1.465 5 50 CDBA O=[N+]([O-])c1cccnc1N1CC[C@H](c2ncc[nH]2)C1 585092659 IPNVVVDGAUVNRH-VIFPVBQESA-N 259.269 1.707 5 50 CDBA O=C(O)c1ccc(I)c([N+](=O)[O-])c1 2566454 DNMTZLCNLAIKQC-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro O=C(c1cccc([N+](=O)[O-])c1O)N1CCC(CO)CC1 128319882 PWNIIEGHYGLEFX-UHFFFAOYSA-N 280.280 1.145 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2cc3c(cc2Cl)OCO3)N1 89571 ISQNUCJEUYXRGA-QPUJVOFHSA-N 298.682 1.665 5 50 CDBA CC(=O)N1CCCO[C@H]1c1ccc([N+](=O)[O-])cc1 182915 RXPMFRZXNBTWRQ-LBPRGKRZSA-N 250.254 1.862 5 50 CDBA O=C(N[C@H]1CCSC1=O)c1cccc([N+](=O)[O-])c1 183074 JQEJGQSAHUEQOF-VIFPVBQESA-N 266.278 1.357 5 50 CDBA CCC(=O)N[C@@H](Cc1ccc(OC)c([N+](=O)[O-])c1)C(=O)O 311953 ZQJITFNZEBENHG-VIFPVBQESA-N 296.279 1.125 5 50 CDBA O=[N+]([O-])c1ncc(N2C[C@@H]3C[C@H]2CN3C2CCC2)cc1O 1776006252 SVCMPNQQJWPRNS-RYUDHWBXSA-N 290.323 1.511 5 50 CDBA NC(=O)c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 85471903 TZLVPZHDZLCXKW-UHFFFAOYSA-N 250.132 1.592 5 50 CDBA in-vitro Cc1cc([N+](=O)[O-])nn1CC(=O)N(C)Cc1ccccc1 33099 NADGYDWFJBFVIO-UHFFFAOYSA-N 288.307 1.758 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCC[C@@H](CO)C2)cc1 4948016 JZEBGNLIZMRNAU-GFCCVEGCSA-N 250.298 1.799 5 50 CDBA O=[N+]([O-])c1ccc(N[C@H](CO)[C@@H]2CCCO2)cc1 253428409 QAIPMTZFOJDKBW-NEPJUHHUSA-N 252.270 1.547 5 50 CDBA N=C1NC(=O)[C@@H](Cc2cccc([N+](=O)[O-])c2)S1 5649393 SYPXWTNWDSTSJP-MRVPVSSYSA-N 251.267 1.304 5 50 CDBA Cn1c(/C=C/c2cccs2)c([N+](=O)[O-])c(=O)n(C)c1=O 30702604 QUGSBXRCIFAORV-AATRIKPKSA-N 293.304 1.224 5 50 CDBA N[C@@H]1CC[C@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@H]12 239807476 CSGQQIVXQBZHIZ-KPXOXKRLSA-N 293.298 1.543 5 50 CDBA CN1CC[C@@H](Nc2ncccc2[N+](=O)[O-])CC1=O 170606509 DFSSBBWPANQMFZ-MRVPVSSYSA-N 250.258 1.023 5 50 CDBA O=C(Nc1cccc([N+](=O)[O-])c1)N1CCS(=O)CC1 170889298 LWELRLHKGMKZPN-UHFFFAOYSA-N 283.309 1.191 5 50 CDBA Nc1cc(NC[C@H]2CCCCO2)ncc1[N+](=O)[O-] 952991731 DQINHWCOMPDVGQ-MRVPVSSYSA-N 252.274 1.553 5 50 CDBA O=[N+]([O-])c1ccc(NCCOCCO)c(Cl)c1 4548171 WNZRBESJSGVXTK-UHFFFAOYSA-N 260.677 1.669 5 50 CDBA CON(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 42160718 PTXGFDJXGPOTHZ-UHFFFAOYSA-N 255.186 1.136 5 50 CDBA Cc1ccnc(NC[C@@H](O)c2cnc[nH]2)c1[N+](=O)[O-] 952883486 TZUFKHQTMYPFHJ-SECBINFHSA-N 263.257 1.167 5 50 CDBA O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCC(OC2CCCCC2)CC1 170603132 KVFFXOATKBIEIB-KGLIPLIRSA-N 296.367 1.992 5 50 CDBA Cn1cnnc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 157207843 WCSXTJMRQNSGFO-UHFFFAOYSA-N 281.659 1.629 5 50 CDBA O=C(Nc1ccccc1CC[N+](=O)[O-])N1CCOCC1 1403008 KYHOYFKXNFVCGP-UHFFFAOYSA-N 279.296 1.370 5 50 CDBA Cc1cc([N+](=O)[O-])c(NCCCO)c([N+](=O)[O-])c1 3877755 ZBRNROWRJLCZBB-UHFFFAOYSA-N 255.230 1.606 5 50 CDBA COc1ccc(NC(=O)CN2CCCC2)c([N+](=O)[O-])c1 4832215 VFQHIHJNVBGYTO-UHFFFAOYSA-N 279.296 1.638 5 50 CDBA CC(C)(O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1 139712993 OYHFEAFLLHMLAB-LBPRGKRZSA-N 294.307 1.676 5 50 CDBA CC(C)[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C(=O)O 236682133 ADCZNVJAWBKNMZ-ZDUSSCGKSA-N 294.307 1.753 5 50 CDBA COC(=O)C(C)(C)CNC(=O)Nc1ccncc1[N+](=O)[O-] 272775087 YFKDRWXQVYSOPN-UHFFFAOYSA-N 296.283 1.311 5 50 CDBA CC(C)N(C)CCNc1cc(N)ccc1[N+](=O)[O-] 193405436 ZRJITHGFKPMVNR-UHFFFAOYSA-N 252.318 1.929 5 50 CDBA O=[N+]([O-])c1ccc(CCSc2nnc(O)[nH]2)cc1 194640860 YEYXBZJOVYQOCA-UHFFFAOYSA-N 266.282 1.753 5 50 CDBA COC[C@@H](C)NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 457222 RHWATJCADZAJKY-MRVPVSSYSA-N 298.295 1.377 5 50 CDBA CC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1C 5028088 NBYLMUDDUIZFDW-UHFFFAOYSA-N 253.283 1.736 5 50 CDBA Nc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)n[nH]1 13153022 KHLPHPDUEQSEKG-UHFFFAOYSA-N 294.296 1.026 5 50 CDBA C[C@@](CN)(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CC1 133755299 OGLIBIKTAPZFKH-LBPRGKRZSA-N 299.352 1.001 5 50 CDBA Cc1ccnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 2865402 GDPNLPBBDUFJTI-UHFFFAOYSA-N 294.292 1.494 5 50 CDBA Cc1c(CNC(=O)NC[C@@H](C)O)cccc1[N+](=O)[O-] 225498732 GDTLTELFIUTNGD-MRVPVSSYSA-N 267.285 1.083 5 50 CDBA Cn1cncc1[C@H](CO)Nc1ccc(F)cc1[N+](=O)[O-] 952963371 HZBFDUWQXFQDOM-JTQLQIEISA-N 280.259 1.613 5 50 CDBA CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 14899021 PHMJUGWMCIGHJZ-UHFFFAOYSA-N 266.300 1.901 5 50 CDBA CNC(=O)COc1cc([N+](=O)[O-])ccc1Br 225533012 TYHLWYOWKMIUGH-UHFFFAOYSA-N 289.085 1.482 5 50 CDBA Cc1ccc(NC(=O)CCn2nc([N+](=O)[O-])cc2C)nc1 374406 PNYNYFDIGKZNEO-UHFFFAOYSA-N 289.295 1.832 5 50 CDBA Cc1ccc(C(=O)NCCCn2ccnc2)cc1[N+](=O)[O-] 1794259 GVZYMFAHTPLKOQ-UHFFFAOYSA-N 288.307 1.920 5 50 CDBA O=[N+]([O-])c1ccc(N[C@@H](CO)[C@H]2CCCO2)cc1 253428412 QAIPMTZFOJDKBW-NWDGAFQWSA-N 252.270 1.547 5 50 CDBA Cc1cc(Cn2c(C)c([N+](=O)[O-])ccc2=O)sn1 1189457289 ILCWGFUEMOHZJU-UHFFFAOYSA-N 265.294 1.878 5 50 CDBA C=CC(=O)NC(NC(=O)C=C)c1cccc([N+](=O)[O-])c1 2952049 JNHDBJCXXGQODI-UHFFFAOYSA-N 275.264 1.198 5 50 CDBA CCOC(=O)c1nc(Cl)nc(Cl)c1[N+](=O)[O-] 1529120 CXMOEGSGXAUCNZ-UHFFFAOYSA-N 266.040 1.868 5 50 CDBA in-vitro CC[C@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)N(C)C 166119588 MFYRACICXFLIGT-SECBINFHSA-N 267.285 1.579 5 50 CDBA C[C@@H]1C[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188562241 WKGXAILQYCTNTJ-RNCFNFMXSA-N 276.292 1.840 5 50 CDBA COC(=O)C(C(=O)OC)c1c(Cl)cccc1[N+](=O)[O-] 1393664 IPIPPPPYURNJHW-UHFFFAOYSA-N 287.655 1.678 5 50 CDBA C[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C1CCOCC1 119225029 UJBQCBNNZYBYRB-VIFPVBQESA-N 294.307 1.845 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1O)[C@H]1CCOC1 163418484 QXNSLZVGVIYFJT-QMMMGPOBSA-N 266.253 1.161 5 50 CDBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 38988 HWYYUVZSWZFHEI-UWVGGRQHSA-N 264.281 1.844 5 50 CDBA Cc1c(C(=O)N2CCC(C(N)=O)CC2)cccc1[N+](=O)[O-] 308512 STMWPZJGNHPBNG-UHFFFAOYSA-N 291.307 1.241 5 50 CDBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1CCCO1 464393 POJZUVGLJGSOGO-GUOLPTJISA-N 276.292 1.903 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)C[S@](C)=O 162478616 ZKTNFKCDIVVVTL-GWNMQOMSSA-N 299.352 1.792 5 50 CDBA NC(=O)c1cc(OC(F)(F)F)ccc1[N+](=O)[O-] 85477152 ITKYUXUOGDHERZ-UHFFFAOYSA-N 250.132 1.592 5 50 CDBA in-vitro O=C(O)/C=C/C(=O)Nc1cc([N+](=O)[O-])ccc1F 116525 KAXIYRLTZKRFFW-ONEGZZNKSA-N 254.173 1.313 5 50 CDBA CCC(CC)NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 4461765 FNBZANSTWMJZTO-UHFFFAOYSA-N 297.336 1.822 5 50 CDBA O=C(N[C@H]1C[C@H]2CC[C@H]1O2)c1cccc([N+](=O)[O-])c1O 191443620 WGNWKKRELBTZQX-POZPLHJXSA-N 278.264 1.350 5 50 CDBA C[C@@H](CNc1ccc([N+](=O)[O-])cc1)Oc1nonc1N 5127872 CMSQCHMXAXQVDB-ZETCQYMHSA-N 279.256 1.439 5 50 CDBA O=[N+]([O-])c1ccccc1OCCSc1cnn[nH]1 177375343 JYRYGNXCEOXCOR-UHFFFAOYSA-N 266.282 1.884 5 50 CDBA CN1C(=S)C(=N)O[C@@H]1c1cccc([N+](=O)[O-])c1 3086229 PRSARNBEOCUELF-SECBINFHSA-N 251.267 1.860 5 50 CDBA CCOCCC1=Nc2cccc([N+](=O)[O-])c2S(=O)(=O)N1 585138788 YEANYDUIIGMHIH-UHFFFAOYSA-N 299.308 1.343 5 50 CDBA CCCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 4071517 OZIMAACTQKBWTF-UHFFFAOYSA-N 258.299 1.673 5 50 CDBA O=C(O)/C=C/c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 129755709 CHDQNHDDYMTOIK-AATRIKPKSA-N 261.193 1.743 5 50 CDBA O=C(O)c1cc(I)ccc1[N+](=O)[O-] 34143793 RYOSQAPCAPOLCV-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro CN1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 19403709 PCDMCSXQXLEQPN-UHFFFAOYSA-N 283.715 1.636 5 50 CDBA Cc1cc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)no1 313083 GJJNPIXKHBUSRF-UHFFFAOYSA-N 273.204 1.692 5 50 CDBA CN1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 4977514 OGBQLAQHHHGIDA-UHFFFAOYSA-N 269.732 1.996 5 50 CDBA COc1ccccc1NC(=O)Cn1nc([N+](=O)[O-])cc1C 1428822 ONZJUASZWPVNFX-UHFFFAOYSA-N 290.279 1.747 5 50 CDBA CNc1nccc(C(=O)NC[C@H](C)C[C@@H](C)O)c1[N+](=O)[O-] 253417940 XSACCPYUQDSDFQ-RKDXNWHRSA-N 296.327 1.168 5 50 CDBA C[C@@H](CN(C)c1ncc(Cl)cc1[N+](=O)[O-])c1nnn[nH]1 129829327 FVQYEGNTOQQZDY-LURJTMIESA-N 297.706 1.396 5 50 CDBA COc1nscc1Cn1c(C)c([N+](=O)[O-])ccc1=O 952880852 DPEJSDWOYFODKO-UHFFFAOYSA-N 281.293 1.578 5 50 CDBA COc1cc(CN2CCCC2)cc([N+](=O)[O-])c1O 16662868 FKLLSGFLZZDZHQ-UHFFFAOYSA-N 252.270 1.905 5 50 CDBA C[C@]1(O)CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 153832873 UMXDHNHXCGCUHR-ZDUSSCGKSA-N 280.280 1.287 5 50 CDBA COC(=O)[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C[C@@H]1C 276973483 UBSJOUWYXDDDBU-ONGXEEELSA-N 279.296 1.625 5 50 CDBA Cc1ccc(OCCN2CCOCC2)c([N+](=O)[O-])c1 20118485 JPHFEZWRIOJKCT-UHFFFAOYSA-N 266.297 1.614 5 50 CDBA CCOC(=O)c1cc(NCCOC)c(F)cc1[N+](=O)[O-] 725261759 FTPYVYSWCCWWBZ-UHFFFAOYSA-N 286.259 1.969 5 50 CDBA C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 13898965 JYORBNUHGKBRNJ-PHIMTYICSA-N 278.308 1.773 5 50 CDBA CNc1cc(N2CCN(C)CC2)ccc1[N+](=O)[O-] 4688289 DQJZRATWFYQSGH-UHFFFAOYSA-N 250.302 1.388 5 50 CDBA COc1ccccc1/C=C/c1nc(O)[nH]c(=O)c1[N+](=O)[O-] 4612828 OGOZMUXGFMWISN-VOTSOKGWSA-N 289.247 1.563 5 50 CDBA Cc1cnc(OCCOCC(F)F)c([N+](=O)[O-])c1 252499667 SDTPDVARFRLALD-UHFFFAOYSA-N 262.212 1.959 5 50 CDBA O=c1[nH]c(Cn2cnc([N+](=O)[O-])c2)cc2ccccc12 154364518 FYEPFRMJRUQQKG-UHFFFAOYSA-N 270.248 1.681 5 50 CDBA O=[N+]([O-])c1cc(Br)cnc1NCCO 38537006 MPSIEXNQZJDIOU-UHFFFAOYSA-N 262.063 1.157 5 50 CDBA in-vitro NC(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 2996364 NMQJTLVYHLEQOM-UHFFFAOYSA-N 264.159 1.478 5 50 CDBA CC[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@@H]1CCCO1 119371615 HYCGMXIDGBSXIK-GWCFXTLKSA-N 294.307 1.988 5 50 CDBA COC(=O)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1 3612913 CTTJNXYJPRENFI-GFCCVEGCSA-N 292.291 1.763 5 50 CDBA COc1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c(OC)c1 89598 BGHATRKYYKUFPI-GXFFZTMASA-N 280.280 1.300 5 50 CDBA CCOC(=O)[C@H](F)[C@@H]1CCN(c2ncccc2[N+](=O)[O-])C1 585092262 MCMPYQHBCYCRLG-MWLCHTKSSA-N 297.286 1.717 5 50 CDBA COCCCNC(=O)c1cccc([N+](=O)[O-])c1C 2871071 YZTSGJOJDHLQMF-UHFFFAOYSA-N 252.270 1.670 5 50 CDBA COC[C@@H](C)NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 455592 VRNCNFCVIZBIDN-MRVPVSSYSA-N 296.279 1.146 5 50 CDBA Cc1cc(C(=O)N2CCC(C(N)=O)CC2)ccc1[N+](=O)[O-] 858468 ZVTUUEAVPYWIFB-UHFFFAOYSA-N 291.307 1.241 5 50 CDBA CCOC(=O)Nc1cc([N+](=O)[O-])ccc1C(=O)O 2173000 QMOOAMHDJPCNKC-UHFFFAOYSA-N 254.198 1.861 5 50 CDBA O=c1[nH]nc(C2CCN(c3ccccc3[N+](=O)[O-])CC2)o1 225813367 GNYQNWJLRIGZKY-UHFFFAOYSA-N 290.279 1.655 5 50 CDBA Cc1c([N+](=O)[O-])c(C(=O)N2CCCCCC2)nn1C 371939 YFFVFFCOVUVIOJ-UHFFFAOYSA-N 266.301 1.653 5 50 CDBA C[C@@H]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CN 164004311 UEGPFLPIEUAKBR-ZJUUUORDSA-N 289.339 1.892 5 50 CDBA Cc1ccc(S(=O)(=O)N2CCCC2)c([N+](=O)[O-])c1 614052 WUAUIQFDJYFWQU-UHFFFAOYSA-N 270.310 1.688 5 50 CDBA Cc1nc(N2CC[C@H]3CCN(C)C[C@H]32)ccc1[N+](=O)[O-] 272258578 ZPZYGOKGKHWGQD-DGCLKSJQSA-N 276.340 1.829 5 50 CDBA C[N+](C)(C)CCOC(=O)[C@@H]1OCCc2ccccc21 490960 GKJYAGYYOTXPNJ-CQSZACIVSA-N 264.345 1.550 5 50 CDBA biogenic NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 2690541 QCRJWNHXJZSHLX-UHFFFAOYSA-N 269.307 1.782 5 50 CDBA Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1[N+](=O)[O-] 253011 QTHQJTJJXKENIK-NSHDSACASA-N 264.281 1.812 5 50 CDBA O=c1c2ccccc2nnn1Cc1cccc([N+](=O)[O-])c1 1057034 WQYPRKIZMQSUNY-UHFFFAOYSA-N 282.259 1.748 5 50 CDBA O=C(O)[C@@H]1C[C@@H](O)CN1Sc1ccccc1[N+](=O)[O-] 43505243 DVIHNYNLBLNACY-APPZFPTMSA-N 284.293 1.122 5 50 CDBA COc1ccc(C(=O)NC[C@H](C)CN(C)C)cc1[N+](=O)[O-] 5077393 BSILJAXGVZKKSJ-JTQLQIEISA-N 295.339 1.531 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1nccs1 1070968 OLDSKNMUHIIRSR-UHFFFAOYSA-N 267.270 1.195 5 50 CDBA CC[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 3877614 MPWLEWUMPDWNFL-SSDOTTSWSA-N 269.213 1.778 5 50 CDBA CC(=O)Nc1ccc([N+](=O)[O-])cc1-c1noc(C)n1 219037196 KUQNBSGLENWDIM-UHFFFAOYSA-N 262.225 1.912 5 50 CDBA O=C(Nc1cnns1)c1cccc([N+](=O)[O-])c1 170603820 NPIAFWWAEJQSAU-UHFFFAOYSA-N 250.239 1.699 5 50 CDBA O=C(NCCCn1ccnc1)c1ccccc1[N+](=O)[O-] 2742002 GXMMZQQPIRTVFC-UHFFFAOYSA-N 274.280 1.611 5 50 CDBA COCCNCCOCCOc1ccc(C)cc1[N+](=O)[O-] 3003408 QMLVADPNQGUFHX-UHFFFAOYSA-N 298.339 1.535 5 50 CDBA C[C@@H](O[N+](=O)[O-])c1cc2c(cc1[N+](=O)[O-])OCCO2 4575226 PZPPQDGJMFOFCQ-ZCFIWIBFSA-N 270.197 1.635 5 50 CDBA O=C(NC1[C@H]2CCC[C@H]1CN(C1CC1)C2)[C@@H]1C[C@@H]1[N+](=O)[O-] 170591908 AZKOFPSZWVRPFJ-DJIHRAIXSA-N 293.367 1.031 5 50 CDBA Cc1c(NC(=O)N2CCC23COC3)cccc1[N+](=O)[O-] 585119318 BWCUUMDIAOSUSW-UHFFFAOYSA-N 277.280 1.910 5 50 CDBA O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]2C1 585124054 SZISOHKFNBJURH-UWVGGRQHSA-N 261.281 1.485 5 50 CDBA O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 169685306 VYHCUDLEIGISHF-KKOKHZNYSA-N 286.243 1.038 5 50 CDBA CC(C)N(c1ccc([N+](=O)[O-])cc1)S(C)(=O)=O 204931286 DCFLGKZLWJYWAQ-UHFFFAOYSA-N 258.299 1.769 5 50 CDBA O=C(NCc1cccnc1)c1ccc([N+](=O)[O-])cc1 38983 SOWWQELCDCDJDH-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA Cc1cc(C(=O)NC[C@@H]2CCCO2)ccc1[N+](=O)[O-] 64149 WKQWVSOBXWPMSP-NSHDSACASA-N 264.281 1.812 5 50 CDBA O=[N+]([O-])c1cc2c(cc1I)OCO2 78210 IHRDPDCTXSIYFC-UHFFFAOYSA-N 293.016 1.928 5 50 CDBA NC1(C(=O)Nc2cc([N+](=O)[O-])ccc2O)CCCCC1 236193738 MTKHUGSRRWYQBK-UHFFFAOYSA-N 279.296 1.901 5 50 CDBA COCC(=O)Oc1ccc(/C=C/[N+](=O)[O-])cc1OC 149511 DXTLEIJFXDPGLC-AATRIKPKSA-N 267.237 1.494 5 50 CDBA Cc1cc(OCCCNCCN(C)C)ccc1[N+](=O)[O-] 5049340 YEEUVCWBBXWMGL-UHFFFAOYSA-N 281.356 1.823 5 50 CDBA Cc1cc(C(=O)N2C[C@@H](C)[C@H](C(=O)O)C2)ccc1[N+](=O)[O-] 111251371 ZNYDGPHAAXQLCK-MWLCHTKSSA-N 292.291 1.696 5 50 CDBA CC(=O)c1ccc(NCCC(=O)O)c([N+](=O)[O-])c1 64037959 FONZPRUZDXLJFF-UHFFFAOYSA-N 252.226 1.684 5 50 CDBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2ccccc2Cl)N1 90854 TYGMJKKENBLZGE-ONGXEEELSA-N 254.673 1.936 5 50 CDBA COC[C@H](C)NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 457221 RHWATJCADZAJKY-QMMMGPOBSA-N 298.295 1.377 5 50 CDBA O=[N+]([O-])c1cc(F)cnc1N[C@@H]1C=C[C@H](CO)C1 585093043 ZKZUQTKOBOCCHO-IONNQARKSA-N 253.233 1.478 5 50 CDBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC1 2837811 KDWMZRYZJBDYRC-UHFFFAOYSA-N 277.280 1.546 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCCNC[C@H](C)O)c1 2881346 PKRFDBXKSFOLDB-NSHDSACASA-N 268.313 1.643 5 50 CDBA Cn1cc([C@@](C)(O)CNc2cc(F)ccc2[N+](=O)[O-])cn1 242001059 VCODUNIAQBWTGI-ZDUSSCGKSA-N 294.286 1.787 5 50 CDBA COC1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 408520987 DPXVGXABJORSQU-UHFFFAOYSA-N 255.249 1.744 5 50 CDBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cnccn1 442163 SALHUWGTJLVYBH-UHFFFAOYSA-N 262.200 1.776 5 50 CDBA COc1cc(CN2CCC[C@@H](CO)C2)cc([N+](=O)[O-])c1O 3110196 QJMOLLTYJFTKJN-SNVBAGLBSA-N 296.323 1.513 5 50 CDBA O=C(Cn1ccnc1[N+](=O)[O-])N1CCC[C@@H]2CCCC[C@@H]21 585133051 PJAJELDKOCFWJO-RYUDHWBXSA-N 292.339 1.973 5 50 CDBA CN1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 163298522 IVMHAERORZGDCB-UHFFFAOYSA-N 269.732 1.996 5 50 CDBA O=[N+]([O-])c1cccc([C@H](O)CNCc2cccnc2O)c1 2325869037 WWPQVEIBFCAJSU-CYBMUJFWSA-N 289.291 1.519 5 50 CDBA O=C(O)CCn1c(=O)c2ccccc2c2ccccc2c1=O 319680 CJHKHMLTUPIPBR-UHFFFAOYSA-N 295.294 1.990 5 50 CDBA C[C@@H]1CN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C 292852716 ABLMCCLXRADBSI-GHMZBOCLSA-N 298.364 1.709 5 50 CDBA CO[C@@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 170005760 KFNLKQYTYAGWNH-GXFFZTMASA-N 294.307 1.988 5 50 CDBA O=C(c1ccc(Cn2cc([N+](=O)[O-])cn2)o1)n1cccn1 375963 TVYPBGVBGJNMCN-UHFFFAOYSA-N 287.235 1.318 5 50 CDBA COC(=O)CN(C(=O)c1cccc([N+](=O)[O-])c1O)C1CC1 280171978 VFFJCTOQCMPRMP-UHFFFAOYSA-N 294.263 1.078 5 50 CDBA C[C@H](CNc1ccc([N+](=O)[O-])cc1)Oc1nonc1N 5127875 CMSQCHMXAXQVDB-SSDOTTSWSA-N 279.256 1.439 5 50 CDBA O=C1CCC[C@@H]2[C@H]3CCC[N@@+]4([O-])CCC[C@H](CN12)[C@@H]34 255281945 XVPBINOPNYFXID-OZOFRIEWSA-N 264.369 1.884 5 50 CDBA COC(=O)CCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 125253 RFLRSMOOFUXJFQ-UHFFFAOYSA-N 266.253 1.795 5 50 CDBA O=C(O)CCCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 241013 IXBWSNDGYRTQSF-UHFFFAOYSA-N 278.220 1.056 5 50 CDBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCOCC1 4156173 NBIPSUSFQGFVLH-UHFFFAOYSA-N 251.242 1.459 5 50 CDBA CN(C(=O)c1ccc([N+](=O)[O-])cc1O)c1cnn(C)c1 170599118 KMMMRMYLIWGFCN-UHFFFAOYSA-N 276.252 1.311 5 50 CDBA C[C@@]1(O)CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 170610598 MSJAVJHSBXVZDP-GFCCVEGCSA-N 284.699 1.845 5 50 CDBA Cc1nn(CC[C@H]2CCNC2=O)c2ccc([N+](=O)[O-])cc12 574823314 KXELQGXMOCTYPX-SNVBAGLBSA-N 288.307 1.779 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N1CC[C@H]([C@@H]2CCOC2)C1 408426508 UMRJEIOLAUHUNK-VHSXEESVSA-N 266.301 1.191 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])c(NC(C)=O)cc1OC 5019092 AGSSDWHUSPSVFS-UHFFFAOYSA-N 268.225 1.348 5 50 CDBA Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(O)c1[N+](=O)[O-] 4344453 SRTKLDVWSCXBDM-UHFFFAOYSA-N 264.197 1.703 5 50 CDBA COCCO[C@@H]1CCN(c2cc(F)ccc2[N+](=O)[O-])C1 225725170 LGPOAJGTIYTILO-LLVKDONJSA-N 284.287 1.976 5 50 CDBA CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(F)(F)F 348092999 NHJIOKVDUZZRMS-VIFPVBQESA-N 294.233 1.494 5 50 CDBA CN=[S@](C)(=O)CCNc1nccc(C)c1[N+](=O)[O-] 952874855 WSTPDIYWRNSQKJ-GOSISDBHSA-N 272.330 1.438 5 50 CDBA CCOC(=O)C(=O)Nc1c(C)cccc1[N+](=O)[O-] 32918909 IGTAQWQSTWWBIN-UHFFFAOYSA-N 252.226 1.405 5 50 CDBA CNC(=O)N[C@@H]1CCCN(c2nccc(C)c2[N+](=O)[O-])C1 952994285 OIBDOPRMRKGXFD-SNVBAGLBSA-N 293.327 1.196 5 50 CDBA O=C(O)[C@H](NCc1cccc([N+](=O)[O-])c1)c1cscn1 1875339484 LROXXRSTYJEHDW-LLVKDONJSA-N 293.304 1.967 5 50 CDBA O=C(NCc1ccccn1)c1ccccc1[N+](=O)[O-] 252976 RABNSWVIYXUULG-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA O=[N+]([O-])C[C@@H](c1c[nH]c2ccccc12)S(=O)(=O)O 1869014 GNDZQZFYCOCREF-JTQLQIEISA-N 270.266 1.374 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cccnc1 2742776 SXYPIRRJAYPWJM-UHFFFAOYSA-N 279.277 1.791 5 50 CDBA COc1cc(/C=C2\SC(=O)NC2=O)cc([N+](=O)[O-])c1O 39780179 NUKUFIYNEFXNIP-YWEYNIOJSA-N 296.260 1.633 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O 521398446 HIJSRYWCRVMPAM-UHTWSYAYSA-N 293.323 1.356 5 50 CDBA CN(C)[C@H]1COC(=O)O[C@H]1c1ccc([N+](=O)[O-])cc1 217041344 JVHRFDUBKQWSDL-QWRGUYRKSA-N 266.253 1.733 5 50 CDBA Nc1c(I)cc(F)cc1[N+](=O)[O-] 148566651 SPBHPTFZEAUROH-UHFFFAOYSA-N 282.012 1.921 5 50 CDBA COc1cccc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)c1 4753335 UOUGLABNRPZKNV-UHFFFAOYSA-N 290.279 1.116 5 50 CDBA C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 614274 MYGGJOBCAZKDDS-GHMZBOCLSA-N 294.307 1.609 5 50 CDBA NC(=O)C1CCN(c2ccc([N+](=O)[O-])c(Cl)n2)CC1 220972370 CFXGTGNKQUSJJS-UHFFFAOYSA-N 284.703 1.345 5 50 CDBA CC(=O)c1cc(N2CC(N(C)C)C2)ccc1[N+](=O)[O-] 253415523 RYBIVAQXKOROTM-UHFFFAOYSA-N 263.297 1.548 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCNC1=O 858980 CYFYOBYYOJJASG-SECBINFHSA-N 293.279 1.068 5 50 CDBA CCCCCC(=O)O[C@H](CC(=O)O)C[N+](C)(C)C 2517065 VVPRQWTYSNDTEA-LLVKDONJSA-O 260.354 1.659 5 50 CDBA endogenous,in-man CN(C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1 2902568 KPFXNPAEVCQFKE-UHFFFAOYSA-N 251.286 1.276 5 50 CDBA CCN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 4819728 SCNUASIDRRLCNB-UHFFFAOYSA-N 263.297 1.373 5 50 CDBA O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCCCC1 261493918 LYEZXKQVTKSLOM-UHFFFAOYSA-N 250.254 1.927 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccn2)cc1 272459 NXIGSDAKUXYZOY-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA Cc1cn(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2C)cn1 527957 YRKQDZXKKYEKBA-UHFFFAOYSA-N 295.320 1.954 5 50 CDBA O=C(Cn1nnc2ccccc21)Nc1ccccc1[N+](=O)[O-] 4129238 FSLNTHRHOBKMIG-UHFFFAOYSA-N 297.274 1.978 5 50 CDBA C[C@@H](O)C[C@@H]1COCCN1c1ccccc1[N+](=O)[O-] 130037389 YRNJSECPAHPKBI-GHMZBOCLSA-N 266.297 1.571 5 50 CDBA O=C(O)[C@@H]1C[C@@H](Cc2ccc([N+](=O)[O-])cc2)CN1 4241413 OMUVMRKMUCNUGA-KOLCDFICSA-N 250.254 1.200 5 50 CDBA O=c1cc(O)c2c(=O)n3c4c(cccc4c2o1)CC3 344357 FVXHRAYAKDGQNB-UHFFFAOYSA-N 255.229 1.370 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1O 16650581 LCTLIEHXUJWWHU-QWHCGFSZSA-N 278.308 1.970 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])c(Sc2ncnn2C)c1 170595033 MPTMBOHBJXVBMN-UHFFFAOYSA-N 294.292 1.661 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(F)cc1F 1423794 RAFVTBIUZNHXDW-UHFFFAOYSA-N 282.206 1.708 5 50 CDBA CN1CCN(c2ccnc3c([N+](=O)[O-])cccc23)CC1 4593351 UKMBHLNZJSXAEO-UHFFFAOYSA-N 272.308 1.895 5 50 CDBA O=[N+]([O-])c1ccc(NCCN2CCOCC2)cc1 20005262 NWUVRJDVZZNZGH-UHFFFAOYSA-N 251.286 1.339 5 50 CDBA CCC1=NCCN1CCNc1ccc([N+](=O)[O-])c(C)n1 1775993435 QNKMHAIYPWGMTB-UHFFFAOYSA-N 277.328 1.834 5 50 CDBA Cc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] 374985 OGGRHWZJYBTWDT-UHFFFAOYSA-N 250.254 1.376 5 50 CDBA O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CCCO1 445608 VZXPHIWIOIILJY-LLVKDONJSA-N 264.281 1.433 5 50 CDBA CCCC1=Nc2cccc([N+](=O)[O-])c2S(=O)(=O)N1 585138668 BSSVHNQGIYZBLC-UHFFFAOYSA-N 269.282 1.717 5 50 CDBA CC(C)OC(=O)Cn1c(=O)sc2cc([N+](=O)[O-])ccc21 5498256 KGOGOBOPCWNCPV-UHFFFAOYSA-N 296.304 1.923 5 50 CDBA O=C(CS(=O)(=O)c1ccccc1)c1ccc([N+](=O)[O-])o1 4543055 FULRUFPWLALPFG-UHFFFAOYSA-N 295.272 1.844 5 50 CDBA Cn1nnnc1SCC(=O)c1ccc([N+](=O)[O-])cc1 4735026 WBPDMXDHWGOWLK-UHFFFAOYSA-N 279.281 1.093 5 50 CDBA C[C@H]1CNCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 420165427 HGJZTJKCAACMFZ-QMMMGPOBSA-N 287.266 1.994 5 50 CDBA COC(=O)C(C(=O)OC)c1ccc([N+](=O)[O-])cc1Cl 22199902 SKVWJFVXCSQZLS-UHFFFAOYSA-N 287.655 1.678 5 50 CDBA COC[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CCO1 266186845 AUXKQXDAAQKKSK-NSHDSACASA-N 282.296 1.455 5 50 CDBA Cc1ncc(Cn2cc(Br)c([N+](=O)[O-])n2)[nH]1 585119086 PYBUFMXSWQNIHS-UHFFFAOYSA-N 286.089 1.634 5 50 CDBA O=[N+]([O-])c1cnc(N2CCn3nccc3C2)c(Cl)c1 585122493 PYHMCOWNQFPZKC-UHFFFAOYSA-N 279.687 1.860 5 50 CDBA COC(=O)C[C@H](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1O 565189548 HKUVVFRDZKQTCH-MRVPVSSYSA-N 296.279 1.828 5 50 CDBA COc1cccc2c1ncc1c(=O)nc(N)sc12 26463106 QELQUYGOHDTGKL-UHFFFAOYSA-N 259.290 1.796 5 50 CDBA Nc1nc(/C=C/c2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 13479849 MERJTQNAXXAOST-VOTSOKGWSA-N 258.237 1.431 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ncccn1 368781 WGADSIIOWABKSF-UHFFFAOYSA-N 280.265 1.186 5 50 CDBA O=C(C1CC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4619803 QMLCDULZLVKAOG-UHFFFAOYSA-N 275.308 1.653 5 50 CDBA CC(=O)N/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)NC(C)C 2677608 OQIYSHVGWUEISB-JYRVWZFOSA-N 291.307 1.596 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@H](O)CN2CCCC2)cc1 4819238 NOSFWVXSNGKPRN-GFCCVEGCSA-N 266.297 1.430 5 50 CDBA CN1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC1 6375899 SXQZCXHNYYVDNL-UHFFFAOYSA-N 280.353 1.539 5 50 CDBA COC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1 4294273 OCXGWRMIILNDHU-UHFFFAOYSA-N 251.198 1.219 5 50 CDBA CCOC(=O)[C@H](C(C)=O)c1ccc(N)cc1[N+](=O)[O-] 4530443 YDHOUFMUOSRUKJ-LLVKDONJSA-N 266.253 1.413 5 50 CDBA CCNc1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 4773219 UTUAGXFBABLLAK-UHFFFAOYSA-N 289.269 1.338 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NC1(C2CCC2)CCC1 458241819 SLNQCMJAPWCBMG-UHFFFAOYSA-N 278.312 1.630 5 50 CDBA COc1ccccc1Nc1nc(NN)nc(C)c1[N+](=O)[O-] 5394130 UWQOXAZHMGZNMO-UHFFFAOYSA-N 290.283 1.731 5 50 CDBA COCCOCCn1cc([N+](=O)[O-])c(-c2nccs2)n1 253427481 UKRVCOHTHIQSJI-UHFFFAOYSA-N 298.324 1.578 5 50 CDBA CCn1nnc(C)c1CNc1nccc(C)c1[N+](=O)[O-] 521398367 BDVJGOXBARXMKV-UHFFFAOYSA-N 276.300 1.830 5 50 CDBA Cc1nc(N2C[C@@H]3CCN(C)C[C@@H]3C2)ccc1[N+](=O)[O-] 1616021086 HJNNPIXNWKSRSK-NWDGAFQWSA-N 276.340 1.686 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NC2CCCC2)c1 5093406 JOFKRFQJUJLIDD-UHFFFAOYSA-N 270.310 1.816 5 50 CDBA O=[N+]([O-])c1ccc2c(c1)c(Br)nn2[N+](=O)[O-] 3091318 YBVTZNWFADRSMW-UHFFFAOYSA-N 287.029 1.747 5 50 CDBA Cc1cc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)no1 1428829 RLNODWNAGXLVBY-UHFFFAOYSA-N 265.229 1.035 5 50 CDBA O=C(O)[C@H]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C1 19979731 POEMRFUPSCRXHF-VIFPVBQESA-N 293.279 1.923 5 50 CDBA O=[N+]([O-])c1ccc(-c2cnc(N3CCOCC3)nc2)cc1 209516 ORDVYDBNNRYAJE-UHFFFAOYSA-N 286.291 1.888 5 50 CDBA O=[N+]([O-])c1ccc(-n2nc3ccc4nonc4c3n2)cc1 4368285 DTWCJQWJGNIOSC-UHFFFAOYSA-N 282.219 1.865 5 50 CDBA CN1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 4977621 ZCKBBRCKFYVUCI-UHFFFAOYSA-N 279.296 1.071 5 50 CDBA O=C(NCCOC1CCCC1)c1ccc(O)c([N+](=O)[O-])c1 160074600 FQMZTPXPCWAZOR-UHFFFAOYSA-N 294.307 1.989 5 50 CDBA CNC(=O)N[C@H]1CCCN(c2nccc(C)c2[N+](=O)[O-])C1 952994284 OIBDOPRMRKGXFD-JTQLQIEISA-N 293.327 1.196 5 50 CDBA CN(CCNCC(F)(F)F)c1ccc([N+](=O)[O-])cn1 1615587377 KHWWLIFTVJILNJ-UHFFFAOYSA-N 278.234 1.578 5 50 CDBA CC(=O)Nc1cc(C(=O)O)c([N+](=O)[O-])c(NC(C)=O)c1C 5536679 YPXUEOWILCFEGO-UHFFFAOYSA-N 295.251 1.518 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(F)cc1 1062580 JIIKASMYQVRWAX-UHFFFAOYSA-N 264.216 1.569 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)N[C@H](C)c1ccccc1 196096 MNIRMFLJSSZBCR-LLVKDONJSA-N 288.307 1.977 5 50 CDBA CC(=O)N1CCO[C@@]1(C)c1ccc([N+](=O)[O-])cc1 437804 NKSLLFHRRVNKHI-LBPRGKRZSA-N 250.254 1.646 5 50 CDBA C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 1000975 QDOJMFPATKMARA-JTQLQIEISA-N 274.280 1.669 5 50 CDBA CC1CCN([C@@]2(O)C(=O)Nc3ccc([N+](=O)[O-])cc32)CC1 4755334 KKPQVGKQUZCXIC-AWEZNQCLSA-N 291.307 1.424 5 50 CDBA CCOC(=O)Cc1nc2ccc([N+](=O)[O-])cc2o1 60637 JHSUODTXBJJUGP-UHFFFAOYSA-N 250.210 1.842 5 50 CDBA CCOC(=O)[C@@H](F)[C@@H]1CCN(c2ncccc2[N+](=O)[O-])C1 585092261 MCMPYQHBCYCRLG-KOLCDFICSA-N 297.286 1.717 5 50 CDBA CO[C@@H](C)CS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 472818 ISARYKZZXVDQHZ-VIFPVBQESA-N 273.310 1.712 5 50 CDBA Nc1ncnc(Oc2ccccc2F)c1[N+](=O)[O-] 5064122 XRSVZZKDEGCQMC-UHFFFAOYSA-N 250.189 1.898 5 50 CDBA CC(C)[C@H]1CNCCN1c1ccc([N+](=O)[O-])nc1 600947777 NNZDKNDGUNFMMC-LLVKDONJSA-N 250.302 1.424 5 50 CDBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@H](C)O1 347572 HHMVWMCEDGWZPS-YUMQZZPRSA-N 254.242 1.437 5 50 CDBA Cc1cc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)nn1C 2857538 MUVLPESKZMPQKE-UHFFFAOYSA-N 289.295 1.958 5 50 CDBA C[C@@H]1CCCCN1[C@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21 244866721 WBEUKNYVFYYBEX-YMTOWFKASA-N 291.307 1.566 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@H](C)c2cn[nH]c2)c1[N+](=O)[O-] 270556916 ZWSXTSVEIUSAKN-SSDOTTSWSA-N 292.299 1.485 5 50 CDBA CC(=O)N[C@@H](CC(=O)O)c1ccc([N+](=O)[O-])cc1 112630 IGXJPNSMMOYCOC-JTQLQIEISA-N 252.226 1.247 5 50 CDBA O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccc(F)cc1F 197144 WDQFINHLOVQPEU-UHFFFAOYSA-N 283.194 1.103 5 50 CDBA CCOC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C 2930449 LXMZRMFHPXLTQE-UHFFFAOYSA-N 252.226 1.405 5 50 CDBA CCN(CC)S(=O)(=O)c1ccccc1[N+](=O)[O-] 3190383 TVZZRXKFWHHNMB-UHFFFAOYSA-N 258.299 1.625 5 50 CDBA CCOC(=O)c1cnn(-c2cccc([N+](=O)[O-])c2)c1N 34937078 CAQVBJANBGLDGH-UHFFFAOYSA-N 276.252 1.539 5 50 CDBA in-vitro CC(=O)N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)O 243164 PABMJKZMUOMZOR-UXBLZVDNSA-N 250.210 1.156 5 50 CDBA biogenic CCOC(=O)/C(=C\c1ccc([N+](=O)[O-])cc1)NC(C)=O 4755803 PDXJSUBGLJCNIH-XYOKQWHBSA-N 278.264 1.635 5 50 CDBA CCN(c1cc(C)c([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 225646202 SWMLPXPIFLPXGA-SECBINFHSA-N 264.285 1.013 5 50 CDBA CN1CCCN(Cc2ccc([N+](=O)[O-])s2)CC1 238896 GBHZSHONVQIEDE-UHFFFAOYSA-N 255.343 1.794 5 50 CDBA Cc1ccnc(N2CCN(CCCF)CC2)c1[N+](=O)[O-] 521398648 WFEXVQBUNDOSBJ-UHFFFAOYSA-N 282.319 1.780 5 50 CDBA CN(C)[C@H](CNc1ncc([N+](=O)[O-])s1)C1CC1 241287096 LJVZKZQMAMWZIZ-MRVPVSSYSA-N 256.331 1.803 5 50 CDBA COC(=O)[C@H]1C[C@@H](O)CN1Cc1cccc([N+](=O)[O-])c1C 169033762 FHKDRSCIMSELFL-DGCLKSJQSA-N 294.307 1.011 5 50 CDBA O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCCC1 5068285 IGXXJWCKQNEELE-LBPRGKRZSA-N 280.324 1.867 5 50 CDBA CN1CCN(Cc2ccc(O)c([N+](=O)[O-])c2)CC1 19608755 WITWBEOHGAFFOA-UHFFFAOYSA-N 251.286 1.048 5 50 CDBA O=C(CN1CCNCC1)Nc1ccc([N+](=O)[O-])cc1Cl 5093849 JHATUMHVKJKULS-UHFFFAOYSA-N 298.730 1.092 5 50 CDBA COC(=O)[C@@H]1C[C@H](O)CN1Cc1cccc([N+](=O)[O-])c1C 158745934 FHKDRSCIMSELFL-AAEUAGOBSA-N 294.307 1.011 5 50 CDBA Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc([N+](=O)[O-])cc1 170598543 HHLLKWAJNZFLIN-UHFFFAOYSA-N 291.223 1.489 5 50 CDBA COC[C@@H](C)NC(=O)/C=C/c1ccccc1[N+](=O)[O-] 2830928 BPVNNJNDZALIRS-QROSGCPLSA-N 264.281 1.759 5 50 CDBA COc1cc(CN2CCC[C@H](CO)C2)cc([N+](=O)[O-])c1O 3110198 QJMOLLTYJFTKJN-JTQLQIEISA-N 296.323 1.513 5 50 CDBA CCOC(=O)CC(=O)Nc1ccc(C)cc1[N+](=O)[O-] 71772178 UKWGWVRAPCTBOC-UHFFFAOYSA-N 266.253 1.795 5 50 CDBA CC1(C)C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 161458705 QQLMYGKCRDSRCT-SECBINFHSA-N 294.307 1.988 5 50 CDBA O=c1oc2cc([N+](=O)[O-])ccc2n1CCC1OCCO1 195565871 GVXKYFOUKLBOTI-UHFFFAOYSA-N 280.236 1.266 5 50 CDBA O=[N+]([O-])C1=CC(=C2C=C([N+](=O)[O-])C=C[N+]2=O)N(O)C=C1 1857522690 WXNZXNOYJCKSDV-UHFFFAOYSA-N 279.188 1.044 5 50 CDBA O=[N+]([O-])c1ccc(Cl)cc1CN1CCN(CCO)CC1 4948437 ZQTDDMVYJCBWAB-UHFFFAOYSA-N 299.758 1.358 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)c1ccccc1 529203 KCSSYKNTAXKHAE-UHFFFAOYSA-N 274.280 1.763 5 50 CDBA COc1ccccc1[C@@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 90836 XLHBDHDXTFIGJA-CABZTGNLSA-N 250.254 1.292 5 50 CDBA COC(=O)[C@H](CC(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1 860399 YALCHPSLBOUASK-LBPRGKRZSA-N 294.307 1.912 5 50 CDBA Cc1cccnc1NC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1 4820294 UKTKIOXBPGBBBO-SECBINFHSA-N 275.268 1.694 5 50 CDBA O=C(NN1CCCCC1)c1ccc(O)c([N+](=O)[O-])c1 119381903 XEGATSPMTJBLTP-UHFFFAOYSA-N 265.269 1.431 5 50 CDBA C[C@H]1OCC[C@]12CN(Cc1cccc([N+](=O)[O-])c1)CCO2 280520173 RUUBJRNFDVDGFS-DOMZBBRYSA-N 292.335 1.975 5 50 CDBA NCCNc1ccc([N+](=O)[O-])c(N2CCCCC2)c1 4046664 CHCMPFLDXUTJDD-UHFFFAOYSA-N 264.329 1.956 5 50 CDBA CN(C)CCCC(C)(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 424061315 SCDOLTYLZLZGFL-UHFFFAOYSA-N 297.359 1.028 5 50 CDBA C[C@@H]1C[N+]2(CCS(=O)(=O)CC2)Cc2ccccc2O1 1615610599 LSMDCFLWXFSTLS-GFCCVEGCSA-N 282.385 1.213 5 50 CDBA Cc1cc(C(=O)NC[C@H]2CCCO2)ccc1[N+](=O)[O-] 64146 WKQWVSOBXWPMSP-LLVKDONJSA-N 264.281 1.812 5 50 CDBA CCOCCCNC(=O)Cc1ccccc1[N+](=O)[O-] 2819103 ALKHGUASUXZZIC-UHFFFAOYSA-N 266.297 1.680 5 50 CDBA O=[N+]([O-])[C@@H]1[C@H]2C[C@H]3[C@H]4[C@H]2[C@H]2[C@H]1C[C@H]([C@H]42)[C@@H]3[N+](=O)[O-] 257357052 LVAWNZCHNHYYFC-BSJVOARFSA-N 250.254 1.055 5 50 CDBA COC(=O)c1cc(C(=O)N2CCCC2)cc([N+](=O)[O-])c1 60853 ZBEMLXAPMNEZLX-UHFFFAOYSA-N 278.264 1.617 5 50 CDBA C[C@H](N)[C@H]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 135237033 KLUNMTGYVKYXBY-AAEUAGOBSA-N 291.351 1.723 5 50 CDBA Cc1nn(C)c(N2CC[C@@](O)(C(F)(F)F)C2)c1[N+](=O)[O-] 266005396 MBTBLOVVVOSZKS-VIFPVBQESA-N 294.233 1.140 5 50 CDBA Cc1nn(CC(=O)Nc2nccs2)c(C)c1[N+](=O)[O-] 1069806 REPQLWKCRKPPPV-UHFFFAOYSA-N 281.297 1.503 5 50 CDBA C[C@@H](O)CNCCNc1ccc(Cl)cc1[N+](=O)[O-] 4156877 SFBLWALWAIFDJS-MRVPVSSYSA-N 273.720 1.631 5 50 CDBA O=C1NC(=O)c2cc([N+](=O)[O-])c(Br)cc21 4499553 YLGNUZYLLNKCPD-UHFFFAOYSA-N 271.026 1.241 5 50 CDBA COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1C 251790247 NJSQRIIVUUCGDM-MWLCHTKSSA-N 294.307 1.849 5 50 CDBA Cn1nc2c(c1N)CN(c1ccc([N+](=O)[O-])cc1)C2 408524826 ZRJHMIZNSHFIOD-UHFFFAOYSA-N 259.269 1.431 5 50 CDBA O=C(O)CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3864409 VZQBXLQRVMDXRH-UHFFFAOYSA-N 269.213 1.780 5 50 CDBA in-vitro O=C1C=CC[C@@H]2[C@H]3CCC[N@+]4([O-])CCC[C@@H](CN12)[C@@H]34 238809353 QMGGMESMCJCABO-JARXUMMXSA-N 262.353 1.660 5 50 CDBA biogenic,in-vitro Nc1c([N+](=O)[O-])cnc(Cl)c1Br 95628393 LTMLJVIGDRMNQF-UHFFFAOYSA-N 252.455 1.988 5 50 CDBA CC1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 170598726 GVWJUCNQYDXYLV-UHFFFAOYSA-N 261.281 1.936 5 50 CDBA CN(CC(=O)O)c1nc2ccc([N+](=O)[O-])cc2s1 34991 UEFPTOKOQARXST-UHFFFAOYSA-N 267.266 1.725 5 50 CDBA O=C1C=CC(=O)N1c1ccc([N+](=O)[O-])cc1Br 5091619 USYVYKYEOALPIH-UHFFFAOYSA-N 297.064 1.787 5 50 CDBA COc1cc(C(=O)N[C@@H](C)[C@@H](C)C(=O)O)ccc1[N+](=O)[O-] 164802340 PVEHFFINWSOWAG-SFYZADRCSA-N 296.279 1.442 5 50 CDBA O=[N+]([O-])c1cc(O)ccc1I 2379300 QCKXOEOOXJUACP-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA in-vitro C[C@H](C(=O)Nc1cccnc1)n1cc([N+](=O)[O-])cn1 1423169 RXLQCEHRCNOMBW-MRVPVSSYSA-N 261.241 1.386 5 50 CDBA Cc1nc(N)sc1CCNc1ccc([N+](=O)[O-])cn1 1615586910 GDMSKSFRNKYYBB-UHFFFAOYSA-N 279.325 1.992 5 50 CDBA C[C@@H]1OCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)[C@H]1C 150905887 NFQCJWCIVXGNQD-IUCAKERBSA-N 280.280 1.550 5 50 CDBA COc1ccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c(OC)c1 89601 BGHATRKYYKUFPI-MFKMUULPSA-N 280.280 1.300 5 50 CDBA CC(C)[C@H](C(=O)O)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 191425 WYZPKTOYRYTTRJ-SNVBAGLBSA-N 292.247 1.300 5 50 CDBA O=C(Cn1cnc([N+](=O)[O-])c1)OCc1ccccc1 4809641 KJESJLJBAFKJFQ-UHFFFAOYSA-N 261.237 1.535 5 50 CDBA CC(=O)OC(OC(C)=O)c1ccc([N+](=O)[O-])c(F)c1 96032034 AMXYFBGXACJEOW-UHFFFAOYSA-N 271.200 1.859 5 50 CDBA C[C@H]1C[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188562316 WKGXAILQYCTNTJ-TVQRCGJNSA-N 276.292 1.840 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1NCCc1cc[nH]n1 714553805 RPGKYYFLXADRKI-UHFFFAOYSA-N 264.289 1.497 5 50 CDBA COc1c(Cl)cc([N+](=O)[O-])c(OC)c1C(=O)O 93127 DQYMZXRGXUJHLS-UHFFFAOYSA-N 261.617 1.964 5 50 CDBA in-vitro O=C(Oc1cccc([N+](=O)[O-])c1)[C@H]1CCCNC1 6092488 MUVROTJILUATRW-VIFPVBQESA-N 250.254 1.500 5 50 CDBA COC(=O)[C@](C)(O)CNc1ccc(Cl)cc1[N+](=O)[O-] 349252400 MBWQHNIMLMSYNZ-LLVKDONJSA-N 288.687 1.584 5 50 CDBA O=C(O)COc1c([N+](=O)[O-])cc(Cl)cc1[N+](=O)[O-] 1772491472 FSRUSMLKVBFOBJ-UHFFFAOYSA-N 276.588 1.620 5 50 CDBA O=C(O)c1c([N+](=O)[O-])cc(Br)cc1[N+](=O)[O-] 14982245 AGYWRQRLPWSJLO-UHFFFAOYSA-N 291.013 1.964 5 50 CDBA CC(=O)c1ccc(N2CCC23COC3)c([N+](=O)[O-])c1 408522381 IELJAFJCMBFLOJ-UHFFFAOYSA-N 262.265 1.777 5 50 CDBA NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 580887 WMMBCHXSXIHYII-UHFFFAOYSA-N 285.259 1.946 5 50 CDBA O=C(O)c1nccnc1C(=O)Nc1ccccc1[N+](=O)[O-] 4012150 BAHZKFYRFQTWIV-UHFFFAOYSA-N 288.219 1.335 5 50 CDBA Cc1nn(CC(=O)Nc2ccncc2)c(C)c1[N+](=O)[O-] 355519 WWOHKMNVASVUCU-UHFFFAOYSA-N 275.268 1.442 5 50 CDBA CN(C[C@H]1CCCO1)C(=O)c1cccc([N+](=O)[O-])c1O 132035366 WXPNVFSCAKPAKK-SECBINFHSA-N 280.280 1.551 5 50 CDBA C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 183287 FJYZQTKHFHDBEO-NXEZZACHSA-N 264.281 1.844 5 50 CDBA O=C(NCN1CCCCC1)c1ccc([N+](=O)[O-])cc1 71771077 UHUWXZXYFYIWMV-UHFFFAOYSA-N 263.297 1.768 5 50 CDBA O=[N+]([O-])c1cccnc1NCc1cc2n(n1)CCCO2 585092437 WVKPQGRWLAMLGT-UHFFFAOYSA-N 275.268 1.581 5 50 CDBA CO[C@@H]1CCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1O 160573420 PQMFYKCBFMUTTC-GXSJLCMTSA-N 280.280 1.598 5 50 CDBA COC(=O)[C@H](CC(C)C)NC(=O)c1cccc([N+](=O)[O-])c1 303451 CVCSSPONYVDWCO-LBPRGKRZSA-N 294.307 1.912 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCCCC1 1070590 YHOSZZUTVIYTQY-UHFFFAOYSA-N 252.274 1.194 5 50 CDBA O=C(N[C@H]1CCN(CC2CC2)C1)c1cc([N+](=O)[O-])c[nH]1 169982012 HARHDCHSWHMIFN-JTQLQIEISA-N 278.312 1.137 5 50 CDBA CCN1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 57366620 IWKXGRRMWASTNC-UHFFFAOYSA-N 253.277 1.876 5 50 CDBA Cc1ccc(NC(=O)c2cnn(C)c2)cc1[N+](=O)[O-] 1002051 NBVDXYCGJHCENK-UHFFFAOYSA-N 260.253 1.889 5 50 CDBA Cc1cc(NC(=O)N[C@@H]2C=C[C@H](CO)C2)ccc1[N+](=O)[O-] 153822642 MWDHDGUGRXEDSH-CMPLNLGQSA-N 291.307 1.962 5 50 CDBA O=C(O)CC(CC(=O)O)c1ccc([N+](=O)[O-])cc1 71624706 YNPLFNKGJKRZNX-UHFFFAOYSA-N 253.210 1.628 5 50 CDBA in-vitro O=C(O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1 15443264 VEAIWASLIKZFDF-SECBINFHSA-N 250.254 1.896 5 50 CDBA O=C(OCCN1CCOCC1)c1cccc([N+](=O)[O-])c1 19331213 OTBNMAAXJXOFLU-UHFFFAOYSA-N 280.280 1.084 5 50 CDBA Cc1ccc(C)c(S(=O)(=O)n2c([N+](=O)[O-])cnc2C)c1 53225 VJYHQOZFCQSYDC-UHFFFAOYSA-N 295.320 1.954 5 50 CDBA COc1ccc(OC)c([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1 115945 CVLKDXLRWZVGRV-GXFFZTMASA-N 280.280 1.300 5 50 CDBA COc1ccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c(OC)c1 89603 BGHATRKYYKUFPI-ZWNOBZJWSA-N 280.280 1.300 5 50 CDBA CC(C)(C)OC(=O)NCCNc1ncccc1[N+](=O)[O-] 49390650 DSKAMWJJTHNJBK-UHFFFAOYSA-N 282.300 1.926 5 50 CDBA O=C(Nc1ccc([N+](=O)[O-])cc1O)C(F)(F)F 4566731 UJHHWDGLVGPPDY-UHFFFAOYSA-N 250.132 1.801 5 50 CDBA CCOC(=O)[C@@H](C(C)=O)C(=O)c1ccccc1[N+](=O)[O-] 101174389 ISECNKUEXSBEIK-NSHDSACASA-N 279.248 1.546 5 50 CDBA O=C(NCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1 5102687 VTQNIZXTQUCBIG-UHFFFAOYSA-N 289.247 1.443 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2cccnc2)cc1 67788 WRWKDMAHPWRIBY-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA C[C@H]1CN(C)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C 408074630 XDYRQSUTZXVFFP-ZJUUUORDSA-N 280.328 1.098 5 50 CDBA CCc1nc(C)cn1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 263827 VDFAVLBYKKJMEJ-UHFFFAOYSA-N 295.320 1.899 5 50 CDBA Cc1cc(OCCCN2CCNCC2)ccc1[N+](=O)[O-] 2839814 JWTKIQMFCXUIKB-UHFFFAOYSA-N 279.340 1.577 5 50 CDBA CCN(CC)C(=O)/N=c1\sc([N+](=O)[O-])cn1CC 71771642 WVNGOPPMBQEWDM-KHPPLWFESA-N 272.330 1.840 5 50 CDBA C[C@@H]1C[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188562290 WKGXAILQYCTNTJ-NOZJJQNGSA-N 276.292 1.840 5 50 CDBA CCOC(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])o2)C1 4838213 VEQAQFMAAWUATB-SNVBAGLBSA-N 282.296 1.963 5 50 CDBA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc([N+](=O)[O-])o1 451969 RGZGSTBIAFBXGZ-JTQLQIEISA-N 295.251 1.331 5 50 CDBA CCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 1789677 URMHNKQBDAAJJJ-UHFFFAOYSA-N 258.299 1.673 5 50 CDBA Cc1cc(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)no1 1421986 PAHOHFSIPRBPQB-SSDOTTSWSA-N 265.229 1.287 5 50 CDBA O=[N+]([O-])c1ccc(NCCN=c2cncc[nH]2)s1 610515190 XPMRSKFGYRYVJP-UHFFFAOYSA-N 265.298 1.392 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 2746067 GINFXBXLTYPPSE-JTQLQIEISA-N 286.309 1.052 5 50 CDBA C[C@@H]1OCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)[C@@H]1C 150905850 NFQCJWCIVXGNQD-BDAKNGLRSA-N 280.280 1.550 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccc3c(c2)OCO3)N1 103383 FKMJJAMPPJQKFX-PELKAZGASA-N 264.237 1.012 5 50 CDBA CN1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 4978422 IYPBEDSFOKZICE-UHFFFAOYSA-N 269.732 1.996 5 50 CDBA O=C(O)[C@H]1CCC[C@@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 314378 DAFGBJNYNSYTIU-QWRGUYRKSA-N 299.304 1.622 5 50 CDBA Cn1nnnc1SCC(=O)c1cccc([N+](=O)[O-])c1 480107 SSLLJMUNWDIUPN-UHFFFAOYSA-N 279.281 1.093 5 50 CDBA Cc1ccccc1OC[C@H]1C[N+]23CCO[B-]2(OCC3)O1 195815431 XOVXHDGSBPXARE-IUDNXUCKSA-N 277.129 1.085 5 50 CDBA O=[N+]([O-])c1ccc(CN2CCn3nccc3C2)cc1 585122456 JLPGKOICSCHLCE-UHFFFAOYSA-N 258.281 1.807 5 50 CDBA Cn1c(=O)c2cn3c4ccccc4ncc3c2n(C)c1=O 117563 VRZRFZAWUPUDPK-UHFFFAOYSA-N 280.287 1.038 5 50 CDBA COC[C@@H]1CN(c2c(OC)cccc2[N+](=O)[O-])CCO1 328593436 JSWUCAVWVVLVDN-JTQLQIEISA-N 282.296 1.455 5 50 CDBA CCOC(=O)Cc1ccc([N+](=O)[O-])c(O)c1[N+](=O)[O-] 72267075 PISBFMTVMRUODY-UHFFFAOYSA-N 270.197 1.314 5 50 CDBA in-vitro Cc1ccnc(N2CCc3nccc(N)c3C2)c1[N+](=O)[O-] 585092098 FFMZTLMSGPGROB-UHFFFAOYSA-N 285.307 1.838 5 50 CDBA O=[N+]([O-])c1cc(CN2CCC[C@H](O)C2)ccc1O 16662693 PGWIVESVDPNWPU-JTQLQIEISA-N 252.270 1.257 5 50 CDBA Cc1cc(C(=O)NCCCN(C)C)ccc1[N+](=O)[O-] 2801325 XRRRVNQSXOXWLK-UHFFFAOYSA-N 265.313 1.585 5 50 CDBA COC(=O)COc1c(OC)cc([N+](=O)[O-])cc1OC 1431593 IKFCHNMIVJSDCQ-UHFFFAOYSA-N 271.225 1.164 5 50 CDBA O=[N+]([O-])c1ccnc(-c2cc([N+](=O)[O-])cc[n+]2[O-])c1 4774795 URJOIZFTDVMRNQ-UHFFFAOYSA-N 262.181 1.198 5 50 CDBA COc1cc([N+](=O)[O-])cnc1NC(=O)[C@H](C)SC 1536162272 BBMPCBLDKCJUSP-LURJTMIESA-N 271.298 1.688 5 50 CDBA Cc1ccc(S(=O)(=O)n2cc([N+](=O)[O-])cn2)cc1 243917 UQXTZCMKWNNBMG-UHFFFAOYSA-N 267.266 1.337 5 50 CDBA CCOC(=O)c1cc([N+](=O)[O-])ccc1-n1ccnc1 6659283 NYZBRGPLOGKWQG-UHFFFAOYSA-N 261.237 1.957 5 50 CDBA CC(=O)N1CC[C@H](CNc2nccc(C)c2[N+](=O)[O-])C1 521394239 LCPZIRPPYYVCOP-LLVKDONJSA-N 278.312 1.579 5 50 CDBA CCCC(C(=O)OC)(C(=O)OC)c1ccc([N+](=O)[O-])cc1 1396282 ICDFIWKBOWHCNU-UHFFFAOYSA-N 295.291 1.979 5 50 CDBA O=C(O)Cc1cc(Br)ccc1[N+](=O)[O-] 5567691 ZKKCLKYKTRUIKW-UHFFFAOYSA-N 260.043 1.984 5 50 CDBA COc1cccc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1OC 90316 UBUCSYPYCYYISP-SKDRFNHKSA-N 280.280 1.300 5 50 CDBA Cc1c(CC(=O)NCC(=O)C(C)C)cccc1[N+](=O)[O-] 135118372 WUONWGPVKGKWOH-UHFFFAOYSA-N 278.308 1.787 5 50 CDBA O=C(O)CC(CC(=O)O)c1ccccc1[N+](=O)[O-] 5061374 QDCQXWFNCDXRJX-UHFFFAOYSA-N 253.210 1.628 5 50 CDBA Cc1nn(Cc2ccc(C(=O)O)o2)c(C)c1[N+](=O)[O-] 812248 WWNBPKPNFYJWDG-UHFFFAOYSA-N 265.225 1.748 5 50 CDBA CC(=O)c1cc2c(c([N+](=O)[O-])c1N=O)OCCO2 4957768 NGYIQEHMYKFTEM-UHFFFAOYSA-N 252.182 1.967 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C)(C)[C@H]1C1CC1 408230789 IWKICYDYFLAEGP-LLVKDONJSA-N 278.312 1.589 5 50 CDBA Nc1nc(I)c(Cl)cc1[N+](=O)[O-] 147529011 ONUNNXNTWARSMR-UHFFFAOYSA-N 299.455 1.830 5 50 CDBA COc1ccc(/C=C2/SC(=O)NC2=O)cc1[N+](=O)[O-] 1214183 INLWDVUOSLVTET-WEVVVXLNSA-N 280.261 1.927 5 50 CDBA Nc1ccc2nn(-c3ccc([N+](=O)[O-])cc3)nc2c1 209034 CBZLPVYUKQTSRC-UHFFFAOYSA-N 255.237 1.911 5 50 CDBA Cc1cc(OCCCCS(=O)(=O)O)ccc1[N+](=O)[O-] 2165047 FTOVQCQLQAJMGJ-UHFFFAOYSA-N 289.309 1.950 5 50 CDBA O=C(NC1CCOCC1)c1ccc(O)c([N+](=O)[O-])c1 164288352 OEZPSJSSQRILJW-UHFFFAOYSA-N 266.253 1.209 5 50 CDBA CCOc1ccc(NC(=O)[C@@H](C)O)c([N+](=O)[O-])c1 4826777 AKVZEESPETUWKJ-SSDOTTSWSA-N 254.242 1.313 5 50 CDBA COc1ccccc1[C@H]1NC(=O)CC[C@@H]1[N+](=O)[O-] 90837 XLHBDHDXTFIGJA-JOYOIKCWSA-N 250.254 1.292 5 50 CDBA COC(=O)[C@@H](CC(C)C)NC(=O)c1cccc([N+](=O)[O-])c1 303452 CVCSSPONYVDWCO-GFCCVEGCSA-N 294.307 1.912 5 50 CDBA CC1(C)O[C@@H]1COC(=O)c1ccc([N+](=O)[O-])cc1 2539400 NNRORFCMFJMIKM-SNVBAGLBSA-N 251.238 1.929 5 50 CDBA OCCCN(CCO)c1ccc2ccc3cccnc3c2n1 1875295174 SHFQNRLMOIYFTG-UHFFFAOYSA-N 297.358 1.964 5 50 CDBA O=C(O)CCCCCNC(=O)c1ccc([N+](=O)[O-])cc1 2166927 QJUKPUCOWZIKDA-UHFFFAOYSA-N 280.280 1.970 5 50 CDBA O=[N+]([O-])c1ccc(NC[C@H]2CCOC2)c2cn[nH]c12 1775998382 BBOWDWJTVGUMEH-MRVPVSSYSA-N 262.269 1.920 5 50 CDBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](C)CN1C 408074624 XDYRQSUTZXVFFP-UWVGGRQHSA-N 280.328 1.098 5 50 CDBA CCN1C[C@@]2([N+](=O)[O-])C[C@]([N+](=O)[O-])(CC=C2Cl)C1 13154467 IMIRONZDASOPRO-ZJUUUORDSA-N 275.692 1.269 5 50 CDBA O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCOCC1 288790 MTHNSFLMWKYCOG-UHFFFAOYSA-N 270.672 1.721 5 50 CDBA C[C@@H](C(=O)O)N1Cc2ccc([N+](=O)[O-])cc2C1=O 809802 NYTKWHBITYKXRB-LURJTMIESA-N 250.210 1.024 5 50 CDBA Nc1cc(O)c([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCCO1 170597849 OIFLOLHJUYMZTP-MRVPVSSYSA-N 295.295 1.182 5 50 CDBA O=C(O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 112587 HKWNCNVBEVINPC-SSDOTTSWSA-N 250.210 1.032 5 50 CDBA in-vitro CCOc1ccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 90816 RKKCAGBZQUVVPH-AAEUAGOBSA-N 264.281 1.682 5 50 CDBA CN1C=C(C(=O)NCCCC[N+](C)(C)C)C=CC1=CN=O 1857524720 UQYQIAQAVIGJHM-UHFFFAOYSA-O 293.391 1.582 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCC[C@H]2CCCN2)c1 166812871 VTURGOZMPYBAAF-SNVBAGLBSA-N 299.352 1.015 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 3899111 SNONFGXPIHDLRG-UHFFFAOYSA-N 253.214 1.340 5 50 CDBA CC(C)(C)C1CCC(O)(CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CC1 170624118 MXIPLZZAXFWZAV-WVIDZAQPSA-N 298.383 1.735 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCOCC1 189208006 STYNVUVSIQMFAE-VIFPVBQESA-N 279.296 1.476 5 50 CDBA CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 15021134 HDFRUPQKYIBRNL-UHFFFAOYSA-N 259.059 1.717 5 50 CDBA in-vitro CC(=O)NCCc1noc(-c2ccc([N+](=O)[O-])cc2)n1 225598959 NCXQDLNIKYPXPH-UHFFFAOYSA-N 276.252 1.323 5 50 CDBA COCCNC(=S)Nc1ccccc1[N+](=O)[O-] 13496744 BVSYRHNILNUDFX-UHFFFAOYSA-N 255.299 1.528 5 50 CDBA O=C(CSc1ncn[nH]1)Nc1ccc([N+](=O)[O-])cc1 18173097 CWTLZEJPOXNXFQ-UHFFFAOYSA-N 279.281 1.444 5 50 CDBA CS(=O)(=O)c1ccc([N+](=O)[O-])cc1Br 95218034 RKUAFVBITZRKPS-UHFFFAOYSA-N 280.099 1.761 5 50 CDBA COc1cc2c(cc1OC)[C@H](C)[N@+](C)(CCO)CC2 253389839 QTDLNPKJXHKAKD-ZBEGNZNMSA-N 266.361 1.760 5 50 CDBA biogenic COc1cccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1 122549 KFYLNOYLFXNMLQ-CMPLNLGQSA-N 250.254 1.292 5 50 CDBA O=C(CCCn1cc([N+](=O)[O-])cn1)Nc1nccs1 1067647 KVVDIWYXZSLEDI-UHFFFAOYSA-N 281.297 1.667 5 50 CDBA O=C1[C@@H]2[C@@H](C(=O)N1Cc1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1 100411211 UTHWUWYTBDEADO-IMIFBBOLSA-N 298.298 1.902 5 50 CDBA COC(=O)CN1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 301498342 CJLFNPGWLRLNGG-UHFFFAOYSA-N 293.323 1.198 5 50 CDBA Cc1cc([N+](=O)[O-])nn1COc1ccccc1C=O 12404976 JKMWXLCZCZDDID-UHFFFAOYSA-N 261.237 1.949 5 50 CDBA in-vitro O=C(O)/C=C/C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 4892966 JRABJZGUAXKSOZ-ONEGZZNKSA-N 270.628 1.828 5 50 CDBA Cc1ccc(N2CC(=O)N(C3CC3)C2)c([N+](=O)[O-])c1 253430895 XZUFIVFDBUEQTN-UHFFFAOYSA-N 261.281 1.672 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccnc2)cc1 255529 CZRISBMGZLRLED-UHFFFAOYSA-N 279.277 1.791 5 50 CDBA O=C1CSC(=O)N1Cc1ccc([N+](=O)[O-])cc1 1416672 MHZDRNMPGIOPBA-UHFFFAOYSA-N 252.251 1.790 5 50 CDBA Cc1cc(OCCN2CCOCC2)ccc1[N+](=O)[O-] 20117867 MBBTWSWVJALUED-UHFFFAOYSA-N 266.297 1.614 5 50 CDBA CCn1cc(CNC(=O)c2ccccc2[N+](=O)[O-])cn1 355524 FEYBXIIPCLADLR-UHFFFAOYSA-N 274.280 1.741 5 50 CDBA CC(=O)OCCNC(=O)Nc1cccc([N+](=O)[O-])c1C 585119965 CNTVQQRBRZANIS-UHFFFAOYSA-N 281.268 1.588 5 50 CDBA COC(=O)C(C(=O)OC)c1ncc(Cl)cc1[N+](=O)[O-] 65337544 UVSRKEGGVVTQFK-UHFFFAOYSA-N 288.643 1.073 5 50 CDBA in-vitro CC[C@H](C)[C@@H](CN(C)C)Nc1c([N+](=O)[O-])ncn1C 585092389 UGODXHAXXGBQQO-VHSXEESVSA-N 269.349 1.717 5 50 CDBA O=C1C=CC[C@@H]2[C@@H]3CCC[N@+]4([O-])CCC[C@@H](CN12)[C@@H]34 253618089 QMGGMESMCJCABO-UOZBHZCFSA-N 262.353 1.660 5 50 CDBA biogenic O=[N+]([O-])c1cnc(N[C@@H]2CCCC23OCCO3)nc1 585117991 NOINYRHSOVHCNR-SECBINFHSA-N 266.257 1.092 5 50 CDBA Cc1cc([N+](=O)[O-])nn1COc1cccc(C=O)c1 2535216 KFSLTEZAUFNCNE-UHFFFAOYSA-N 261.237 1.949 5 50 CDBA in-vitro C[N+]1([C@@H]2CC[C@H]3CCC[C@H]2C32OCCO2)CCOCC1 101022206 VRVCNBSRFRKSAW-RBSFLKMASA-N 282.404 1.785 5 50 CDBA C[C@H]1CCC[C@@H](C)[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 248533183 SLHPTAZLMFPPJZ-IWIIMEHWSA-N 280.328 1.732 5 50 CDBA CC(C)N(c1ccccc1[N+](=O)[O-])S(C)(=O)=O 169725157 GEESNODPSMLCJA-UHFFFAOYSA-N 258.299 1.769 5 50 CDBA O=C(N[C@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 3085975 OHNCQODQPDYKMG-NWDGAFQWSA-N 264.281 1.628 5 50 CDBA C[C@@H]1CN(c2c[n+]([O-])ccc2[N+](=O)[O-])C[C@@H](C2CC2)O1 408523231 QGTXUESSMXJFAV-RNCFNFMXSA-N 279.296 1.232 5 50 CDBA O=[N+]([O-])C[C@H](c1c[nH]c2ccccc12)S(=O)(=O)O 1869013 GNDZQZFYCOCREF-SNVBAGLBSA-N 270.266 1.374 5 50 CDBA Cc1c([N+](=O)[O-])cc(C(=O)N(C)C)cc1[N+](=O)[O-] 2831438 JMBPIHHOZGNXQZ-UHFFFAOYSA-N 253.214 1.513 5 50 CDBA CN(C)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 142256597 OVUXKOAUZYEBIW-UHFFFAOYSA-N 277.324 1.761 5 50 CDBA O=[N+]([O-])c1ccccc1CS(=O)(=O)NCC(F)F 184611096 MEUQSUOMMMTHNG-UHFFFAOYSA-N 280.252 1.279 5 50 CDBA Nc1ccc([N+](=O)[O-])cc1C(=O)NCCC1=CCOCC1 170605150 ANXNFVVYDNBLRI-UHFFFAOYSA-N 291.307 1.644 5 50 CDBA Cc1cc(C)n(S(=O)(=O)c2ccccc2[N+](=O)[O-])n1 310007 LIQLSNJCYAYJDM-UHFFFAOYSA-N 281.293 1.645 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnccn1 438606 CDKCREBPFQDNRR-UHFFFAOYSA-N 258.237 1.946 5 50 CDBA NC(=O)c1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)cc1 858507 IJIFIVQIOINEMR-UHFFFAOYSA-N 270.244 1.925 5 50 CDBA COC(=O)C1(Cn2cc(Cl)cc([N+](=O)[O-])c2=O)CC1 240555842 GXTBCHMENRKBOK-UHFFFAOYSA-N 286.671 1.363 5 50 CDBA COc1ccc(=O)n(Cc2cccc([N+](=O)[O-])c2C)n1 170603544 FFGOEOBHYQBMNZ-UHFFFAOYSA-N 275.264 1.517 5 50 CDBA O=C(O)c1cc([N+](=O)[O-])ccc1I 2559907 JSSFIFUXHORXJX-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro CCOC(=O)[C@@]1(C)Oc2ccc([N+](=O)[O-])cc2NC1=O 8729836 RARDOKXXQXTSKH-LBPRGKRZSA-N 280.236 1.248 5 50 CDBA in-vitro Cc1nn(C)c(N2CC[C@](O)(C(F)(F)F)C2)c1[N+](=O)[O-] 266005394 MBTBLOVVVOSZKS-SECBINFHSA-N 294.233 1.140 5 50 CDBA CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5666141 DSOLQUVYSHSDNU-MRVPVSSYSA-N 283.240 1.004 5 50 CDBA O=[N+]([O-])c1cccc(OCCN2CCOCC2)c1 20230827 TZARIMLSZORYDL-UHFFFAOYSA-N 252.270 1.306 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(OC)CC1 521395106 JMIKMGHTGBNADN-UHFFFAOYSA-N 294.307 1.997 5 50 CDBA COC(=O)Cc1ccc(C(=O)OC)cc1[N+](=O)[O-] 77011490 DCDSLKRPXTVJSA-UHFFFAOYSA-N 253.210 1.097 5 50 CDBA O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N1CCOCC1 81047 NHEDTDCDOYHVMV-UHFFFAOYSA-N 272.207 1.345 5 50 CDBA CCCN(c1ccccc1[N+](=O)[O-])S(C)(=O)=O 211804610 VBQRMJUMGDEDKY-UHFFFAOYSA-N 258.299 1.771 5 50 CDBA CNC(=O)N[C@@H]1CCCN(c2cc(C)c([N+](=O)[O-])cn2)C1 952993348 GNNMEVKLWRZQJR-SNVBAGLBSA-N 293.327 1.196 5 50 CDBA C[C@@H]1[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CCC[C@H]1C 225385049 HRCNYRYYTNHPKZ-VWYCJHECSA-N 280.328 1.732 5 50 CDBA CCOC(=O)c1cc(NCCCO)c(F)cc1[N+](=O)[O-] 725262012 QVLFLBURRDHLIF-UHFFFAOYSA-N 286.259 1.705 5 50 CDBA COCCCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4313640 DNBUBZRKFYCKPY-UHFFFAOYSA-N 288.325 1.218 5 50 CDBA O=C(NCc1noc(-c2ccccc2[N+](=O)[O-])n1)C(F)F 253429150 GQTDBUVRKJJAHB-UHFFFAOYSA-N 298.205 1.526 5 50 CDBA C[C@H]1CN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C 292852727 ABLMCCLXRADBSI-WDEREUQCSA-N 298.364 1.709 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Cl 1693946 RJQRHZYXGHSNKQ-UHFFFAOYSA-N 260.589 1.943 5 50 CDBA CC1(S(=O)(=O)N2CCc3c2cccc3[N+](=O)[O-])CC1 408457274 OEYCPWUAYVAQAH-UHFFFAOYSA-N 282.321 1.840 5 50 CDBA Cc1ccc(C)c(S(=O)(=O)NCCCF)c1[N+](=O)[O-] 170611290 ZILSYEPZASZPOW-UHFFFAOYSA-N 290.316 1.850 5 50 CDBA O=CN1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 453078 IAHFWCGBKZUJLL-UHFFFAOYSA-N 297.698 1.162 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCOC[C@H]2c2ncno2)c1 328593702 ZYZWAJJYJKVOID-LBPRGKRZSA-N 290.279 1.551 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CCC([C@H](F)C(N)=O)CC1 585132726 POSPUPZUWYONFI-NSHDSACASA-N 296.302 1.338 5 50 CDBA CCOC(=O)c1ccc([N+](=O)[O-])cc1CC(=O)O 214474982 VVFBQYHRHLVHLZ-UHFFFAOYSA-N 253.210 1.399 5 50 CDBA O=CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 451905 YJXCUIZKNCAFBW-UHFFFAOYSA-N 297.698 1.162 5 50 CDBA C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 38987 HWYYUVZSWZFHEI-NXEZZACHSA-N 264.281 1.844 5 50 CDBA CC(=O)c1ccc(NCCc2nnc[nH]2)c([N+](=O)[O-])c1 268469500 YJHXCFLSDDZNSU-UHFFFAOYSA-N 275.268 1.570 5 50 CDBA Cc1ncc([N+](=O)[O-])n1CCO[C@@H]1CCCCO1 196792820 XQXUFEMJNJHIBN-LLVKDONJSA-N 255.274 1.643 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@@H](O)CN2CCCC2)cc1 4819239 NOSFWVXSNGKPRN-LBPRGKRZSA-N 266.297 1.430 5 50 CDBA Cn1nc(Br)c([N+](=O)[O-])c1Br 14007752 PGMQVDHYFOWDLI-UHFFFAOYSA-N 284.895 1.853 5 50 CDBA C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1 183289 FJYZQTKHFHDBEO-UWVGGRQHSA-N 264.281 1.844 5 50 CDBA Cc1nn([C@@H](C)C(=O)N2CCCCC2)c(C)c1[N+](=O)[O-] 1068589 CWESNDCEBMDVQG-NSHDSACASA-N 280.328 1.982 5 50 CDBA NC(=O)[C@@H](F)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 585133193 AIILPQCDILBKEV-ZDUSSCGKSA-N 295.314 1.630 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)/N=c1\[nH]ccs1 372363 NPGICNOVMMVHGL-UHFFFAOYSA-N 285.306 1.274 5 50 CDBA Cn1nnnc1SCc1ccc([N+](=O)[O-])cc1 417612 ZEKNFPNYDXUUHX-UHFFFAOYSA-N 251.271 1.411 5 50 CDBA CN1CCC(N(C)Cc2ccc([N+](=O)[O-])o2)CC1 201287 PORZZLDABFMUFV-UHFFFAOYSA-N 253.302 1.714 5 50 CDBA CCOC(=O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 2141304 XYNYTHKTWXHFAU-UHFFFAOYSA-N 267.241 1.279 5 50 CDBA Cc1cccc([N+](=O)[O-])c1NCC1(C(N)=O)CCOCC1 120609118 XHFRFIFMIBWGMY-UHFFFAOYSA-N 293.323 1.597 5 50 CDBA O=C(O)C1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 12021472 CZNJNZYRDDIEEM-UHFFFAOYSA-N 278.264 1.532 5 50 CDBA CC(=O)c1ccc(N2CCN3CC[C@H]2C3)c([N+](=O)[O-])c1 381939115 TXQNTQHMIAZTRE-LBPRGKRZSA-N 275.308 1.692 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1 256335 RZCSIXRGZZQPRO-NSHDSACASA-N 290.275 1.645 5 50 CDBA CCn1ncc([N+](=O)[O-])c1C(=O)NCc1ccccc1 800697 FXENLHXSSFSXHE-UHFFFAOYSA-N 274.280 1.741 5 50 CDBA COc1ccc(CSc2nnc(C)n2N)cc1[N+](=O)[O-] 305883 DJTFNDWOTKSPON-UHFFFAOYSA-N 295.324 1.509 5 50 CDBA Nc1nc(N2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-] 216942227 XAMHULWRUULNME-UHFFFAOYSA-N 299.334 1.899 5 50 CDBA CCc1c[nH]c(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)n1 178116799 OAONZKNYNFOELS-UHFFFAOYSA-N 295.320 1.854 5 50 CDBA O=C(O)c1cccn(-c2ccc([N+](=O)[O-])cc2)c1=O 390823818 FUIJYCKOHMZKNT-UHFFFAOYSA-N 260.205 1.444 5 50 CDBA Cc1cc(C)n(C(=O)CCCn2cc([N+](=O)[O-])cn2)n1 1423446 IZDLYSSIMJSFRF-UHFFFAOYSA-N 277.284 1.725 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2ccc3c(c2)OCO3)N1 103388 FKMJJAMPPJQKFX-PRHODGIISA-N 264.237 1.012 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])nn1Cc1ccccc1 194800 LCYQWJHPXZMIQN-UHFFFAOYSA-N 261.237 1.626 5 50 CDBA CC(C)N1C[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)CC1=O 1163513 GBOMHZMCOJEVBR-JTQLQIEISA-N 291.307 1.790 5 50 CDBA CC1CCN([C@]2(O)C(=O)Nc3ccc([N+](=O)[O-])cc32)CC1 4755335 KKPQVGKQUZCXIC-CQSZACIVSA-N 291.307 1.424 5 50 CDBA Cc1nc(N2CCC[C@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-] 301621254 FIOXFIBJXHYVJW-NSHDSACASA-N 292.339 1.603 5 50 CDBA CN(C)C1CCN(c2cnccc2[N+](=O)[O-])CC1 169725788 KGKYFTPGLBNKOB-UHFFFAOYSA-N 250.302 1.520 5 50 CDBA CCOC(=O)C[C@H](NC(C)=O)c1ccc([N+](=O)[O-])cc1 1807004 YSMCYVXIUHWNHI-LBPRGKRZSA-N 280.280 1.725 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCOCC1 4583106 CAEWMRVLPRROEE-UHFFFAOYSA-N 265.269 1.767 5 50 CDBA CC(=O)N1[C@H](C[N+](=O)[O-])C[C@@H](C)N1c1ccccc1 4603360 DCQAFYPIDRLVIK-MFKMUULPSA-N 263.297 1.694 5 50 CDBA CC(=O)c1ccc(NC[C@@H]2COCO2)c([N+](=O)[O-])c1 521395251 IRHCNKYAFMHANO-SNVBAGLBSA-N 266.253 1.582 5 50 CDBA CON1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 408523425 RORJXDJRVWCXMA-UHFFFAOYSA-N 279.296 1.481 5 50 CDBA CN(C)/C=C(\c1ccccc1)S(=O)(=O)CC[N+](C)(C)C 71785287 TWVLFYUPCYYUNG-FYWRMAATSA-N 297.444 1.668 5 50 CDBA COC(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC 125379 QFDPDZYOLBAGEN-UHFFFAOYSA-N 282.252 1.495 5 50 CDBA CC1=NN(c2ccccc2)C(=O)[C@H]1[C@H](C)C[N+](=O)[O-] 297236 MLRDEESSCJSTAE-SKDRFNHKSA-N 261.281 1.938 5 50 CDBA O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@H]1CCCO1 585089362 HGTHTZZMWOCQJX-SNVBAGLBSA-N 282.271 1.572 5 50 CDBA CC(=O)N1c2ccc([N+](=O)[O-])cc2NC(=O)C[C@@H]1C 3997083 JZBPVSYPNBPFCX-ZETCQYMHSA-N 263.253 1.678 5 50 CDBA Cn1c(=O)c([N+](=O)[O-])c(NCCCO)c2ccccc21 4309966 BVJGUCHNCOITRP-UHFFFAOYSA-N 277.280 1.241 5 50 CDBA Cc1ccnc(N2C[C@H]3CCN(C)C[C@H]3C2)c1[N+](=O)[O-] 585092356 RHVIFJPCVACWDJ-NEPJUHHUSA-N 276.340 1.686 5 50 CDBA CCOC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc2c1=O 17300516 LYNIYLCGKJWHSC-UHFFFAOYSA-N 262.221 1.613 5 50 CDBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccc1[N+](=O)[O-] 247703212 BJTDPZWRFIXVIZ-UMNHJUIQSA-N 290.323 1.613 5 50 CDBA CC(=O)NC[C@H]1CN(c2cccc(C)c2[N+](=O)[O-])CCO1 170602860 IHWXKZKOHCUZKX-LBPRGKRZSA-N 293.323 1.245 5 50 CDBA COc1ccc(NC(=O)N2CC[C@H](CO)C2)c([N+](=O)[O-])c1 584906990 WFJOIAMAUUGHQO-VIFPVBQESA-N 295.295 1.450 5 50 CDBA O=[N+]([O-])c1cccnc1N[C@H]1CCCN(CCF)C1 585092395 UUSAMCGPFFJRCJ-JTQLQIEISA-N 268.292 1.836 5 50 CDBA CCN1CCN(CCOc2ccc([N+](=O)[O-])c(C)c2)CC1 5065455 ZCYYDAFQZDUZAY-UHFFFAOYSA-N 293.367 1.920 5 50 CDBA COc1ccc(Nc2n/c(=N\N)[nH]c(C)c2[N+](=O)[O-])cc1 13477246 DMUBBAGWJVZYLF-UHFFFAOYSA-N 290.283 1.153 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCc2ccccc21 1067375 ZWEDYXDTQVYRKA-UHFFFAOYSA-N 286.291 1.771 5 50 CDBA C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 267628 JYORBNUHGKBRNJ-QWRGUYRKSA-N 278.308 1.773 5 50 CDBA CCCCSC[C@H]1Cn2nc([N+](=O)[O-])nc2O1 2496764 KFJIWSFOZDOGLI-SSDOTTSWSA-N 258.303 1.481 5 50 CDBA CCOC(=O)COc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2684971 OIPICVKGZXMYPP-UHFFFAOYSA-N 270.197 1.445 5 50 CDBA COc1cc([N+](=O)[O-])cnc1N1CC[C@H](O)CC(C)(C)C1 585133008 MKTIVYVIVGNSCA-NSHDSACASA-N 295.339 1.986 5 50 CDBA CS(=O)(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 4506011 LLAWYFFLHACFRY-UHFFFAOYSA-N 293.732 1.209 5 50 CDBA CC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@H]1CCCO1 152533901 XTIQBODKKHSVEP-CMPLNLGQSA-N 294.307 1.988 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@H]([C@H](O)C(F)(F)F)C2)cn1 450885808 VICVZIUQHRHQKJ-XVKPBYJWSA-N 291.229 1.739 5 50 CDBA CS(=O)(=O)c1ccc(SCC(=O)O)c([N+](=O)[O-])c1 1475602 MILCDFHAJJDOKY-UHFFFAOYSA-N 291.306 1.175 5 50 CDBA C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)O 20557907 DZPYKYTXQZEIAJ-LURJTMIESA-N 253.214 1.189 5 50 CDBA C[C@@H](O)[C@H](NSc1ccccc1[N+](=O)[O-])C(=O)O 31362116 QJMPRIHAPGGFMA-MUWHJKNJSA-N 272.282 1.026 5 50 CDBA O=[N+]([O-])CC1(O)CCN(Cc2ccccc2)CC1 72194137 KROYZEIFJNHYOI-UHFFFAOYSA-N 250.298 1.290 5 50 CDBA CC(=O)c1ccc(NCCN=S(C)(C)=O)c([N+](=O)[O-])c1 408518678 UHFYVXHIBKCULN-UHFFFAOYSA-N 299.352 1.937 5 50 CDBA O=C1CCC(=O)N1c1ccc(Cl)cc1[N+](=O)[O-] 4103978 UVNPGRWABCHYDH-UHFFFAOYSA-N 254.629 1.902 5 50 CDBA C[C@H](C(=O)Nn1cnnc1)c1ccc([N+](=O)[O-])cc1 471523 SPTNSYQPAKGAML-QMMMGPOBSA-N 261.241 1.060 5 50 CDBA COC(=O)CCc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 2166709 DQLWOAONCUINLZ-UHFFFAOYSA-N 270.197 1.314 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NC1CCCCCC1 1423498 RTYUSHRMLJPTON-UHFFFAOYSA-N 266.301 1.630 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1NCc1nc(N(C)C)n[nH]1 585132756 SSXPZERQQFWIOI-UHFFFAOYSA-N 277.288 1.094 5 50 CDBA Cc1cc(N2CCN(C[C@H](C)O)C[C@H]2C)ncc1[N+](=O)[O-] 225403201 RRKMGSZRNLSUQH-NEPJUHHUSA-N 294.355 1.190 5 50 CDBA Nc1ccc(C(=O)NCCCCCC(=O)O)cc1[N+](=O)[O-] 237930844 JMGDGUUTCAKADT-UHFFFAOYSA-N 295.295 1.552 5 50 CDBA CC(C)(C)NS(=O)(=O)Nc1ccccc1[N+](=O)[O-] 4005472 ISUYNHZTDVMOFO-UHFFFAOYSA-N 273.314 1.640 5 50 CDBA Nc1nc(Cl)c(Br)cc1[N+](=O)[O-] 85224926 ZXEAEDQQTTWJBE-UHFFFAOYSA-N 252.455 1.988 5 50 CDBA in-vitro O=[N+]([O-])c1ccc(S(=O)(=O)N2CCCC2)cc1 128947 FFCUNTGOHGZCQO-UHFFFAOYSA-N 256.283 1.379 5 50 CDBA in-vitro O=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4517275 MVZXUWLTGGBNHL-VIFPVBQESA-N 281.224 1.556 5 50 CDBA in-vitro O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc([N+](=O)[O-])c[nH]1 169982010 HARHDCHSWHMIFN-SNVBAGLBSA-N 278.312 1.137 5 50 CDBA O=C1OCC[C@H]2CN(c3ccnc(F)c3[N+](=O)[O-])CCN12 585118419 NXRCVVCQRAIISH-QMMMGPOBSA-N 296.258 1.160 5 50 CDBA COc1cc(C(=O)CCC(=O)O)c([N+](=O)[O-])cc1OC 2168001 AOWBIDDDHVSFPH-UHFFFAOYSA-N 283.236 1.660 5 50 CDBA C[C@@H](O)CNCCNc1ccc([N+](=O)[O-])cc1Cl 4143282 DAVRYBDIZYBJOI-MRVPVSSYSA-N 273.720 1.631 5 50 CDBA Cc1c(Cl)nc2c([N+](=O)[O-])ccc(C)n2c1=O 725244925 NZZSQCKLGPTOOK-UHFFFAOYSA-N 253.645 1.873 5 50 CDBA C[C@H]1C[C@@H](O)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 408279332 ZAXGNRURCUUEQD-WRWORJQWSA-N 283.259 1.721 5 50 CDBA O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)c(F)c1 408463056 AZMHICIIVWCVIT-TVHISCQUSA-N 279.271 1.334 5 50 CDBA N=C(CCO)NOCc1c(F)cc([N+](=O)[O-])cc1F 408518586 OYBIQHPYTSVYBE-UHFFFAOYSA-N 275.211 1.254 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)c2ccccc2)nc1 1390042 NVIZNXXUBXUVGG-UHFFFAOYSA-N 264.262 1.823 5 50 CDBA Cc1ccc(S(=O)(=O)NC2CC2)cc1[N+](=O)[O-] 5012582 XXBCUSMPDZZQTQ-UHFFFAOYSA-N 256.283 1.344 5 50 CDBA O=[N+]([O-])c1ccc(N2CCNCC2)cc1N1CCCC1 4550604 HAVYTZCTAHRQNI-UHFFFAOYSA-N 276.340 1.605 5 50 CDBA CCOCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4676906 FQMJTCFQVZMJHE-UHFFFAOYSA-N 293.323 1.280 5 50 CDBA CC(C)(C)N[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 22016032 HILZEJUHMCGOIB-NSHDSACASA-N 291.307 1.615 5 50 CDBA Cc1ccnc(N2[C@H]3CC[C@@H]2CN(C)CC3)c1[N+](=O)[O-] 585092366 SEMGRSGSQRPQRX-NWDGAFQWSA-N 276.340 1.971 5 50 CDBA Cc1nc(N2CCC(C)CC2)[nH]c(=O)c1[N+](=O)[O-] 4951378 PDPGVDPYOXVZPA-UHFFFAOYSA-N 252.274 1.223 5 50 CDBA C[C@H]1[C@@H]2CCCN2CCN1Cc1ccc(O)c([N+](=O)[O-])c1 22078412 FTITUJQJYXKYKM-AAEUAGOBSA-N 291.351 1.969 5 50 CDBA Cc1c(NC(=O)N2C[C@H]3C[C@H]2C(=O)O3)cccc1[N+](=O)[O-] 296053288 ADKNRVOFYMTKEQ-KCJUWKMLSA-N 291.263 1.435 5 50 CDBA CS(=O)(=O)N1CC=C(c2cccc([N+](=O)[O-])c2)CC1 616582603 GVKMBADDWUVOKB-UHFFFAOYSA-N 282.321 1.644 5 50 CDBA O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Br 3163567 BBKJKUFARRJPRP-UHFFFAOYSA-N 291.013 1.964 5 50 CDBA in-vitro Cc1[nH]nc(C(=O)N2CCC[C@H]2[C@H]2CCCO2)c1[N+](=O)[O-] 285828166 OHRUMYODQUAMPG-VHSXEESVSA-N 294.311 1.410 5 50 CDBA N[C@H]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 721867253 UPWCLTDDFJOOKP-AOOOYVTPSA-N 299.352 1.143 5 50 CDBA CCOC(=O)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 141911511 QMHQULBRPFVSDE-UHFFFAOYSA-N 263.209 1.822 5 50 CDBA Cc1nc([N+](=O)[O-])c(NCCCO)n1Cc1ccccc1 3903787 PFWQBNNVWDWKDC-UHFFFAOYSA-N 290.323 1.942 5 50 CDBA COC(=O)[C@@H](C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4520904 RXDDNUKGTCKLDT-ZCFIWIBFSA-N 269.213 1.476 5 50 CDBA COc1cc([N+](=O)[O-])cc(C=O)c1O[C@@H](C)C(=O)O 6007555 MIQCEOGOTBKVCB-LURJTMIESA-N 269.209 1.268 5 50 CDBA CC1=NCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] 13140579 HFZAOPGZWSISIF-UHFFFAOYSA-N 269.282 1.018 5 50 CDBA O=C(NCCCN1CCOCC1)c1cccc([N+](=O)[O-])c1 19720984 CPIHNOVSVDLFGZ-UHFFFAOYSA-N 293.323 1.047 5 50 CDBA O=C(O)[C@@H]1CS[C@H](c2ccc(O)c([N+](=O)[O-])c2)N1 85504 WHTBIMRPVIAQET-IMTBSYHQSA-N 270.266 1.089 5 50 CDBA CC1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 4310065 JYTMTVBQIJBDGR-UHFFFAOYSA-N 263.297 1.930 5 50 CDBA C[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 16382188 MYGGJOBCAZKDDS-PHIMTYICSA-N 294.307 1.609 5 50 CDBA COc1cccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1OC 90314 UBUCSYPYCYYISP-JOYOIKCWSA-N 280.280 1.300 5 50 CDBA CC(=O)N1[C@@H](C(=O)O)CS[C@H]1c1ccc([N+](=O)[O-])cc1 185042 DPFVSVGVJVQKSP-MNOVXSKESA-N 296.304 1.642 5 50 CDBA O=C(O)[C@@H]1CCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O1 71778214 YYULGVYLSQGCRW-QMMMGPOBSA-N 268.181 1.281 5 50 CDBA Nc1cc2n(n1)CCN(c1ccc([N+](=O)[O-])cc1F)C2 877871859 VKUBXQBDOVBWPC-UHFFFAOYSA-N 277.259 1.533 5 50 CDBA CC[C@@H](CO)NC(=O)OCc1ccc([N+](=O)[O-])cc1 5662964 HWPPBNKNJGFQDB-JTQLQIEISA-N 268.269 1.592 5 50 CDBA O=[N+]([O-])c1ccc(Sc2cccc[n+]2[O-])c2nonc12 1757986 ICCFXXDUYSPKOL-UHFFFAOYSA-N 290.260 1.916 5 50 CDBA Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)no1 2506211 CVNCVDVMQHVMBR-UHFFFAOYSA-N 277.236 1.909 5 50 CDBA CN1CCN(c2c([N+](=O)[O-])c(=O)oc3ccccc23)CC1 3895945 YENAYOJVUHVETP-UHFFFAOYSA-N 289.291 1.453 5 50 CDBA CCN(C)c1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 248269211 UVSWUELWOYFFON-DGCLKSJQSA-N 277.324 1.424 5 50 CDBA CC(C)(C)C1CCC(O)(CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CC1 170624116 MXIPLZZAXFWZAV-OOLXCHQQSA-N 298.383 1.735 5 50 CDBA C[C@@H](O)CNCCNc1c(Cl)cccc1[N+](=O)[O-] 4156888 RWYKAWYSJIOERS-MRVPVSSYSA-N 273.720 1.631 5 50 CDBA CCN(c1ncc(Cl)cc1[N+](=O)[O-])[C@H]1CCNC1=O 253427157 LJHVJGXDLIIIJK-QMMMGPOBSA-N 284.703 1.358 5 50 CDBA COc1cc(N2CCOCC2)cc(N)c1[N+](=O)[O-] 821864280 JHHZSMFJIORQQJ-UHFFFAOYSA-N 253.258 1.022 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN(CCO)CC2)c(Cl)c1 19735910 CSOGHWZVDGBXNY-UHFFFAOYSA-N 285.731 1.363 5 50 CDBA in-vitro Cc1ccc(C(=O)NCCN(C)C)cc1[N+](=O)[O-] 4590976 NRDREXDIENVEEF-UHFFFAOYSA-N 251.286 1.195 5 50 CDBA Cc1cc(NC[C@@H]2CC(=O)N(C3CC3)C2)ncc1[N+](=O)[O-] 253425780 PKGNFPMWDYVQRR-JTQLQIEISA-N 290.323 1.721 5 50 CDBA CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc([N+](=O)[O-])[nH]1 299002014 KFFZVNAODBUIFI-JTQLQIEISA-N 282.344 1.629 5 50 CDBA Cn1ncc([N+](=O)[O-])c1NC(=O)Cc1ccsc1 191675496 GOZSVNSABCAXFE-UHFFFAOYSA-N 266.282 1.571 5 50 CDBA CNC(=O)Cn1c(=O)c2ccccc2c2ccccc21 12416919 UAUYKISTHMCQNB-UHFFFAOYSA-N 266.300 1.901 5 50 CDBA COc1ccc(NC(=O)c2cnccn2)c([N+](=O)[O-])c1 4903484 SOSGLIHGWHAQAI-UHFFFAOYSA-N 274.236 1.646 5 50 CDBA O=C(NCCOC1CCCC1)c1cccc([N+](=O)[O-])c1O 121315914 CUMZTTLGEDKWNN-UHFFFAOYSA-N 294.307 1.989 5 50 CDBA C[C@@H]1C[C@H](O)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 408279330 ZAXGNRURCUUEQD-HQJQHLMTSA-N 283.259 1.721 5 50 CDBA O=C1C[C@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 189721 SYLRVRWGYQCANJ-MRVPVSSYSA-N 251.267 1.030 5 50 CDBA COc1c([N+](=O)[O-])cc([N+](=O)[O-])c(OC)c1[N+](=O)[O-] 100397011 WCMIMEQWHNFVQH-UHFFFAOYSA-N 273.157 1.428 5 50 CDBA CCN1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 5065597 GPOMAORZQWKNPD-UHFFFAOYSA-N 279.340 1.611 5 50 CDBA CC1(C)CN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1O 287856089 SGEIIKRZAYCOIU-QMMMGPOBSA-N 294.336 1.807 5 50 CDBA Cc1cc(CS(=O)(=O)Oc2ccccc2[N+](=O)[O-])on1 253429496 HHLGGLYBIXYBHN-UHFFFAOYSA-N 298.276 1.800 5 50 CDBA COC(=O)COc1c(Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] 40545338 YNBDXAJLGWEAQY-UHFFFAOYSA-N 290.615 1.708 5 50 CDBA CCOC(=O)Cc1c(Br)cncc1[N+](=O)[O-] 95743308 RAFZKGHGDIHWKS-UHFFFAOYSA-N 289.085 1.858 5 50 CDBA NCc1cc(CN2CCc3ccc([N+](=O)[O-])cc3C2)no1 1875291416 YDVFFLDQXRZZFK-UHFFFAOYSA-N 288.307 1.600 5 50 CDBA O=C(NC1(c2nnc[nH]2)CCC1)c1csc([N+](=O)[O-])c1 194283587 YXTTXDJIKPCBCZ-UHFFFAOYSA-N 293.308 1.584 5 50 CDBA O=C(O)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3883359 ZIRBMAVPCZUDTF-UHFFFAOYSA-N 250.254 1.896 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](c3nnn[nH]3)C2)n1 161015882 IBWALRLSGXAGOC-VIFPVBQESA-N 289.299 1.195 5 50 CDBA CC1(NS(=O)(=O)c2cc(F)c(F)c([N+](=O)[O-])c2)CC1 1615552499 VWHLKWZFAGNJKS-UHFFFAOYSA-N 292.263 1.704 5 50 CDBA CCN(CC)c1nc(C)c([N+](=O)[O-])c(C)c1C(N)=O 19732808 ZFWQTBZTLSYSPH-UHFFFAOYSA-N 266.301 1.552 5 50 CDBA CC[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 186117 GTJHLKNZGZFMKV-MRVPVSSYSA-N 258.299 1.672 5 50 CDBA NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ccncc1[N+](=O)[O-] 241262013 LAOKBYFBBFJDKS-FOGDFJRCSA-N 290.323 1.613 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@H](C)C[C@H](C)N)c1[N+](=O)[O-] 520815203 BFTCFEAQEGJFPY-JGVFFNPUSA-N 283.332 1.126 5 50 CDBA Cc1cnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)s1 170599144 YWWQCQIXWDIXHZ-UHFFFAOYSA-N 293.304 1.995 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCC[C@@H](C(N)=O)C1 192612551 STDZBWOIXMYQIP-ZJUUUORDSA-N 295.343 1.576 5 50 CDBA Cc1c(Cl)cc([N+](=O)[O-])c(OCC(=O)O)c1[N+](=O)[O-] 1772491503 VJOLFULSDGMYHV-UHFFFAOYSA-N 290.615 1.928 5 50 CDBA O=C(O)C1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 991056 OLNXQUYMKRMJIU-UHFFFAOYSA-N 278.264 1.532 5 50 CDBA O=C(O)CSc1cc(Cl)c2nonc2c1[N+](=O)[O-] 1314162 LEIJUUNMDKBYLE-UHFFFAOYSA-N 289.656 1.961 5 50 CDBA CNc1c(Cl)cc([N+](=O)[O-])cc1S(=O)(=O)NC 216715133 LNKCGAACKSPWDC-UHFFFAOYSA-N 279.705 1.198 5 50 CDBA Cc1c(C(=O)NC(C)(C)CO)cccc1[N+](=O)[O-] 307501 RFZSIMYPOXRICG-UHFFFAOYSA-N 252.270 1.404 5 50 CDBA COc1ccc(-c2cnc3nonc3n2)cc1[N+](=O)[O-] 1848444234 ZUMXJLSLBOMMFE-UHFFFAOYSA-N 273.208 1.597 5 50 CDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ncn[nH]1 5013754 BCMQOVDXIXASIA-UHFFFAOYSA-N 293.308 1.752 5 50 CDBA COc1ccc([N+](=O)[O-])cc1CNC(C)(C)CO 4868094 AUASLHHTKBKVIM-UHFFFAOYSA-N 254.286 1.464 5 50 CDBA O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCCC2)cc1 21981746 RCEYIHLMZBWOJK-UHFFFAOYSA-N 270.310 1.520 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])c(COC(C)=O)c1 145962087 DTOYHEZLUYOUOE-UHFFFAOYSA-N 253.210 1.445 5 50 CDBA CCCCNc1ncc(C(=O)OC)cc1[N+](=O)[O-] 95495992 OWOGOUUYKXSDFD-UHFFFAOYSA-N 253.258 1.988 5 50 CDBA C[C@H]1CCCN(c2ccc(-n3cnnn3)cc2[N+](=O)[O-])C1 5042287 JXBRTBRZDUMSAH-JTQLQIEISA-N 288.311 1.807 5 50 CDBA C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)[C@H](C(N)=O)C1 952993321 WVACXDXSYNAGJK-PELKAZGASA-N 281.287 1.824 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1ccco1 470200 FSOUAXLJFJRBNA-UHFFFAOYSA-N 272.216 1.984 5 50 CDBA Nc1c(F)cc(I)cc1[N+](=O)[O-] 4348098 YXIIZLLZNKTXHB-UHFFFAOYSA-N 282.012 1.921 5 50 CDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCc1ccno1 349491183 BZLCGUJEYYLXTG-UHFFFAOYSA-N 297.292 1.370 5 50 CDBA CNc1c(C(=O)OCCCNC(C)=O)cccc1[N+](=O)[O-] 170596217 RPAMTGIDXAWRNP-UHFFFAOYSA-N 295.295 1.320 5 50 CDBA Nc1ncnc(Nc2ccc(F)c(F)c2)c1[N+](=O)[O-] 3912593 JUCKXEKTPRZFGR-UHFFFAOYSA-N 267.195 1.989 5 50 CDBA O=[N+]([O-])c1ccccc1N1CC(NC2CCOCC2)C1 952994928 WUKMJNJLLOYPEM-UHFFFAOYSA-N 277.324 1.552 5 50 CDBA CCOC(=O)CSCC(=O)Nc1ccc([N+](=O)[O-])cc1 4517659 DLUNITMSZOXCCP-UHFFFAOYSA-N 298.320 1.830 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccco2)c1 4722078 YYCPMKOVDHIJGB-UHFFFAOYSA-N 282.277 1.666 5 50 CDBA COc1cc(C(=O)N[C@H](C)[C@@H](C)C(=O)O)ccc1[N+](=O)[O-] 164802100 PVEHFFINWSOWAG-HTQZYQBOSA-N 296.279 1.442 5 50 CDBA O=C(NC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 124895 ZIDAIXFZQZFHDE-LLVKDONJSA-N 250.254 1.504 5 50 CDBA Nn1ccc2nc3ccn(C4CCCC4)c(=O)c3cc2c1=O 40398610 PERHWXIAYMWGFL-UHFFFAOYSA-N 296.330 1.540 5 50 CDBA Cc1ccc/c(=N/S(=O)(=O)c2ccccc2[N+](=O)[O-])[nH]1 1225894 HRCVVJMGAMTNTE-UHFFFAOYSA-N 293.304 1.521 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)N2CCCCCC2)n1 483218 ATMWCCQRPLUHGK-UHFFFAOYSA-N 252.274 1.345 5 50 CDBA N[C@H]1CCC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 124981188 RBTOVHWKCCAALK-UWVGGRQHSA-N 299.352 1.143 5 50 CDBA Cc1nc(O)c2c(n1)CN(c1ncc([N+](=O)[O-])cc1C)C2 585132785 VPJXLGDUMQZOQM-UHFFFAOYSA-N 287.279 1.622 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CCn2nccc2C1 585122431 DZBWAMNCHAQEOO-UHFFFAOYSA-N 259.269 1.515 5 50 CDBA CCOC(=O)C(C(=O)OCC)c1ccc([N+](=O)[O-])cc1F 95944465 RZYIUPASHFMODF-UHFFFAOYSA-N 299.254 1.944 5 50 CDBA in-vitro CCN(CC)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 187395 SONXVVRXIQJXIP-UHFFFAOYSA-N 258.299 1.625 5 50 CDBA Cc1ccc/c(=N/S(=O)(=O)c2ccc([N+](=O)[O-])cc2)[nH]1 267049 GPWKTNXKKSBWRP-UHFFFAOYSA-N 293.304 1.521 5 50 CDBA O=C(O)[C@H]1CS[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N1 85492 WHTBIMRPVIAQET-MUWHJKNJSA-N 270.266 1.089 5 50 CDBA O=C(NC1[C@H]2CCC[C@H]1CN(C1CC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] 252514054 AZKOFPSZWVRPFJ-YRRQLQLVSA-N 293.367 1.031 5 50 CDBA Cc1nn(C)c(NCc2cnc3nccn3c2)c1[N+](=O)[O-] 408518619 QAODNRJRNMKYRT-UHFFFAOYSA-N 287.283 1.292 5 50 CDBA CC(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])s1 170597142 NAVYDXVHHCQLCL-UHFFFAOYSA-N 256.283 1.611 5 50 CDBA O=C(O)c1ccc([N+](=O)[O-])cc1I 5427620 SQICTGFCQITYDT-UHFFFAOYSA-N 293.016 1.898 5 50 CDBA in-vitro CC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 5662980 DSOLQUVYSHSDNU-QMMMGPOBSA-N 283.240 1.004 5 50 CDBA NC(=O)C1CCN(Cc2ccc([N+](=O)[O-])s2)CC1 19633865 TYVJPMMLTWTUEA-UHFFFAOYSA-N 269.326 1.354 5 50 CDBA CCOC(=O)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1 19640042 MRIZUWLPEUPULM-UHFFFAOYSA-N 279.296 1.769 5 50 CDBA O=C(c1ccc([N+](=O)[O-])o1)n1nnc2ccccc21 368764 ZPNXQDQUIPHRQB-UHFFFAOYSA-N 258.193 1.621 5 50 CDBA O=C1N[C@@H]2c3ccc([N+](=O)[O-])cc3C(=O)N2c2ccccc21 252496683 POMWWGHFRPIOAK-ZDUSSCGKSA-N 295.254 1.997 5 50 CDBA O=C(CN1CCNCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 5092628 PFYAUYIMWCFEFY-UHFFFAOYSA-N 298.730 1.092 5 50 CDBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1ccncc1 207296 JRWIJYVFPKNQDZ-UHFFFAOYSA-N 269.216 1.790 5 50 CDBA CCn1ncc([N+](=O)[O-])c1C(=O)n1nc(C)cc1C 356003 AXDFLVHBQVEESJ-UHFFFAOYSA-N 263.257 1.313 5 50 CDBA COc1cccc(NCCN2CCCOCC2)c1[N+](=O)[O-] 188497620 IPMPLBUCPVVFKG-UHFFFAOYSA-N 295.339 1.738 5 50 CDBA CC(=O)N1[C@H](c2ccc([N+](=O)[O-])cc2)SC[C@H]1C(=O)O 369594 DPFVSVGVJVQKSP-QWRGUYRKSA-N 296.304 1.642 5 50 CDBA NS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 2170321 GCJFIVMGFRULPF-UHFFFAOYSA-N 270.188 1.261 5 50 CDBA CN(C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N(C)C 4982095 OJQCOSUJNGFNDL-UHFFFAOYSA-N 282.256 1.271 5 50 CDBA O=[N+]([O-])[C@H]1[C@H]2C[C@@H]3C4C2C2C4[C@H](C[C@H]21)[C@H]3[N+](=O)[O-] 257357055 LVAWNZCHNHYYFC-QMJAETIYSA-N 250.254 1.055 5 50 CDBA CC[C@H](C)Nc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 675009469 IKEMALOPOHBVLR-LURJTMIESA-N 282.256 1.812 5 50 CDBA O=Cc1ccc(Cn2cc(Cl)c([N+](=O)[O-])n2)o1 2505987 GMOIDBNEMSRTQN-UHFFFAOYSA-N 255.617 1.899 5 50 CDBA NCC1(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCC1 109706123 CZLVOAHGCNPEJC-UHFFFAOYSA-N 299.352 1.145 5 50 CDBA CCN(CCO)C(=O)Nc1ccc([N+](=O)[O-])cc1C 163065903 ATZFRMWKQCUNRX-UHFFFAOYSA-N 267.285 1.749 5 50 CDBA CC(=O)NCCNc1nccc2c1c(=O)oc1ccccc12 1776111170 CSNIIDHUBBXDSM-UHFFFAOYSA-N 297.314 1.889 5 50 CDBA COc1cccc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)c1 15685009 SMEBOTMJUPTQAR-AATRIKPKSA-N 289.247 1.563 5 50 CDBA NC(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 55292038 QQDZWCIDUGRUIJ-LLVKDONJSA-N 263.297 1.292 5 50 CDBA O=c1[nH]c2cccnc2n1-c1ccc([N+](=O)[O-])cc1 501233 GZOAOHCKZRGXRO-UHFFFAOYSA-N 256.221 1.622 5 50 CDBA O=C(O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1732202 RDEPTRFZTKVALC-UHFFFAOYSA-N 258.211 1.680 5 50 CDBA in-vitro O=[N+]([O-])Nc1ncc(-c2ccc([N+](=O)[O-])cc2)cn1 2865151 BNIDVSLDOKTSHR-UHFFFAOYSA-N 261.197 1.655 5 50 CDBA CCOC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 44287006 GVFHLFNXERJLBX-UHFFFAOYSA-N 266.253 1.278 5 50 CDBA C[C@H]1CN(c2c[n+]([O-])ccc2[N+](=O)[O-])C[C@@H](C2CC2)O1 408523233 QGTXUESSMXJFAV-ZANVPECISA-N 279.296 1.232 5 50 CDBA COC(=O)CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2684922 JYKFTRPWOJQMRO-UHFFFAOYSA-N 272.238 1.768 5 50 CDBA O=[N+]([O-])c1cccc(S(=O)(=O)C(F)(F)F)c1 3098920 KDAOZCLTNCRPFJ-UHFFFAOYSA-N 255.173 1.888 5 50 CDBA CCOC(=O)C1=NN(c2ccc(F)cc2[N+](=O)[O-])CC1=O 6758121 PCTJFPIBQJEUQB-UHFFFAOYSA-N 295.226 1.042 5 50 CDBA NS(=O)(=O)c1ccc(Br)c([N+](=O)[O-])c1 78210714 LRJQWKFWBDRBME-UHFFFAOYSA-N 281.087 1.005 5 50 CDBA CN1C[C@@H](c2noc(-c3ccc([N+](=O)[O-])cc3)n2)CC1=O 225597366 JZAUABLXFACSEZ-VIFPVBQESA-N 288.263 1.591 5 50 CDBA COc1cccc(CCN=c2ccc([N+](=O)[O-])c(C)[nH]2)n1 348350315 NMDWJRGRCMDOAO-UHFFFAOYSA-N 288.307 1.778 5 50 CDBA CCCn1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)n1 470431 ZXWHPQSTWOUTPV-UHFFFAOYSA-N 276.256 1.244 5 50 CDBA CCN1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 54979090 BUIAMLUVBCIZLR-BQYQJAHWSA-N 289.335 1.772 5 50 CDBA O=[N+]([O-])c1c(Br)cc2c(c1[N+](=O)[O-])OCO2 71772866 CJJAGZXHQCMNEX-UHFFFAOYSA-N 291.013 1.994 5 50 CDBA O=[N+]([O-])c1ccc(OC[C@@H](O)CN2CCCCC2)cc1 32695 HUKIYIZTJIPXIR-ZDUSSCGKSA-N 280.324 1.820 5 50 CDBA COC(=O)Nc1ccc([N+](=O)[O-])c(NC(=O)OC)c1 4902135 SEOACTGILOKOFQ-UHFFFAOYSA-N 269.213 1.951 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1cc2ccccc2[nH]1 373540 WNCNHEOLLQNXAI-UHFFFAOYSA-N 299.290 1.589 5 50 CDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1Cc1ccc([N+](=O)[O-])cc1 239229143 UTHWUWYTBDEADO-CDGCEXEKSA-N 298.298 1.902 5 50 CDBA Cc1ccc(NC(=O)/C=C/C(=O)O)c([N+](=O)[O-])c1 3995636 KPULDRWQUXVEGP-SNAWJCMRSA-N 250.210 1.483 5 50 CDBA O=C(OC[C@@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])cc1 4991851 FCZLLBHKMMATSX-VIFPVBQESA-N 299.304 1.186 5 50 CDBA CN1CCC(NC(=O)Nc2cccc([N+](=O)[O-])c2)CC1 2857206 NHURYSIPVRSKDO-UHFFFAOYSA-N 278.312 1.811 5 50 CDBA C[C@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC(C)(C)O1 160129737 FLBLLDILGWCYMU-VIFPVBQESA-N 294.307 1.940 5 50 CDBA COc1cc(/C=C\C(=O)O)c([N+](=O)[O-])cc1OC 4570405 BZIRMMAJZSOLEW-ARJAWSKDSA-N 253.210 1.710 5 50 CDBA Cc1nnc(NC(=O)COc2ccccc2[N+](=O)[O-])s1 122282 AKZCTBPEOUZLGW-UHFFFAOYSA-N 294.292 1.772 5 50 CDBA Cc1cc([N+](=O)[O-])c[nH]c1=NCc1ccn2ccnc2c1 356858804 LXIDWJPNEZOPMS-UHFFFAOYSA-N 283.291 1.980 5 50 CDBA Cc1nc(Oc2cccc([N+](=O)[O-])c2)nc(N(C)C)n1 489513489 KWFGJEABWRNONC-UHFFFAOYSA-N 275.268 1.947 5 50 CDBA O=[N+]([O-])c1cc(Br)ccc1[S@](=O)O 675062127 GRQQMBZPRCUUSC-UHFFFAOYSA-N 266.072 1.938 5 50 CDBA O=C(O)CSCC(=O)Nc1ccccc1[N+](=O)[O-] 5717498 TZHVMQYWALBPJJ-UHFFFAOYSA-N 270.266 1.351 5 50 CDBA CCOC[C@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 193805645 JIFUQWTWCZEUND-CYBMUJFWSA-N 291.307 1.856 5 50 CDBA Cc1cnn(Cc2cccc([N+](=O)[O-])c2C)c(=O)c1 195435197 MPGWKXBHFXPEIV-UHFFFAOYSA-N 259.265 1.817 5 50 CDBA CNC(=O)[C@@H]1CCCCN1c1ccc([N+](=O)[O-])cn1 1615588142 XJBAEZQKKCIBLJ-JTQLQIEISA-N 264.285 1.095 5 50 CDBA CN1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 202157416 CAEUGAAFIWDZJX-UHFFFAOYSA-N 291.351 1.646 5 50 CDBA COc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] 103431 KHJBAYJZCAOEME-UHFFFAOYSA-N 266.253 1.076 5 50 CDBA COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C1CC1 124474518 UDCLLDJBPDFGPB-SNVBAGLBSA-N 280.280 1.455 5 50 CDBA CC[C@@H](O)[C@H]1CC(c2ccc([N+](=O)[O-])cc2)=NO1 4576763 MFUIMKPWEBKXMS-VXGBXAGGSA-N 250.254 1.859 5 50 CDBA CNc1nc(N2CCC(C)CC2)nc(C)c1[N+](=O)[O-] 4919523 ZMQUOVZKEGPQEI-UHFFFAOYSA-N 265.317 1.971 5 50 CDBA Cc1ocnc1CNC(=O)c1cc([N+](=O)[O-])ccc1N 170597893 PRRAAPVZPZAQKP-UHFFFAOYSA-N 276.252 1.403 5 50 CDBA O=C(Nc1nncs1)c1cccc([N+](=O)[O-])c1 127493 MEIANMMMYMSTED-UHFFFAOYSA-N 250.239 1.699 5 50 CDBA O=C(O)C(=O)Cc1ccc(Br)cc1[N+](=O)[O-] 1705011 GMHILUUZMBKBJE-UHFFFAOYSA-N 288.053 1.554 5 50 CDBA O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCc2ccccc21 1826919 YIKYJNBCZISWBO-UHFFFAOYSA-N 287.279 1.166 5 50 CDBA CCN(C[C@H]1CCOC1)C(=O)c1ccc([N+](=O)[O-])c(O)c1 169971418 MRBKJZSKCQSWSO-SNVBAGLBSA-N 294.307 1.799 5 50 CDBA Cc1cnc(N2CCc3nocc3C2)c([N+](=O)[O-])c1 585122447 HUZPATOXSQDDEZ-UHFFFAOYSA-N 260.253 1.849 5 50 CDBA C[C@@H]1CN(c2cc(N)c([N+](=O)[O-])cc2F)C[C@@H](C)N1 4623619 CNHUHUYYUWJDRI-HTQZYQBOSA-N 268.292 1.503 5 50 CDBA CCCc1[nH]nc(C(=O)N[C@H](C)C[C@@H](C)N)c1[N+](=O)[O-] 520815202 BFTCFEAQEGJFPY-HTQZYQBOSA-N 283.332 1.126 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccnn1C 175971 LUMAJONGUXQDNZ-UHFFFAOYSA-N 276.252 1.589 5 50 CDBA Cc1ccc([N+](=O)[O-])c(OCCON2C(=O)CCC2=O)c1 2868494 OREIHGKBKHRNIG-UHFFFAOYSA-N 294.263 1.363 5 50 CDBA Cc1nnnn1CCCOc1ccc([N+](=O)[O-])cc1 123290784 QTKQLSKINYYMDU-UHFFFAOYSA-N 263.257 1.359 5 50 CDBA O=[N+]([O-])c1cccnc1N[C@H](CO)Cc1nccs1 1615587669 PSIKAWTWRBMECJ-QMMMGPOBSA-N 280.309 1.462 5 50 CDBA NC(=O)c1ccc(NCc2ccco2)c([N+](=O)[O-])c1 4755269 MJYYELMTGSJDCZ-UHFFFAOYSA-N 261.237 1.899 5 50 CDBA Cn1cnnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1 4094125 BVYNLTLYSPRAKS-UHFFFAOYSA-N 293.308 1.454 5 50 CDBA C[C@@H]1OCC[C@@]12CN(Cc1cccc([N+](=O)[O-])c1)CCO2 280520182 RUUBJRNFDVDGFS-SWLSCSKDSA-N 292.335 1.975 5 50 CDBA O=C(c1cn[nH]c1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188565816 NIWJVTKFRQZQQC-UHFFFAOYSA-N 288.263 1.221 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N[C@@H]2C(=O)NCC[C@@H]2C)c1 193521118 DPMHQENPDNDFIP-CABZTGNLSA-N 263.297 1.840 5 50 CDBA O=c1c2ccccc2oc2nc3n(c(=O)c12)CCCS3 25784 BLSDBWLPHJIFMF-UHFFFAOYSA-N 286.312 1.999 5 50 CDBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCCO1 375712 AYUPVFAVNLZROP-JTQLQIEISA-N 254.217 1.851 5 50 CDBA Cc1c(CNC(=O)c2ccc([N+](=O)[O-])cc2)cnn1C 474340 NFCUJFGJUJUFPV-UHFFFAOYSA-N 274.280 1.567 5 50 CDBA O=C(OC[C@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])cc1 4991852 FCZLLBHKMMATSX-SECBINFHSA-N 299.304 1.186 5 50 CDBA O=[N+]([O-])c1ccc2c(CN3CCNCC3)c[nH]c2c1 261507079 FBTAVBSOEZTENF-UHFFFAOYSA-N 260.297 1.481 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)c2ncccc12 3877851 OZWSRMISPRQBSV-UHFFFAOYSA-N 259.265 1.980 5 50 CDBA C[C@@H](CCCO)N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 239782577 CPKDXGJMVXIOES-UWVGGRQHSA-N 267.329 1.989 5 50 CDBA CCN1CCN(c2c(F)cccc2[N+](=O)[O-])CC1 238791141 MMKRSZIZGVYLFQ-UHFFFAOYSA-N 253.277 1.876 5 50 CDBA CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] 170615559 CTNDNCDTPQYZDA-UHFFFAOYSA-N 266.225 1.633 5 50 CDBA Cc1ccc(C(=O)NC[C@H]2CCCO2)cc1[N+](=O)[O-] 253006 QTHQJTJJXKENIK-LLVKDONJSA-N 264.281 1.812 5 50 CDBA COC[C@@H](C)NCc1cc2c(cc1[N+](=O)[O-])OCO2 4997336 PSFXBQOKVMDECA-MRVPVSSYSA-N 268.269 1.448 5 50 CDBA C[C@H]1CC(O)C[C@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1 170605832 HNWOWMCAJDWGCQ-QWRGUYRKSA-N 292.335 1.898 5 50 CDBA CO[C@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@@H]1OC 300172555 CJNSEXMRGCUQSS-RYUDHWBXSA-N 298.270 1.220 5 50 CDBA C[C@H]1CN(c2cc(N)c([N+](=O)[O-])cc2F)C[C@@H](C)N1 4623615 CNHUHUYYUWJDRI-OCAPTIKFSA-N 268.292 1.503 5 50 CDBA C[C@H](N[C@H](C)CCCO)c1ccc(N)c([N+](=O)[O-])c1 239782579 CPKDXGJMVXIOES-ZJUUUORDSA-N 267.329 1.989 5 50 CDBA Cc1c([N+](=O)[O-])c(=O)n(Cc2ccccc2F)n1C 498051089 OSFKDAFSOAFLGH-UHFFFAOYSA-N 265.244 1.591 5 50 CDBA Cc1ccnc(N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1 225537510 NGKUPWUKOGBESQ-UHFFFAOYSA-N 286.291 1.961 5 50 CDBA O=C(NOCCC(F)(F)F)c1cc([N+](=O)[O-])ccc1O 154957279 AVHIUWRTKAIYND-UHFFFAOYSA-N 294.185 1.914 5 50 CDBA COc1cccc(NCc2ccc(C(N)=O)o2)c1[N+](=O)[O-] 185514924 AWBAGRDSBIHPPB-UHFFFAOYSA-N 291.263 1.907 5 50 CDBA C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H]1O 170604766 XKNRRKQPKBVCKI-PRHODGIISA-N 279.296 1.020 5 50 CDBA Cc1cc(C)n(-c2ccc([N+](=O)[O-])cc2-c2nnn[nH]2)n1 12446108 QQASLULXJUJQOE-UHFFFAOYSA-N 285.267 1.577 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCOCC2)c1 57351657 CVSCKLCYFWYQTA-UHFFFAOYSA-N 266.253 1.218 5 50 CDBA O=C1N=CC=C[C@@H]1c1noc(-c2ccc([N+](=O)[O-])cc2)n1 253416002 ZPOLYFUTDMLBHK-SNVBAGLBSA-N 284.231 1.896 5 50 CDBA COC(=O)[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C[C@@H]1C 276973476 UBSJOUWYXDDDBU-GXSJLCMTSA-N 279.296 1.625 5 50 CDBA COc1cccc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])c1OC 90311 UBUCSYPYCYYISP-CABZTGNLSA-N 280.280 1.300 5 50 CDBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCNCCO 4045604 WGWFIJQRKSWNLJ-UHFFFAOYSA-N 293.245 1.607 5 50 CDBA O=C(O)[C@@H]1C[C@@H](Cc2cccc([N+](=O)[O-])c2)CN1 4241402 LGBDRRRFTLQEHU-KOLCDFICSA-N 250.254 1.200 5 50 CDBA CCOC(=O)c1cc(C)c([N+](=O)[O-])cc1[N+](=O)[O-] 113736091 IUNWYBCKKXSNTK-UHFFFAOYSA-N 254.198 1.988 5 50 CDBA C[C@@H](O)CCN(C)C(=O)c1ccc(O)c([N+](=O)[O-])c1 119121577 BBSMEOMKDASPEK-MRVPVSSYSA-N 268.269 1.143 5 50 CDBA CC(C)CNC(=S)NC(=O)c1cccc([N+](=O)[O-])c1 2892001 YZIFMAWJESZQSY-UHFFFAOYSA-N 281.337 1.855 5 50 CDBA CCOc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 3880411 XPJPHQASENFHGZ-UHFFFAOYSA-N 252.270 1.830 5 50 CDBA Cc1cc([N+](=O)[O-])c2nc(Cl)c(C)c(=O)n2c1 725244948 OHEJBSJWOXRSPX-UHFFFAOYSA-N 253.645 1.873 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1Cc2cnn(C)c2C1 585132716 OXSSUHMFTXFBAL-UHFFFAOYSA-N 259.269 1.552 5 50 CDBA C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1nn(C)cc1O 1616036526 XGTYPCCBQBDKOS-SSDOTTSWSA-N 263.257 1.602 5 50 CDBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 30493500 HZOLXAZFSIJXGC-UHFFFAOYSA-N 286.309 1.388 5 50 CDBA in-vitro Cc1nn(CC(=O)NCc2ccccc2)c(C)c1[N+](=O)[O-] 197058 HJHZBRQYGANODP-UHFFFAOYSA-N 288.307 1.725 5 50 CDBA O=[N+]([O-])c1cccc(CN2CCOC23COC3)c1 211332842 UGJHAJQCLLDTAG-UHFFFAOYSA-N 250.254 1.154 5 50 CDBA NCCCCn1cc(-c2cccc([N+](=O)[O-])c2)nn1 219653913 VUZNHJRCHGAGEQ-UHFFFAOYSA-N 261.285 1.592 5 50 CDBA O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(F)nc1F 170610462 FUUWDBMOYCKSNU-UHFFFAOYSA-N 297.221 1.493 5 50 CDBA Cc1nn(CC(=O)Nc2ccccn2)c(C)c1[N+](=O)[O-] 17355390 WBUNGEZQEMCHJZ-UHFFFAOYSA-N 275.268 1.442 5 50 CDBA O=c1c2c([N+](=O)[O-])cc([N+](=O)[O-])cc2nc2ccccn12 2880603 JVJPGKWTTUJPCN-UHFFFAOYSA-N 286.203 1.664 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccccc1F 1423494 GZOKRJIJPOWZGB-UHFFFAOYSA-N 264.216 1.569 5 50 CDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)C(C)C 194982278 JSOFRFCPUPTJMD-JTQLQIEISA-N 268.317 1.684 5 50 CDBA COC(=O)/C=C/S(=O)(=O)c1ccccc1[N+](=O)[O-] 458719 IOSRCEOXBWYESM-VOTSOKGWSA-N 271.250 1.055 5 50 CDBA O=C(CCC(=O)N1CCCC1)Nc1ccc([N+](=O)[O-])cc1 4598739 DYUWOEYEOMZPFX-UHFFFAOYSA-N 291.307 1.936 5 50 CDBA C[C@H](NCC(=O)N1CCOCC1)c1ccccc1[N+](=O)[O-] 253393942 YYZVHXZBOWACOP-NSHDSACASA-N 293.323 1.104 5 50 CDBA COc1ccnc(Cn2ccnc2[N+](=O)[O-])c1OC 863949234 YGFVXTBZWFKWFW-UHFFFAOYSA-N 264.241 1.252 5 50 CDBA C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1CCOC1 170005543 WBWSDNIYWQGRFV-WCBMZHEXSA-N 280.280 1.455 5 50 CDBA CN1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 116268906 FKPIEGDOUDQGFH-UHFFFAOYSA-N 269.732 1.996 5 50 CDBA Cc1cc(C)nc(NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)n1 1432074 MDBYQYNHUWHPIK-VIFPVBQESA-N 290.283 1.398 5 50 CDBA O=c1oc2cc([N+](=O)[O-])ccc2n1CN1CCCCC1 33177 HSOUZZCVNFAIKP-UHFFFAOYSA-N 277.280 1.946 5 50 CDBA O=[N+]([O-])C[C@H](O)c1c(F)c(F)c(F)c(F)c1F 1705326 JATSBNOGFCYNOT-REOHCLBHSA-N 257.114 1.692 5 50 CDBA CC1CCN(c2ccc([N+](=O)[O-])cc2C(N)=O)CC1 4755457 MHMLFZKDNDROCA-UHFFFAOYSA-N 263.297 1.930 5 50 CDBA CCc1nnc(CN2CCc3ccc([N+](=O)[O-])cc32)n1C 170594693 ZRCLMKHYDHCNBA-UHFFFAOYSA-N 287.323 1.848 5 50 CDBA CCc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N)n(C)n1 191674102 KPAPSJRSFVEMJS-UHFFFAOYSA-N 289.295 1.725 5 50 CDBA CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCC[C@@H](C(N)=O)C1 192612535 STDZBWOIXMYQIP-NXEZZACHSA-N 295.343 1.576 5 50 CDBA O=[N+]([O-])c1c(Br)n[nH]c1Br 14007756 HUEFSFAVCVCTAX-UHFFFAOYSA-N 270.868 1.843 5 50 CDBA in-vitro COc1cc(CN2CCC[C@H]2CO)c([N+](=O)[O-])cc1OC 16662680 OIDTUERXEMTVOY-NSHDSACASA-N 296.323 1.569 5 50 CDBA O=[N+]([O-])c1ccc(N2CC[C@H]([C@@H](O)C(F)(F)F)C2)cn1 450885806 VICVZIUQHRHQKJ-OIBJUYFYSA-N 291.229 1.739 5 50 CDBA COC(=O)c1ccc(C(F)(F)F)c([N+](=O)[O-])c1N 117985398 DQZRQVGFBFXRRX-UHFFFAOYSA-N 264.159 1.982 5 50 CDBA Cn1cnc([N+](=O)[O-])c1Sc1cn2c(n1)CCC2 285521 LWCYHHMYVMUFEE-UHFFFAOYSA-N 265.298 1.622 5 50 CDBA O=C(O)[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 4237845 JVYAJIFDTIREQQ-ZETCQYMHSA-N 250.210 1.032 5 50 CDBA CC1=C[C@H](C)[C@H]2C(=O)N(CCC[N+](C)(C)C)C(=O)[C@H]2C1 96129682 GOEBHGSAJXXUNJ-MELADBBJSA-N 279.404 1.670 5 50 CDBA biogenic CS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1CCCC1 95495685 UDZHJBLGRXJPOC-UHFFFAOYSA-N 270.310 1.599 5 50 CDBA CCS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1OC 475278 LUYKSVCFVADRSP-UHFFFAOYSA-N 260.271 1.365 5 50 CDBA COc1cc(C(=O)O)c(NC(C)=O)cc1[N+](=O)[O-] 42684197 QWIICWOSUUZYES-UHFFFAOYSA-N 254.198 1.260 5 50 CDBA in-vitro COc1cccc([N+](=O)[O-])c1NCC1(CO)CCOCC1 408516862 YWRZKYBHWBIPCF-UHFFFAOYSA-N 296.323 1.804 5 50 CDBA COc1cc(N2CC3(COC3)C2)ccc1[N+](=O)[O-] 2069797344 DCRDZRIDSPQRRI-UHFFFAOYSA-N 250.254 1.440 5 50 CDBA O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccncc1 616066 BFIZYNCANPJGGU-UHFFFAOYSA-N 287.275 1.685 5 50 CDBA NC(=O)c1ccc(I)c([N+](=O)[O-])c1 33963533 MDOJTZQKHMAPBK-UHFFFAOYSA-N 292.032 1.298 5 50 CDBA investigational NC(=O)CSc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 13108942 QAHCHBQWSGRIGB-UHFFFAOYSA-N 278.293 1.562 5 50 CDBA CN(C)[C@@H]1CCC[C@H]1Nc1ncc([N+](=O)[O-])cn1 585117937 DTFSRKGLVPVBAK-NXEZZACHSA-N 251.290 1.279 5 50 CDBA CC[C@@H](COC)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 119025190 VTZMZZVGJNTEPR-VIFPVBQESA-N 268.269 1.455 5 50 CDBA CN1C(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)N(C)C1=S 35349218 IKYDEVXECLBIJQ-TWGQIWQCSA-N 293.304 1.330 5 50 CDBA C[C@@H]1CC(NC(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@@H](C)C1 286443546 LVCTYBZCDNAZPQ-YUMQZZPRSA-N 266.301 1.872 5 50 CDBA O=C1O[C@@H](Cn2nccc2[N+](=O)[O-])CN1c1ccccc1 163653570 UASYPDZHDQKMCT-LLVKDONJSA-N 288.263 1.817 5 50 CDBA O=[N+]([O-])c1ccc(N[C@H](CO)Cc2nccs2)nc1 1615585700 AREOCSFZDWNVHG-QMMMGPOBSA-N 280.309 1.462 5 50 CDBA CC[S@@](=O)CCNc1cc(N)ccc1[N+](=O)[O-] 800849356 CFSLSDOVARDXKU-QGZVFWFLSA-N 257.315 1.358 5 50 CDBA Cc1cc(Br)cc(C(N)=O)c1[N+](=O)[O-] 307164089 GKXIMXGIYINISS-UHFFFAOYSA-N 259.059 1.765 5 50 CDBA COC(=O)c1ccn(COc2ccccc2[N+](=O)[O-])n1 32368 AKFRSTHVUBVTSU-UHFFFAOYSA-N 277.236 1.614 5 50 CDBA COCc1nn(Cc2ccc([N+](=O)[O-])c(F)c2)c(=O)o1 170605618 CYORURATLSIZCV-UHFFFAOYSA-N 283.215 1.078 5 50 CDBA O=[N+]([O-])c1cc(CN2CCC[C@@H](O)C2)ccc1O 16662691 PGWIVESVDPNWPU-SNVBAGLBSA-N 252.270 1.257 5 50 CDBA COC[C@H]1CCCN1C(=O)c1cccc([N+](=O)[O-])c1O 156555707 VYULYPWBKHRTFH-SECBINFHSA-N 280.280 1.551 5 50 CDBA O=C(O)[C@H]1CS[C@H](c2ccc(O)c([N+](=O)[O-])c2)N1 85496 WHTBIMRPVIAQET-HZGVNTEJSA-N 270.266 1.089 5 50 CDBA Cc1nc([N+](=O)[O-])nn1C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 102729408 RKRKBJUVKNPZKH-ITSCGTHASA-N 278.312 1.535 5 50 CDBA O=C(O)[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1 4237844 JVYAJIFDTIREQQ-SSDOTTSWSA-N 250.210 1.032 5 50 CDBA O=[N+]([O-])c1ccc(I)cc1O 34224533 NWDXJGPGCDHUJO-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA Nc1cc(CC(=O)NC[C@H]2CCCO2)ccc1[N+](=O)[O-] 408515235 MEHXFUDFVDRJNP-SNVBAGLBSA-N 279.296 1.015 5 50 CDBA C[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)[C@@H](C(N)=O)C1 1615588184 YLTODGITGGNGHI-PSASIEDQSA-N 264.285 1.080 5 50 CDBA O=C(NCc1ccncc1)c1ccc([N+](=O)[O-])cc1 2745009 DMVJAZBVAHBZNK-UHFFFAOYSA-N 257.249 1.920 5 50 CDBA Cc1ccnc(N2CC(NC3CCOCC3)C2)c1[N+](=O)[O-] 1307209011 QZDNSFLXIKNIPE-UHFFFAOYSA-N 292.339 1.255 5 50 CDBA Cc1ccnc(NC[C@H](O)c2cncs2)c1[N+](=O)[O-] 1615003626 YTVFKTNKXHGINL-QMMMGPOBSA-N 280.309 1.900 5 50 CDBA O=[N+]([O-])c1ccccc1OCCOCCn1cncn1 5013312 DCPPYROSCPHZGK-UHFFFAOYSA-N 278.268 1.282 5 50 CDBA CCN1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1 303973 VZQTXZQPKCGCDD-UHFFFAOYSA-N 293.323 1.381 5 50 CDBA Cc1ccc(OCCN2CCN(C)CC2)c([N+](=O)[O-])c1 20118624 GQPPEZBDSBAORQ-UHFFFAOYSA-N 279.340 1.529 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)NC2CCCCCC2)n1 483219 OYQTWLRRGFKZSA-UHFFFAOYSA-N 266.301 1.781 5 50 CDBA O=[N+]([O-])c1cnc2ccc(I)cn12 89202021 VJONIPFOBPBPTF-UHFFFAOYSA-N 289.032 1.847 5 50 CDBA CN1CCN=C1CCN(C)c1ccc([N+](=O)[O-])cn1 1775989134 FBGFPAKSFNKFHX-UHFFFAOYSA-N 263.301 1.160 5 50 CDBA COc1cc([N+](=O)[O-])cnc1NC(=O)[C@@H](C)SC 1536162273 BBMPCBLDKCJUSP-ZCFIWIBFSA-N 271.298 1.688 5 50 CDBA COc1cccc(N[C@@H](C)C[S@](C)=O)c1[N+](=O)[O-] 169041523 CJSOZBUGDNUKRV-DCXZOGHSSA-N 272.326 1.782 5 50 CDBA COc1cccc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])c1OC 90319 UBUCSYPYCYYISP-BXKDBHETSA-N 280.280 1.300 5 50 CDBA NS(=O)(=O)c1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1 3880520 FSSLALWOTRNRTI-UHFFFAOYSA-N 294.292 1.381 5 50 CDBA CN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)N(C)C1=S 4903314 RKENABXMBFXRSI-YFHOEESVSA-N 277.305 1.624 5 50 CDBA CC(C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(F)(F)F 294418359 NVCNSAWQNCQLAD-UHFFFAOYSA-N 280.206 1.248 5 50 CDBA CN1C[C@H](c2noc(-c3ccc([N+](=O)[O-])cc3)n2)CC1=O 225597398 JZAUABLXFACSEZ-SECBINFHSA-N 288.263 1.591 5 50 CDBA Cn1ccc(NCCNc2ncc([N+](=O)[O-])cc2Cl)n1 225648841 HENRJVBJVZWZQZ-UHFFFAOYSA-N 296.718 1.901 5 50 CDBA O=[N+]([O-])c1ccc(Cl)cc1NCCN1CCOCC1 19849686 LKGMCEFONLDCJO-UHFFFAOYSA-N 285.731 1.992 5 50 CDBA CCn1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)cn1 372996 KQPHELBLWOMOPP-UHFFFAOYSA-N 274.280 1.741 5 50 CDBA CNC(=O)N[C@H]1CCCN(c2cc(C)c([N+](=O)[O-])cn2)C1 952993339 GNNMEVKLWRZQJR-JTQLQIEISA-N 293.327 1.196 5 50 CDBA O=C(O)[C@H]1CCCN1C(=O)Nc1cccc([N+](=O)[O-])c1 21508383 XNMYLMZWZVVLTE-SNVBAGLBSA-N 279.252 1.676 5 50 CDBA Cc1csc(=NCCN=c2ccc([N+](=O)[O-])c(C)[nH]2)[nH]1 408523441 KBYGWJVQOZOLQX-UHFFFAOYSA-N 293.352 1.431 5 50 CDBA Cc1nn(CC(=O)Nc2ccc(O)cc2)c(C)c1[N+](=O)[O-] 1070967 XVDQQQZIHMKFOM-UHFFFAOYSA-N 290.279 1.752 5 50 CDBA CCC(=O)NC(=S)Nc1ccc([N+](=O)[O-])cc1OC 4091613 AHYGNQQQOCJVNS-UHFFFAOYSA-N 283.309 1.826 5 50 CDBA CCCO[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 241784814 RWYYMXCUPZFUMP-GMTAPVOTSA-N 256.302 1.069 5 50 CDBA CC(C)(C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 4369141 UHFXZEXYBBMXBY-UHFFFAOYSA-N 258.299 1.672 5 50 CDBA in-vitro COCCCNC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1 2898807 GHHQOAXSDDRZPT-UHFFFAOYSA-N 297.336 1.236 5 50 CDBA CC1(C)O[C@H]1COC(=O)c1ccc([N+](=O)[O-])cc1 4521433 NNRORFCMFJMIKM-JTQLQIEISA-N 251.238 1.929 5 50 CDBA CN(CC1CCOCC1)C(=O)c1ccc(O)c([N+](=O)[O-])c1 119654964 CABNWDSLEVHAQJ-UHFFFAOYSA-N 294.307 1.799 5 50 CDBA C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1cc[nH]n1 1875259781 GFHVZOYVDIXSTE-QMMMGPOBSA-N 296.308 1.357 5 50 CDBA CCOC[C@@H](O)COc1c(C)cc(C)cc1[N+](=O)[O-] 193824725 VSICKHPOXWEFDP-LLVKDONJSA-N 269.297 1.988 5 50 CDBA O=C(O)C[S@@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 1140322 YRJUVGJXBGUUER-IBGZPJMESA-N 297.210 1.806 5 50 CDBA in-vitro O=C(O)[C@@H]1CS[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N1 85501 WHTBIMRPVIAQET-RCOVLWMOSA-N 270.266 1.089 5 50 CDBA COC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 123346 XNJVTNSOVUSNRD-UHFFFAOYSA-N 272.644 1.151 5 50 CDBA biogenic,in-vitro COC(=O)c1ccc(/C=C/C(=O)O)c([N+](=O)[O-])c1 44201272 OBXIHACULRGOCJ-SNAWJCMRSA-N 251.194 1.479 5 50 CDBA CN1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 4043673 ZEBGUAUODJBFEV-UHFFFAOYSA-N 266.257 1.255 5 50 CDBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CCC(=O)O 262643218 JKJJYUCQVIXEEP-VIFPVBQESA-N 295.295 1.328 5 50 CDBA COCCCNC(=O)c1cccc([N+](=O)[O-])c1O 130317905 UAEQCZDAJSEHNK-UHFFFAOYSA-N 254.242 1.067 5 50 CDBA Cc1n[nH]c(SCC(=O)c2cccc([N+](=O)[O-])c2)n1 18167998 DFXJQXNRQUMQRP-UHFFFAOYSA-N 278.293 1.996 5 50 CDBA Cn1cnc([N+](=O)[O-])c1N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 407979782 AWMLDOKRYPQFHE-IVZWLZJFSA-N 278.312 1.698 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccccn1 2807331 CZEHKIUGPXTYIO-UHFFFAOYSA-N 261.241 1.133 5 50 CDBA COc1cc([C@H](C)O)c([N+](=O)[O-])cc1OCCCC(=O)O 4521581 DUIJUTBRRZCWRD-QMMMGPOBSA-N 299.279 1.900 5 50 CDBA in-vitro O=C(O)[C@H]1CS[C@@H](c2cccc([N+](=O)[O-])c2)N1 77917 SALHXESGFYVCIK-BDAKNGLRSA-N 254.267 1.383 5 50 CDBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@]2(CCOC2)C1 155209823 QIUQNGPHHMMMKX-CQSZACIVSA-N 292.291 1.553 5 50 CDBA C[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@@H](C)N1C 294123110 ZUNQRRHMTVXZSR-AOOOYVTPSA-N 293.323 1.465 5 50 CDBA CN=[S@@](C)(=O)CCNc1nccc(C)c1[N+](=O)[O-] 952874856 WSTPDIYWRNSQKJ-SFHVURJKSA-N 272.330 1.438 5 50 CDBA C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)O1 13303255 HHMVWMCEDGWZPS-OCAPTIKFSA-N 254.242 1.437 5 50 CDBA Nc1cc(N2CCC(CO)CC2)ccc1[N+](=O)[O-] 236344335 FMRSMKOZUFIELK-UHFFFAOYSA-N 251.286 1.386 5 50 CDBA Cn1nc([N+](=O)[O-])nc1Oc1ccc2ccc(=O)oc2c1 111880 DYAKISXVUGXZQO-UHFFFAOYSA-N 288.219 1.622 5 50 CDBA CCOc1cc([N+](=O)[O-])c2[nH]c3c(c2c1)CCNC3=O 210104 YZLCWECERJJGFO-UHFFFAOYSA-N 275.264 1.761 5 50 CDBA CCC(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1 456097 ABZWIUAXRUJNRU-UHFFFAOYSA-N 253.283 1.818 5 50 CDBA CCOC(=O)C(Cc1ccccc1[N+](=O)[O-])C(=O)OCC 1748877 XKWHIUXRQYXRSG-UHFFFAOYSA-N 295.291 1.880 5 50 CDBA C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1O 170604765 XKNRRKQPKBVCKI-UFBFGSQYSA-N 279.296 1.020 5 50 CDBA O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CCCO1 19991907 CTAHUEVTRDBKHX-SNVBAGLBSA-N 252.226 1.418 5 50 CDBA CC(C)CNCCOC(=O)c1cccc([N+](=O)[O-])c1 2168176 YJMBUSCJOSPCPS-UHFFFAOYSA-N 266.297 1.997 5 50 CDBA Cc1cc(C)n(C(=O)c2nn(C)c(C)c2[N+](=O)[O-])n1 376125 MHBBFBGUYPLMSB-UHFFFAOYSA-N 263.257 1.139 5 50 CDBA NC1(CNc2ncc([N+](=O)[O-])cc2Cl)CCC1 236198792 LLLPKJKKLXLELO-UHFFFAOYSA-N 256.693 1.937 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 211950789 SBQFRYVZSCKFQW-OUJBWJOFSA-N 294.332 1.838 5 50 CDBA O=[N+]([O-])c1ccc(N2CCN(CCF)CC2)nc1 1149352272 RZVHDVDUTOTUQO-UHFFFAOYSA-N 254.265 1.081 5 50 CDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1CCCO[C@H](C)C1 408522946 FHLQZHSVSQJGMI-SNVBAGLBSA-N 294.307 1.997 5 50 CDBA COC[C@H]1C[C@@H](O)CN1Cc1cc([N+](=O)[O-])ccc1F 1615587977 MQWPLZRTKHJFRH-VXGBXAGGSA-N 284.287 1.316 5 50 CDBA O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1CCO 4381484 DZWAVLDRXDPZOM-UHFFFAOYSA-N 286.243 1.336 5 50 CDBA Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@](C)(O)C1CC1 585089765 TVOANFMNLIQPJX-CQSZACIVSA-N 296.298 1.933 5 50 CDBA C[C@@H](O)CNCCNc1ccc([N+](=O)[O-])c2cccnc12 4045819 KYGLWXLOXYFWLV-SNVBAGLBSA-N 290.323 1.525 5 50 CDBA O=[N+]([O-])c1cncc([N+](=O)[O-])c1NCc1cccnc1 22033293 AFUDJPPRSGYSPK-UHFFFAOYSA-N 275.224 1.905 5 50 CDBA Cc1cc(C(=O)NCc2cn(C)nc2C)ccc1[N+](=O)[O-] 999342 NCOXVDBKNKZQMG-UHFFFAOYSA-N 288.307 1.875 5 50 CDBA O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)NC2=O 2909363 KUHXKQLGVUDBKC-UHFFFAOYSA-N 296.238 1.709 5 50 CDBA CC[C@@H](CO)Nc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 4081294 QRJVLGKRJMNHPD-NSHDSACASA-N 295.339 1.614 5 50 CDBA CCN(CC)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 19848348 ZRRXXXGBVDGATC-LBPRGKRZSA-N 291.307 1.569 5 50 CDBA Cc1cc(C)n(-c2cc([N+](=O)[O-])ccc2-c2nnn[nH]2)n1 12446086 KYCOMSAAUPTACB-UHFFFAOYSA-N 285.267 1.577 5 50 CDBA CC(C)NC[C@@H]1CCc2cc(CO)c([N+](=O)[O-])cc2N1 896836 XCGYUJZMCCFSRP-LBPRGKRZSA-N 279.340 1.812 5 50 CDBA biogenic,world Cc1ccc(/C=C\c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)o1 32690914 FHJNVNQHBXQUCN-PLNGDYQASA-N 263.209 1.456 5 50 CDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1cccc([N+](=O)[O-])c1 239203400 SHPJSIUHFNHXFW-RBJBARPLSA-N 284.271 1.906 5 50 CDBA O=C1NN(c2ccc([N+](=O)[O-])cc2)C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@@H]12 169684982 KSKYUERSKUVUJX-RBJBARPLSA-N 299.286 1.411 5 50 CDBA CC1CCN(C(=O)Cn2cnc([N+](=O)[O-])c2)CC1 336299 QZYDZNJQQUDTKY-UHFFFAOYSA-N 252.274 1.050 5 50 CDBA COCCCNC(=S)NC(=O)c1cccc([N+](=O)[O-])c1 2898819 TVZQBWHUOHEXCZ-UHFFFAOYSA-N 297.336 1.236 5 50 CDBA CNc1nccc(C(=O)NC[C@H](C)C[C@H](C)O)c1[N+](=O)[O-] 253417918 XSACCPYUQDSDFQ-BDAKNGLRSA-N 296.327 1.168 5 50 CDBA COC[C@@H](Nc1ccc([N+](=O)[O-])cn1)[C@H]1CCCO1 225714417 NBIGRCVIIPSXPU-GHMZBOCLSA-N 267.285 1.596 5 50 CDBA O=[N+]([O-])c1cccnc1NC1CC(N2CCOCC2)C1 585092089 DUFVGJMWRDAVNB-UHFFFAOYSA-N 278.312 1.265 5 50 CDBA COC(=O)C1=C(C)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1 256332 RZCSIXRGZZQPRO-LLVKDONJSA-N 290.275 1.645 5 50 CDBA CNc1nccc(C(=O)NC[C@@H](C)C[C@@H](C)O)c1[N+](=O)[O-] 253417923 XSACCPYUQDSDFQ-DTWKUNHWSA-N 296.327 1.168 5 50 CDBA O=[N+]([O-])c1cc(Br)ccc1NCCO 19985714 MELNSLNFQOOTKK-UHFFFAOYSA-N 261.075 1.762 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(F)ccc1F 1071211 YRUJUWXXJIBMAW-UHFFFAOYSA-N 282.206 1.708 5 50 CDBA CSCCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4974107 CZBMVJWMBQEAFA-UHFFFAOYSA-N 290.366 1.545 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCN(C)C 163218578 DDLFNYJUTURXDF-UHFFFAOYSA-N 280.328 1.929 5 50 CDBA Cc1cc(N2CCN(C[C@@H](C)O)C[C@H]2C)ncc1[N+](=O)[O-] 225403253 RRKMGSZRNLSUQH-VXGBXAGGSA-N 294.355 1.190 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cccnc1 435245 GAUNFWFOWZDLPI-UHFFFAOYSA-N 283.243 1.786 5 50 CDBA COC[C@@H](C)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 2840099 UXMQZCOOEAIZFO-VQCYPWCPSA-N 264.281 1.759 5 50 CDBA NC(=O)c1cncc(Oc2ccc([N+](=O)[O-])cc2)c1 253426186 PKARPEHVZWZUMN-UHFFFAOYSA-N 259.221 1.881 5 50 CDBA O=[N+]([O-])c1ccc2c(c1N1C[C@@H]3CC[C@H](C1)O3)CCN2 365531079 CBABSUJHKHHATP-AOOOYVTPSA-N 275.308 1.930 5 50 CDBA O=C(N[C@@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 3085976 OHNCQODQPDYKMG-VXGBXAGGSA-N 264.281 1.628 5 50 CDBA O=[N+]([O-])c1ccc([C@@]2(O)NN=C3CCCCCN32)cc1 3187571 CGBIUFFMZYJUNM-CYBMUJFWSA-N 276.296 1.490 5 50 CDBA CC[N@+]1(C)[C@@H](c2ccc(OC)c(OC)c2)[C@@H](O)[C@H](O)[C@H]1C 252441334 QIVWXVZLBPQWKQ-XHLKGYDDSA-N 296.387 1.335 5 50 CDBA biogenic CSc1ccc(C(=O)N2C[C@H](O)C[C@@H]2C)cc1[N+](=O)[O-] 170089374 BNPXOOAGPKGZSI-WCBMZHEXSA-N 296.348 1.912 5 50 CDBA CCS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4619721 XSWAQALONDYXEG-UHFFFAOYSA-N 299.352 1.067 5 50 CDBA CCNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 5045878 VUBCPDLPDLXFOL-UHFFFAOYSA-N 264.690 1.546 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)NC1CCCCCC1 1428150 XKZIKNVHWNPJBG-UHFFFAOYSA-N 266.301 1.630 5 50 CDBA C[C@@H](O)C[C@H]1CCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164994757 LHJPQOWTWRVOEQ-MWLCHTKSSA-N 294.307 1.676 5 50 CDBA COc1ccc([N+](=O)[O-])cc1/C=C1/SC(=O)NC1=O 2891571 DZRRZWNEPYPEHH-WEVVVXLNSA-N 280.261 1.927 5 50 CDBA CC(=O)NCCNc1ccc(Cl)cc1[N+](=O)[O-] 4506966 KRZUBFRGLDYGHZ-UHFFFAOYSA-N 257.677 1.796 5 50 CDBA O=[N+]([O-])c1ccc([C@]2(O)NN=C3CCCCCN32)cc1 3187572 CGBIUFFMZYJUNM-ZDUSSCGKSA-N 276.296 1.490 5 50 CDBA Cc1ccnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 1423497 KLTCDVUEEPWAJB-UHFFFAOYSA-N 261.241 1.133 5 50 CDBA CC(C)N(CCOCCO)c1ncccc1[N+](=O)[O-] 225778688 WDXFGDQSHZHJBQ-UHFFFAOYSA-N 269.301 1.214 5 50 CDBA CC(C)(C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 187093 OZVQKJSICMYVSR-UHFFFAOYSA-N 258.299 1.672 5 50 CDBA O=C(Nc1ccccc1[N+](=O)[O-])c1ccc(=O)oc1 5101821 SOIBGANNNPXZCM-UHFFFAOYSA-N 260.205 1.800 5 50 CDBA COc1cc(CN2CCC(O)CC2)c([N+](=O)[O-])cc1OC 22591343 MYNFDSOYJLKIMH-UHFFFAOYSA-N 296.323 1.569 5 50 CDBA CC(C)(C)OC(=O)N1CC(n2cc([N+](=O)[O-])cn2)C1 74938172 IOGPBTPTPJYTFK-UHFFFAOYSA-N 268.273 1.583 5 50 CDBA COC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 170005826 HFERDHRXCZKRPG-UHFFFAOYSA-N 268.269 1.455 5 50 CDBA O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 407999924 WOSTXSXFKBYHFD-AOZIVVCUSA-N 290.319 1.502 5 50 CDBA COc1ccc(C(=O)NC[C@@H]2CCCO2)cc1[N+](=O)[O-] 284737 FAFSASGZBUPDLR-JTQLQIEISA-N 280.280 1.512 5 50 CDBA CCN(CC)C(=S)NC(=O)c1cccc([N+](=O)[O-])c1 586847 GBGWDSSBOCFPAX-UHFFFAOYSA-N 281.337 1.951 5 50 CDBA CN(CC(=O)O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4101075 SDUKWLYCRWBFJD-UHFFFAOYSA-N 255.186 1.024 5 50 CDBA CCN1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 4486530 ZKWRDEODLSZTRM-UHFFFAOYSA-N 278.312 1.764 5 50 CDBA Cc1nc(N[C@H]2CC[C@@H](CN)C2)ncc1[N+](=O)[O-] 420273247 LVRZGFFNYGUQIG-BDAKNGLRSA-N 251.290 1.233 5 50 CDBA O=[N+]([O-])c1cc(F)ccc1N1CCC[C@@H](CO)[C@H]1CO 952994545 RBIZWKHWFPIVLB-TVQRCGJNSA-N 284.287 1.304 5 50 CDBA C[C@H]1CCCCN1[C@@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21 4845059 WBEUKNYVFYYBEX-XPTSAGLGSA-N 291.307 1.566 5 50 CDBA COc1ccc(CSCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-] 6673690 YEIKVRVZNQXQIW-UHFFFAOYSA-N 296.308 1.448 5 50 CDBA COC(=O)c1cc(Br)cc([N+](=O)[O-])c1N 67796532 AVBOYXHZYFHVJS-UHFFFAOYSA-N 275.058 1.726 5 50 CDBA NC(=O)Cc1ccc([N+](=O)[O-])cc1Br 86987756 WJJKXHFRJYEHGW-UHFFFAOYSA-N 259.059 1.385 5 50 CDBA CCCN(c1ccc([N+](=O)[O-])cc1)S(C)(=O)=O 204993365 XCTOOKPFFUTRFN-UHFFFAOYSA-N 258.299 1.771 5 50 CDBA CC(C)[C@@H](O)Cn1cc(Br)c([N+](=O)[O-])n1 300883057 NBOHSVMQKALBAH-ZETCQYMHSA-N 278.106 1.571 5 50 CDBA O=[N+]([O-])c1ncn(C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)n1 102320388 OIPFSQCTHGMSNS-WWAQEKKBSA-N 264.285 1.227 5 50 CDBA COC(=O)/C=C/c1cc(OC)c(OC)cc1[N+](=O)[O-] 65336725 ZNTYPDPRULFABN-SNAWJCMRSA-N 267.237 1.798 5 50 CDBA CC(C)C(=O)N[C@H]1CCCN(c2ncc([N+](=O)[O-])s2)C1 253425452 UCEJUEFCPNOQAN-VIFPVBQESA-N 298.368 1.792 5 50 CDBA NC(=O)c1cc(Br)c(F)c([N+](=O)[O-])c1 74937736 ZZLBLAZKHBROQT-UHFFFAOYSA-N 263.022 1.595 5 50 CDBA in-vitro O=[N+]([O-])c1cccnc1N[C@@H]1CCCN(CCF)C1 585092396 UUSAMCGPFFJRCJ-SNVBAGLBSA-N 268.292 1.836 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccccc1F 1428139 FNPDZUOSCGPETA-UHFFFAOYSA-N 278.243 1.878 5 50 CDBA Nc1c(Br)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3860913 KWMDHCLJYMVBNS-UHFFFAOYSA-N 262.019 1.848 5 50 CDBA in-vitro CCOCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 2728016 ULWDFPWCXJZVJC-UHFFFAOYSA-N 288.325 1.300 5 50 CDBA O=[N+]([O-])c1ccccc1-n1nc2c3nonc3ccc2[n+]1[O-] 4803604 UAEZCEVKQDRAJN-UHFFFAOYSA-N 298.218 1.103 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3nnn[nH]3)C2)n1 161016004 IBWALRLSGXAGOC-SECBINFHSA-N 289.299 1.195 5 50 CDBA NC(=O)CCSCc1cc([N+](=O)[O-])ccc1F 1615547269 DOYJAUFJHVAQNV-UHFFFAOYSA-N 258.274 1.843 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)N1CCc2ccccc21 1068071 KCIDAVVKMNZZRF-UHFFFAOYSA-N 272.264 1.381 5 50 CDBA Cc1c(C(=O)N[C@@H]2CCSC2=O)cccc1[N+](=O)[O-] 211124 DEQRGPSFELFOPP-SECBINFHSA-N 280.305 1.665 5 50 CDBA COC(=O)[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)C[C@@H](C)O1 253398296 SGETUGRTANGJJH-MWLCHTKSSA-N 295.295 1.065 5 50 CDBA O=[N+]([O-])c1ccccc1CN[C@H]1CC[C@H](O)CC1 252701440 DELTZHFOMFJNKL-HAQNSBGRSA-N 250.298 1.988 5 50 CDBA O=[N+]([O-])c1ccc(N2CCOCC2)cc1SCCO 4044499 UKNUPIJRXPWQFJ-UHFFFAOYSA-N 284.337 1.516 5 50 CDBA CN(C)c1n[nH]c(CNc2ncc([N+](=O)[O-])cc2Cl)n1 585132645 IXUIWGBCXKMJRI-UHFFFAOYSA-N 297.706 1.439 5 50 CDBA CCOC(=O)C(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 2310133 NZILSSCNFHBUCO-UHFFFAOYSA-N 295.276 1.706 5 50 CDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCc2cnccc21 118942625 BJNCROXEOIVTHN-UHFFFAOYSA-N 285.259 1.898 5 50 CDBA O=[N+]([O-])c1cc(F)ccc1N1CC[C@@](F)(CO)C1 253393122 SFOAGVXBESHSJV-NSHDSACASA-N 258.224 1.645 5 50 CDBA COc1cccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c1 31171 FARVKTGOMGXWBT-UHFFFAOYSA-N 262.225 1.579 5 50 CDBA Nc1nonc1-c1noc(-c2ccc([N+](=O)[O-])cc2)n1 179504 NTEZTXPVRFXPRC-UHFFFAOYSA-N 274.196 1.277 5 50 CDBA Cn1cc(CNC(=O)c2cccc([N+](=O)[O-])c2)cn1 4904049 XIHPUEOPXWFTII-UHFFFAOYSA-N 260.253 1.258 5 50 CDBA O=C(NC1[C@H]2CCC[C@H]1CN(C1CC1)C2)[C@H]1C[C@H]1[N+](=O)[O-] 252514053 AZKOFPSZWVRPFJ-XRRVDJEJSA-N 293.367 1.031 5 50 CDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCCNCC2)cc1 226462126 MLYIIFTUOQGDLJ-JTQLQIEISA-N 299.352 1.015 5 50 CDBA Cc1nc(NCCN=S(C)(C)=O)ccc1[N+](=O)[O-] 952991704 SUZMBIDJJTURBG-UHFFFAOYSA-N 272.330 1.438 5 50 CDBA C[C@H]1C[N+]2(CCS(=O)(=O)CC2)Cc2ccccc2O1 1615610601 LSMDCFLWXFSTLS-LBPRGKRZSA-N 282.385 1.213 5 50 CDBA COc1ccccc1/C=C/c1nc(O)c([N+](=O)[O-])c(=O)[nH]1 17207183 SMZTUGZITRKUQQ-VOTSOKGWSA-N 289.247 1.563 5 50 CDBA O=Cc1ccc(-c2cc3[nH]c(=O)[nH]c3cc2[N+](=O)[O-])o1 435657 BUZGQGQQDLINFF-UHFFFAOYSA-N 273.204 1.837 5 50 CDBA Cc1c(-c2nnc(S)n2C)cccc1[N+](=O)[O-] 12372506 HGRVFQHHOITPSN-UHFFFAOYSA-N 250.283 1.987 5 50 CDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])c3cccnc23)CCN1 5017303 QQBBHAASIIEVMS-SNVBAGLBSA-N 272.308 1.941 5 50 CDBA CCOC(=O)C(Oc1ccc([N+](=O)[O-])cc1)C(=O)OCC 1761779 MTUAFHSWSUJZOZ-UHFFFAOYSA-N 297.263 1.468 5 50 CDBA C=CC(=O)Nc1cc([N+](=O)[O-])ccc1N1CCN(C)CC1 222222852 UNLHQXWNOIFYOH-UHFFFAOYSA-N 290.323 1.471 5 50 CDBA Nc1ncnc(NCc2ccc3c(c2)OCO3)c1[N+](=O)[O-] 3912522 DHIMGCWQXMNGAI-UHFFFAOYSA-N 289.251 1.308 5 50 CDBA NC(=O)[C@H]1CCN(c2ccnc3c([N+](=O)[O-])cccc23)C1 432333510 BKWYOJXVRIQHNR-VIFPVBQESA-N 286.291 1.455 5 50 CDBA O=C(N[C@@H]1CC=CCC1)c1cnc(O)c([N+](=O)[O-])c1 193601196 QEJSMOMGTHDMDS-SECBINFHSA-N 263.253 1.534 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1OC 214476228 SGHKADDRNOIRKA-UHFFFAOYSA-N 270.197 1.607 5 50 CDBA CCOC(=O)c1ccc(N2CCNCC2)c([N+](=O)[O-])c1 12352195 QAGYBERSNPLRAY-UHFFFAOYSA-N 279.296 1.181 5 50 CDBA COc1ccc([C@@H]2NC(=O)N(C)C(C)=C2[N+](=O)[O-])cc1 283816 VKUFOWSTBQTLHR-NSHDSACASA-N 277.280 1.900 5 50 CDBA N=c1ncccn1CC(=O)c1cccc([N+](=O)[O-])c1 22018609 FWOTWRGTKZESCN-UHFFFAOYSA-N 258.237 1.154 5 50 CDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(F)c(F)c1 1423777 QRDZZOUXLQFEAJ-UHFFFAOYSA-N 282.206 1.708 5 50 CDBA CCC(CCC(=O)OC)(CCC(=O)OC)[N+](=O)[O-] 44125422 YTKRPDNROYTFHV-UHFFFAOYSA-N 261.274 1.318 5 50 CDBA CC(C)(C)N[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 100289058 HILZEJUHMCGOIB-LLVKDONJSA-N 291.307 1.615 5 50 CDBA N[C@@H]1CC[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@H]21 170078299 CSGQQIVXQBZHIZ-GGZOMVNGSA-N 293.298 1.543 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCO1 474438 NNPUULCEZUUSOR-LLVKDONJSA-N 266.253 1.721 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[C@@H]1CCCO1 69503 WMAWDLWRKZLWPA-VIFPVBQESA-N 276.248 1.370 5 50 CDBA CCCNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 4978099 OAQPFEREKARCAN-UHFFFAOYSA-N 251.242 1.060 5 50 CDBA COc1ccc(OCc2ncnn2C)cc1[N+](=O)[O-] 170611137 KBVMOFBSGPPKOS-UHFFFAOYSA-N 264.241 1.311 5 50 CDBA CC(=O)c1ccc(NCC(C)(CO)CO)c([N+](=O)[O-])c1 408518324 AIMDVVQXBHBSII-UHFFFAOYSA-N 282.296 1.200 5 50 CDBA O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2N1CCCCC1 4402321 AJIFEQMYRMDRJH-UHFFFAOYSA-N 295.320 1.530 5 50 CDBA COCCCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 2964868 XSXKHYMJSMLMDG-VMPITWQZSA-N 264.281 1.761 5 50 CDBA O=[N+]([O-])c1ccc(NS(=O)(=O)N2CCCCC2)cc1 4171759 KHHGUYDZFNKACA-UHFFFAOYSA-N 285.325 1.737 5 50 CDBA O=[N+]([O-])c1ccc(CCN2CC[C@]3(CNCCO3)C2)cc1 1616038528 NPJGMCCBDFVJRN-HNNXBMFYSA-N 291.351 1.202 5 50 CDBA O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)n1cccn1 1054242 CRVMXEUKMAQGFY-UHFFFAOYSA-N 285.215 1.586 5 50 CDBA C[C@H](CO)N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 284993456 YOJXTQRAJDGYKF-SECBINFHSA-N 292.295 1.457 5 50 CDBA CC1(C2CC2)CC[N+]2(CC1)CCS(=O)(=O)CC2 1775988983 XDXARHOWXKVUFY-UHFFFAOYSA-N 258.407 1.442 5 50 CDBA O=C(C1CC1)N1CCCN(c2ncc([N+](=O)[O-])s2)CC1 192542162 XNJWMIVKEIJQIO-UHFFFAOYSA-N 296.352 1.500 5 50 CDBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CC1CCC1 172901280 IHFRYZXUMMRTSO-UHFFFAOYSA-N 260.249 1.991 5 50 CDBA CC(=O)CCN(C)C(=O)c1ccc(O)c([N+](=O)[O-])c1 135186474 YABJRKGYJYJHRJ-UHFFFAOYSA-N 266.253 1.352 5 50 CDBA O=C(NCC[C@H]1CCCCO1)c1ccc(O)c([N+](=O)[O-])c1 119785266 IKTYGSHSLUAECH-LLVKDONJSA-N 294.307 1.989 5 50 CDBA COc1nc(Nc2cccc([N+](=O)[O-])c2)nc(OC)n1 281298 XXQHPVGGNYOXSK-UHFFFAOYSA-N 277.240 1.541 5 50 CDBA Cn1cc([C@H]2OCC[C@@H]2Nc2ncccc2[N+](=O)[O-])cn1 170613084 FPQSGFVQWUCENG-CMPLNLGQSA-N 289.295 1.665 5 50 CDBA COc1ccc([N+](=O)[O-])c(I)n1 167723198 WBTMVYPHMGGMJK-UHFFFAOYSA-N 280.021 1.603 5 50 CDBA O=[N+]([O-])c1ccnn1Cc1ncoc1C(F)(F)F 1775993124 ZWMXTSXVLUAMOS-UHFFFAOYSA-N 262.147 1.846 5 50 CDBA CCC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C 1875324066 FUOWITCNCMOKEA-UHFFFAOYSA-N 286.309 1.427 5 50 CDBA O=C(CN1CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl 19296331 ZIVDJRRJSADUCW-UHFFFAOYSA-N 299.714 1.519 5 50 CDBA Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(Cl)cn1 1070867 QHNLBUAXPMNEJQ-UHFFFAOYSA-N 295.686 1.787 5 50 CDBA Nc1nc(SCc2ccc([N+](=O)[O-])cc2)n[nH]1 2363063 DEJVQZGMBZKGIR-UHFFFAOYSA-N 251.271 1.587 5 50 CDBA CN1CCN(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 258982 QVEBCLSPQOTMJT-UHFFFAOYSA-N 298.730 1.140 5 50 CDBA COc1ccc([N+](=O)[O-])cc1N1C(=O)c2cccnc2C1=O 367670 LKZXYRNSLYRYGC-UHFFFAOYSA-N 299.242 1.799 5 50 CDBA COC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 457097 ZZSXHZRZNTYACB-UHFFFAOYSA-N 292.291 1.620 5 50 CDBA COc1nn(Cc2ccccc2F)cc1[N+](=O)[O-] 4852995 MTSFEJCQMLGDFH-UHFFFAOYSA-N 251.217 1.987 5 50 CDBA C[C@H](O)CN(C)Nc1ccc2ncccc2c1[N+](=O)[O-] 952963882 MWCNHKMKNVKAOM-VIFPVBQESA-N 276.296 1.783 5 50 CDBA COc1ccc(C(=O)Nc2nncs2)cc1[N+](=O)[O-] 175654 GXRSMAVCRJSTKK-UHFFFAOYSA-N 280.265 1.707 5 50 CDBA C[C@H]1CCCCN1[C@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21 244866720 WBEUKNYVFYYBEX-LKFCYVNXSA-N 291.307 1.566 5 50 CDBA O=C(O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 112583 HKWNCNVBEVINPC-ZETCQYMHSA-N 250.210 1.032 5 50 CDBA in-vitro CN1C=C(C(=O)NCCC[N+](C)(C)C)C=CC1=CN=O 1848972856 AWUFUPQZTBKRDK-UHFFFAOYSA-O 279.364 1.192 5 50 CDBA Cn1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cn1 372995 BIHOOIFVGASTHM-UHFFFAOYSA-N 294.698 1.912 5 50 CDBA COc1ccc(Oc2ncnc(N)c2[N+](=O)[O-])cc1 5064198 LCIYYQHPQNKUCP-UHFFFAOYSA-N 262.225 1.768 5 50 CDBA O=[N+]([O-])c1ccc(O)c(I)c1 1726237 BKQFOYCEUMVWOW-UHFFFAOYSA-N 265.006 1.905 5 50 CDBA CC[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@H]1CCCO1 119371900 HYCGMXIDGBSXIK-GXFFZTMASA-N 294.307 1.988 5 50 CDBA CC(C)[C@@H]1C(C#N)(C#N)C(C#N)=C(N)[C@]1(C)[N+](=O)[O-] 22135327 MKNXHHJVJVVPHB-GXSJLCMTSA-N 259.269 1.078 5 50 CDBA Cc1ccc2nc3c(C(=O)O)cccn3c(=O)c2c1 35196775 PULTVJUNVUPMSG-UHFFFAOYSA-N 254.245 1.854 5 50 CDBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N(CCO)CCO 4982195 VWRKTQUZXJWOLG-UHFFFAOYSA-N 294.229 1.405 5 50 CDBA C[C@@H](O)C[C@@H]1CCCN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 164994527 LHJPQOWTWRVOEQ-KOLCDFICSA-N 294.307 1.676 5 50 CDBA O=C(O)[C@@H]1CCC[C@@H]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 314375 DAFGBJNYNSYTIU-MNOVXSKESA-N 299.304 1.622 5 50 CDBA C[C@H](C(=O)NC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 471661 KZPAKHJKISMATP-GXFFZTMASA-N 278.308 1.994 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@@H]1O 16650577 LCTLIEHXUJWWHU-OLZOCXBDSA-N 278.308 1.970 5 50 CDBA CC(=O)Nc1c(C)c(N)cc(C(=O)O)c1[N+](=O)[O-] 5336565 BTBNIDUYZBWBIO-UHFFFAOYSA-N 253.214 1.142 5 50 CDBA Cc1ccccc1OC[C@@H]1C[N+]23CCO[B-]2(OCC3)O1 195815433 XOVXHDGSBPXARE-JEYLPNPQSA-N 277.129 1.085 5 50 CDBA CN1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 4990171 VMHLKFWMWNNDPB-UHFFFAOYSA-N 269.732 1.996 5 50 CDBA CCCO[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2[N+](=O)[O-])C1 241784815 RWYYMXCUPZFUMP-OUAUKWLOSA-N 256.302 1.069 5 50 CDBA CCOC(=O)COc1ccc(/C=C/[N+](=O)[O-])cc1OC 304144 UCSPQAGORVUWGT-VOTSOKGWSA-N 281.264 1.885 5 50 CDBA O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 100321444 KQEVIRDFQKXDCH-WTTBSCSTSA-N 284.271 1.906 5 50 CDBA O=C(NCc1ccc(O)nc1)c1ccc([N+](=O)[O-])cc1 118695286 XPTPFNSYVDWVSB-UHFFFAOYSA-N 273.248 1.625 5 50 CDBA CCOC(=O)C(=O)OC[C@@H]1CCC[N@+]2(C)CCCC[C@H]12 252441183 JPHOAYNPGBNGHY-ZENOOKHLSA-N 284.376 1.502 5 50 CDBA biogenic O=[N+]([O-])c1cccnc1NCc1cn(C2CCC2)nn1 585092354 REQQMVYSNBCQBR-UHFFFAOYSA-N 274.284 1.918 5 50 CDBA Cc1ccc(N2CCN(c3ncc[nH]3)CC2)c([N+](=O)[O-])c1 225648015 GWSCLACZGCFDFG-UHFFFAOYSA-N 287.323 1.953 5 50 CDBA CNC(=O)[C@@H](NC(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C 194928796 JNWGQLARTPBZJV-LBPRGKRZSA-N 293.323 1.404 5 50 CDBA CCN(CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1 4990981 OKDWEXMXXCTNSG-UHFFFAOYSA-N 251.286 1.875 5 50 CDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](O)C1 156008839 CUMWLZKYKAWACH-JTQLQIEISA-N 265.269 1.502 5 50 CDBA Cc1cc([N+](=O)[O-])c(Cl)cc1S(N)(=O)=O 158734911 XIKYZHHBOOLVMW-UHFFFAOYSA-N 250.663 1.204 5 50 CDBA CN(CC1(O)CCCC1)C(=O)c1ccc(O)c([N+](=O)[O-])c1 119346935 NTFTUHIUJFFXRO-UHFFFAOYSA-N 294.307 1.678 5 50 CDBA O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@]2(CCOC2)C1 159431828 PRUHQEWBLZWGAH-AWEZNQCLSA-N 292.291 1.553 5 50 CDBA CCN(CC)CC(=O)Nc1cccc([N+](=O)[O-])c1 4991293 SAJLGYWTCZAPQD-UHFFFAOYSA-N 251.286 1.875 5 50 CDBA O=[N+]([O-])c1ccc(N2CCC[C@H](c3cnn[nH]3)C2)nc1 1775987679 RBHCGKAASFWVAT-VIFPVBQESA-N 274.284 1.492 5 50 CDBA C[C@H]1C(=O)NCCCN1c1nc2sccn2c1[N+](=O)[O-] 170606335 VMCNDWHVXDQQKK-ZETCQYMHSA-N 295.324 1.019 5 50 CDBA C[C@@H]1CCCC[C@]1(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 408520804 XQNKCPGWTLGUMK-MFKMUULPSA-N 280.328 1.876 5 50 CDBA COc1cc(CCNC(C)=O)c([N+](=O)[O-])cc1OC 12364302 GQNYIUIRUDLJIW-UHFFFAOYSA-N 268.269 1.291 5 50 CDBA O=[N+]([O-])c1cc(F)ccc1N1CC[C@](F)(CO)C1 253393121 SFOAGVXBESHSJV-LLVKDONJSA-N 258.224 1.645 5 50 CDBA C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)CN(C)C 2824339 AQNLZXIGDUEOLO-SNVBAGLBSA-N 265.313 1.522 5 50 CDBA CC(C)n1ccc2nc3ccn(N)c(=O)c3cc2c1=O 40398608 DKHXOXNQJQKMII-UHFFFAOYSA-N 270.292 1.006 5 50 CDBA COC(=O)[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C[C@H]1C 276973481 UBSJOUWYXDDDBU-MWLCHTKSSA-N 279.296 1.625 5 50 CDBA COC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1 31169 PEHRVWIULHRTGQ-UHFFFAOYSA-N 290.235 1.357 5 50 CDBA O=[N+]([O-])c1ccc2c(c1)nnn2CN1CCCCC1 297319 CUYCQRSCMSUBLW-UHFFFAOYSA-N 261.285 1.783 5 50 CDBA COC(=O)[C@H](C)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4520903 RXDDNUKGTCKLDT-LURJTMIESA-N 269.213 1.476 5 50 CDBA in-vitro O=C1C[C@@H](NCC2CC2)C(=O)N1c1ccc([N+](=O)[O-])cc1 83251951 DCVWSFBEAZLFSA-GFCCVEGCSA-N 289.291 1.226 5 50 CDBA C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C1CCOCC1 163539436 QNGZIWCGXZFNKA-VIFPVBQESA-N 294.307 1.845 5 50 CDBA CCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1N 79039 IQYXMFOQGPEJHU-UHFFFAOYSA-N 276.252 1.539 5 50 CDBA in-vitro CCOC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1OC 4551256 PYPKPXVIJXUSTK-UHFFFAOYSA-N 268.225 1.105 5 50 CDBA COc1ccc([N+](=O)[O-])cc1NC(=O)CC(C)=O 564116 LUYDCBSYHLMSBP-UHFFFAOYSA-N 252.226 1.521 5 50 CDBA O=[N+]([O-])c1ccc(NC(=S)N2CCOCC2)cc1 4599590 NXRGFTFOOPUGKK-UHFFFAOYSA-N 267.310 1.624 5 50 CDBA Cc1cc([N+](=O)[O-])cnc1N1CCC([C@@H](F)C(N)=O)CC1 585132725 POSPUPZUWYONFI-LLVKDONJSA-N 296.302 1.338 5 50 CDBA C[C@H]1C[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188562266 WKGXAILQYCTNTJ-ZANVPECISA-N 276.292 1.840 5 50 CDBA CCOC(=O)c1cnc2c([N+](=O)[O-])cnn2c1C 27951 JDYWHHZLNHDAON-UHFFFAOYSA-N 250.214 1.123 5 50 CDBA Nc1c([N+](=O)[O-])cnn1CC(=O)NC1CCCCCCC1 127509767 LMEUCKLQRGYNRI-UHFFFAOYSA-N 295.343 1.603 5 50 CDBA Cc1c([N+](=O)[O-])c(-c2nnc3n2CCCCC3)nn1C 72334100 UPHKKAGDFDRIOL-UHFFFAOYSA-N 276.300 1.622 5 50 CDBA COC(=O)c1cnc(N2CC3CC2(C)C3)c([N+](=O)[O-])c1 585099544 SRKWYKHRRYZUNB-UHFFFAOYSA-N 277.280 1.765 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N(C)C[C@@H](C)c2nnn[nH]2)c1 129863186 VVCLRWHBQKPHRB-SECBINFHSA-N 276.300 1.656 5 50 CDBA Cc1nc(N(C)C[C@H](C)c2nnn[nH]2)ccc1[N+](=O)[O-] 132898559 YCEJIRPLAADZJO-ZETCQYMHSA-N 277.288 1.051 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CCCNCC1 226461376 FHHZJANUXKSFJB-JTQLQIEISA-N 299.352 1.015 5 50 CDBA O=C(N[C@@H]1CCSC1=O)c1cccc([N+](=O)[O-])c1 183079 JQEJGQSAHUEQOF-SECBINFHSA-N 266.278 1.357 5 50 CDBA O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccccn1 209650 IHMYKDIATKXECK-UHFFFAOYSA-N 271.276 1.849 5 50 CDBA C[C@H]1[C@H](C)CN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 292852720 ABLMCCLXRADBSI-MNOVXSKESA-N 298.364 1.709 5 50 CDBA CCOC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C 2950652 KRFCMBJBNWKDPV-UHFFFAOYSA-N 252.226 1.405 5 50 CDBA COCCCn1cnc(-c2cccc([N+](=O)[O-])c2)n1 170602135 HVEPEZITEAAUQD-UHFFFAOYSA-N 262.269 1.890 5 50 CDBA CCOC(=O)Nc1n[nH]c(NC(=O)OCC)c1[N+](=O)[O-] 13152585 MAJAJNBFGFUERK-UHFFFAOYSA-N 287.232 1.455 5 50 CDBA CN(C)CCCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 2824753 LJSIONKADBUDFQ-RMKNXTFCSA-N 277.324 1.676 5 50 CDBA COc1ccc(S(=O)(=O)N2CCCC2)c([N+](=O)[O-])c1 621222 DVJSZGXEKZOEOP-UHFFFAOYSA-N 286.309 1.388 5 50 CDBA COC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C 4578566 HTFVBAOITGEFIZ-UHFFFAOYSA-N 266.253 1.795 5 50 CDBA C[C@@H](C(=O)O)N1CCc2ccc([N+](=O)[O-])cc2C1 237514908 ZUIPFXJTUHGKBF-QMMMGPOBSA-N 250.254 1.426 5 50 CDBA O=C(NC1(CCO)CCCC1)c1ccc(O)c([N+](=O)[O-])c1 253427046 KQZJAELDZZJURZ-UHFFFAOYSA-N 294.307 1.725 5 50 CDBA COCCCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 163971919 HOWBJKUCZMVRGW-UHFFFAOYSA-N 254.242 1.067 5 50 CDBA O=C1C[C@H](NCC2CC2)C(=O)N1c1ccc([N+](=O)[O-])cc1 95630533 DCVWSFBEAZLFSA-LBPRGKRZSA-N 289.291 1.226 5 50 CDBA C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccccc1 197133 LHWRJMCFAVKUSE-VIFPVBQESA-N 275.268 1.064 5 50 CDBA Cc1cc(S(=O)(=O)O)cc([N+](=O)[O-])c1Cl 1690007 OJTXHPQIEJMIJY-UHFFFAOYSA-N 251.647 1.803 5 50 CDBA Cc1ccc([N+](=O)[O-])c(N(C)C[C@H](C)c2nnn[nH]2)c1 129863413 VVCLRWHBQKPHRB-VIFPVBQESA-N 276.300 1.656 5 50 CDBA CN(C)C1CCN(c2ccc([N+](=O)[O-])c(C=O)c2)CC1 169725304 KQNZXPUUEPMIKT-UHFFFAOYSA-N 277.324 1.938 5 50 CDBA O=[N+]([O-])c1cccnc1N1CCOC[C@@H]1[C@H]1CCC[C@@H]1O 521398445 HIJSRYWCRVMPAM-RTXFEEFZSA-N 293.323 1.356 5 50 CDBA CCNc1cc(N2CCN(C)CC2)ccc1[N+](=O)[O-] 4739194 YXOVQJWQCRKDNS-UHFFFAOYSA-N 264.329 1.778 5 50 CDBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC(O)(CO)C1 408523993 PCHOXGQPDJRCAN-UHFFFAOYSA-N 292.213 1.157 5 50 CDBA COCCNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 2172194 ZPMPJKVKKVQCAB-UHFFFAOYSA-N 253.258 1.671 5 50 CDBA O=C(O)c1cccc([N+](=O)[O-])c1C(=O)NC1=NCCS1 2913188 MJYJCZJSQALRSI-UHFFFAOYSA-N 295.276 1.126 5 50 CDBA CON(C)C(=O)[C@H]1C[C@@H]1c1ccc([N+](=O)[O-])cc1 218115464 KGXGWVIKULLBRL-MNOVXSKESA-N 250.254 1.718 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1cccnc1 267056 HVBLJIUEBIYWIA-UHFFFAOYSA-N 293.304 1.468 5 50 CDBA O=Cc1cc(OCCCC(=O)O)ccc1[N+](=O)[O-] 2585707 OQKITJICGXCHGS-UHFFFAOYSA-N 253.210 1.651 5 50 CDBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)C1CC1 4676255 SVDQHCVSHNSUNN-UHFFFAOYSA-N 265.294 1.818 5 50 CDBA CCc1ccc(OC[C@H]2C[N+]34CCO[B-]3(OCC4)O2)cc1 195790753 BOORSZFOUGVWOZ-KLAILNCOSA-N 291.156 1.339 5 50 CDBA Cc1nc(N[C@H](CO)Cc2cnc[nH]2)ccc1[N+](=O)[O-] 1775986780 YPDKGIUPHHWXJX-JTQLQIEISA-N 277.284 1.037 5 50 CDBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2ccccc2Cl)N1 90859 TYGMJKKENBLZGE-KOLCDFICSA-N 254.673 1.936 5 50 CDBA N[C@H](CC(=O)O)c1cccn1-c1ccc([N+](=O)[O-])cc1 32763 QPTSBCSINGPCKQ-LLVKDONJSA-N 275.264 1.860 5 50 CDBA Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)no1 116175 XHJLDAHBWWMCRZ-UHFFFAOYSA-N 283.265 1.692 5 50 CDBA in-vitro CCn1cc([N+](=O)[O-])c(-c2nnc3n2CCCCC3)n1 72334158 INGBTQLSUOHYPM-UHFFFAOYSA-N 276.300 1.796 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CCCO1 5061037 NGSJDKZZFOXQIG-SNVBAGLBSA-N 295.295 1.904 5 50 CDBA CCOC(=O)C(C(=O)OCC)c1ncccc1[N+](=O)[O-] 14985813 IMGOJADWUZXLFZ-UHFFFAOYSA-N 282.252 1.200 5 50 CDBA CC1=NN(c2ccccc2)C(=O)[C@H]1[C@@H](C)C[N+](=O)[O-] 297234 MLRDEESSCJSTAE-CABZTGNLSA-N 261.281 1.938 5 50 CDBA CN1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4182692 KYOGKWGGIMQUIL-UHFFFAOYSA-N 290.367 1.947 5 50 CDBA CNC(=O)[C@H]1CCC[C@H]1Nc1ccc([N+](=O)[O-])nc1 345151243 QWWXKHCIZDPTQT-VHSXEESVSA-N 264.285 1.316 5 50 CDBA O=[N+]([O-])c1ccc(Br)c([S@](=O)O)c1 675060899 NDGYBOJWMPDSLH-UHFFFAOYSA-N 266.072 1.938 5 50 CDBA CC(C)(C)OC(=O)[C@@H]1N[C@@H]1c1ccc([N+](=O)[O-])cc1 95644404 JXJGFVMVUVDWNV-GHMZBOCLSA-N 264.281 1.949 5 50 CDBA in-vitro CCN1CCN(Cc2cc(OC)c(O)c([N+](=O)[O-])c2)CC1 19536977 DNQGUMCBKFDZHK-UHFFFAOYSA-N 295.339 1.447 5 50 CDBA CCOc1ccc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc1 90819 RKKCAGBZQUVVPH-WCQYABFASA-N 264.281 1.682 5 50 CDBA CCOC(=O)CCn1cnc2ccc([N+](=O)[O-])cc2c1=O 2887024 WONJIRZTJDZEMG-UHFFFAOYSA-N 291.263 1.258 5 50 CDBA O=[N+]([O-])c1ccc(C[n+]2ccccc2)c([N+](=O)[O-])c1 4582952 LXPWWMFGFAZCNB-UHFFFAOYSA-N 260.229 1.839 5 50 CDBA CCCn1nnc(NC(=O)c2ccccc2[N+](=O)[O-])n1 469979 DJJMBPKLZDFFIV-UHFFFAOYSA-N 276.256 1.244 5 50 CDBA CC(C)(C)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 310261878 QSGJVCLBOLUALD-UHFFFAOYSA-N 258.299 1.540 5 50 CDBA O=C(NCCC1=CCOCC1)c1cccc([N+](=O)[O-])c1O 152935816 UQRHURZBLGJPMU-UHFFFAOYSA-N 292.291 1.767 5 50 CDBA C[C@@H]1C[C@H]1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 585079410 KBCPPFFEVMKFFM-LDYMZIIASA-N 263.249 1.977 5 50 CDBA CN(C)CCNC(=O)c1cc([N+](=O)[O-])ccc1Cl 5102284 NEKIUJOPLITFBM-UHFFFAOYSA-N 271.704 1.540 5 50 CDBA COc1cc(CN2CCSCC2)cc([N+](=O)[O-])c1O 201940 HMXIWAHFOQDKOA-UHFFFAOYSA-N 284.337 1.858 5 50 CDBA COc1cc(CO)ccc1Oc1nc([N+](=O)[O-])nn1C 528835 DJDQCQMUILUBJA-UHFFFAOYSA-N 280.240 1.017 5 50 CDBA NC(=O)[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 4987190 SFTGNNSWLGSSMZ-NSHDSACASA-N 263.297 1.292 5 50 CDBA O=C(NC[C@H]1CCOC1)c1cccc([N+](=O)[O-])c1O 123111090 JEUCZPWXLROXMS-MRVPVSSYSA-N 266.253 1.067 5 50 CDBA CCn1nnc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 2862005 YNJXWDKTADUHKC-UHFFFAOYSA-N 276.256 1.162 5 50 CDBA O=[N+]([O-])c1cc(F)c(N2CCCC2)cc1N1CCNCC1 4543928 VIIKTWJXHOLHTB-UHFFFAOYSA-N 294.330 1.744 5 50 CDBA O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCOCC1 83795461 JQHVPCOCZXOUEE-UHFFFAOYSA-N 270.672 1.721 5 50 CDBA COC(=O)[C@H]1O[C@@H]1c1cc([N+](=O)[O-])ccc1OC 1704603 ZFSZGUBDAZQINV-ZJUUUORDSA-N 253.210 1.216 5 50 CDBA CN1CCc2nc(N)c3c(=O)oc4ccccc4c3c2C1 22170639 DCEDRBVDYRNTPM-UHFFFAOYSA-N 281.315 1.911 5 50 CDBA Cn1ncc([N+](=O)[O-])c1C(=O)NC1CCCCCC1 483033 SEBZWJSMLMLYBA-UHFFFAOYSA-N 266.301 1.781 5 50 CDBA C[C@H](Nc1ccc([N+](=O)[O-])cn1)c1nn(C)cc1O 1616036533 XGTYPCCBQBDKOS-ZETCQYMHSA-N 263.257 1.602 5 50 CDBA O=C1c2cc([N+](=O)[O-])ccc2-n2c1nc1ccccc1c2=O 334588 UFMQJYHLIUACCG-UHFFFAOYSA-N 293.238 1.838 5 50 CDBA in-vitro Cc1c(C(=O)NCCCN(C)C)cccc1[N+](=O)[O-] 2743270 BLMJDDFBTNLKSW-UHFFFAOYSA-N 265.313 1.585 5 50 CDBA CS(=O)(=O)CCSc1c(Cl)cncc1[N+](=O)[O-] 408516805 AFVJREAMIXBGDN-UHFFFAOYSA-N 296.757 1.780 5 50 CDBA COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(C)C 299114 HTXNPHLKZGDNLC-LLVKDONJSA-N 280.280 1.522 5 50 CDBA COc1cccc(N[C@H](C)C[S@](C)=O)c1[N+](=O)[O-] 169041614 CJSOZBUGDNUKRV-NTCNTBNZSA-N 272.326 1.782 5 50 CDBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)CCO 282039695 UKBREIAQALOZCY-UHFFFAOYSA-N 297.311 1.840 5 50 CDBA CCC1=C([N+](=O)[O-])[C@@H](c2ccc3c(c2)OCO3)NC(=O)N1 248090 ZHPLGDGVANEAJZ-LLVKDONJSA-N 291.263 1.668 5 50 CDBA Cn1cnc([N+](=O)[O-])c1CN1CC(C)(C)OC(C)(C)C1 408429523 KTUGWQGPPFHNSD-UHFFFAOYSA-N 282.344 1.718 5 50 CDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCC[C@@H]1CCCN1 166788957 RFCWJOFZDNVCDQ-JTQLQIEISA-N 299.352 1.015 5 50 CDBA CC(=O)c1cccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 1070288 SSIOLRFLZJOENL-UHFFFAOYSA-N 288.263 1.633 5 50 CDBA O=C(O[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 4829341 MJOVTDWCYHURGZ-QWRGUYRKSA-N 251.238 1.665 5 50 CDBA COC(=O)c1cc(Cn2cc([N+](=O)[O-])cn2)c(C)s1 121324119 LFJFIIBFXYMBQA-UHFFFAOYSA-N 281.293 1.996 5 50 CDBA C[C@H]1OC[C@@H]2[C@@H](c3cccc([N+](=O)[O-])c3)N(C)O[C@H]2CO1 248018511 LEEHOBZPJJDMHG-NZPIUUIZSA-N 294.307 1.891 5 50 CDBA COC[C@@H](Nc1ncccc1[N+](=O)[O-])C1CCOCC1 585092976 WUCZAHJOLZTYBI-LLVKDONJSA-N 281.312 1.843 5 50 CDBA O=C1CCCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3156715 IRUIXNSWMUXBCA-UHFFFAOYSA-N 279.208 1.266 5 50 CDBA Cn1cc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cn1 373003 VBRNSSZYLRXRKU-UHFFFAOYSA-N 294.698 1.912 5 50 CDBA COc1ccc(C(=O)NCc2ccccn2)cc1[N+](=O)[O-] 440700 KUXQBVAFZUBAAL-UHFFFAOYSA-N 287.275 1.928 5 50 CDBA COc1ccc(C=O)cc1Cn1ccc([N+](=O)[O-])n1 2573204 KNEGYIQWZRNSIN-UHFFFAOYSA-N 261.237 1.661 5 50 CDBA C[C@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 1540366040 JVGKBAWLHUSIKT-LURJTMIESA-N 272.692 1.843 5 50 CDBA C[C@H]1CN(c2ccc([N+](=O)[O-])c(N)c2)C[C@H](C)N1 5276215 OTASVJFNJXDROV-IUCAKERBSA-N 250.302 1.364 5 50 CDBA O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCOCC1 122357 JFGITFUPSIAISG-UHFFFAOYSA-N 270.672 1.721 5 50 CDBA CC(C)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 239164 QWBHWBJUYFMXHS-UHFFFAOYSA-N 277.324 1.761 5 50 CDBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCO1 4777420 RIGKPBKPPIVLOS-ZWNOBZJWSA-N 294.307 1.657 5 50 CDBA Cn1[nH]c(=N)c2c1CN(c1ccc([N+](=O)[O-])cc1)C2 328600369 XNBWNTCKBWTVGO-UHFFFAOYSA-N 259.269 1.261 5 50 CDBA O=[N+]([O-])c1ccc(N2CCC[C@@H](OCCO)C2)s1 169987447 BULXOSXXWAQSOG-SECBINFHSA-N 272.326 1.634 5 50 CDBA CN(C(=O)c1cccc([N+](=O)[O-])c1O)[C@@H]1CCOC1 163418355 QXNSLZVGVIYFJT-MRVPVSSYSA-N 266.253 1.161 5 50 CDBA CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@H]1CCOC1 160290814 YZLZJGWIZWGHPZ-VIFPVBQESA-N 266.253 1.161 5 50 CDBA O=C(O)Cc1ncc(C(F)(F)F)cc1[N+](=O)[O-] 514277334 KLDHMMOSIHSAIM-UHFFFAOYSA-N 250.132 1.636 5 50 CDBA C[C@H](CNc1ncccc1[N+](=O)[O-])c1nncn1C 170606515 PHTAXZJPIBJLMS-MRVPVSSYSA-N 262.273 1.334 5 50 CDBA COCCNCCCOc1ccc(C)cc1[N+](=O)[O-] 3460821 QKJJCXJOZDVYKT-UHFFFAOYSA-N 268.313 1.908 5 50 CDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1S(C)(=O)=O 4045599 RMCUBOLBZPKZKY-SNVBAGLBSA-N 299.352 1.065 5 50 CDBA Cc1nc([N+](=O)[O-])c(N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)n1C 221752688 NVRFYHFXIBFULF-MNOVXSKESA-N 296.371 1.870 5 50 CDBA N=C1NC(=O)[C@H](CC(=O)Nc2ccc([N+](=O)[O-])cc2)S1 18106278 TZUFCYVGNXOWGZ-QMMMGPOBSA-N 294.292 1.090 5 50 CDBA CC(=O)N1[C@@H](C[N+](=O)[O-])C[C@@H](C)N1c1ccccc1 4603358 DCQAFYPIDRLVIK-ZWNOBZJWSA-N 263.297 1.694 5 50 CDBA COC(=O)c1cc([N+](=O)[O-])c(C(F)(F)F)cc1N 118792041 YPFUHFOLSYLYNX-UHFFFAOYSA-N 264.159 1.982 5 50 CDBA CN(C)[C@@H]1COC(=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1 217041239 JVHRFDUBKQWSDL-GHMZBOCLSA-N 266.253 1.733 5 50 CDBA CC[C@@H](C)Nc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 675009472 IKEMALOPOHBVLR-ZCFIWIBFSA-N 282.256 1.812 5 50 CDBA N[C@@H]1CC[C@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@@H]12 170078296 CSGQQIVXQBZHIZ-XXILOJSOSA-N 293.298 1.543 5 50 CDBA CN(C)C(=O)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 187865904 WRVYZTQUGHJCID-UHFFFAOYSA-N 293.279 1.371 5 50 CDBA NS(=O)(=O)c1cc([N+](=O)[O-])c(Br)s1 68590098 IKBUTKYQEXSXMA-UHFFFAOYSA-N 287.116 1.066 5 50 CDBA COC(=O)[C@@H](CC(C)C)NC(=O)c1ccccc1[N+](=O)[O-] 318607 IZJKSTSDGTZPJE-LLVKDONJSA-N 294.307 1.912 5 50 CDBA CCOc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 2884132 FMACXMNYUHFWSB-UHFFFAOYSA-N 290.279 1.829 5 50 CDBA CC(=O)OCCCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 2939385 UJYHJTCXAOOBPT-UHFFFAOYSA-N 292.247 1.144 5 50 CDBA CN(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4740532 CNAXIIBLFRWQLX-UHFFFAOYSA-N 278.312 1.398 5 50 CDBA C[C@@H]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CN 253196961 UEGPFLPIEUAKBR-NXEZZACHSA-N 289.339 1.892 5 50 CDBA COc1cc(NC(=O)c2ccn(C)n2)cc([N+](=O)[O-])c1 356240 KINKGSNMUZODID-UHFFFAOYSA-N 276.252 1.589 5 50 CDBA O=[N+]([O-])c1ccc([C@@H](O)[C@H](CO)N2CCCCC2)cc1 96027514 PJWKHFUUONPSEU-UONOGXRCSA-N 280.324 1.475 5 50 CDBA COC(=O)C(C)(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 97756868 DBHFSFIZHCTXJY-UHFFFAOYSA-N 287.293 1.320 5 50 CDBA O=C(N[C@H]1CCC[C@@H]1CCO)c1ccc([N+](=O)[O-])s1 170601323 UVOOHKTUCANRIB-BDAKNGLRSA-N 284.337 1.937 5 50 CDBA CO[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1OC 170612148 BHKUYZWWUFJVCM-CHWSQXEVSA-N 294.307 1.010 5 50 CDBA COC(=O)c1ccc(Cn2nc([N+](=O)[O-])cc2C)cc1 550610 FOVJSTWURUAITC-UHFFFAOYSA-N 275.264 1.935 5 50 CDBA COc1cc([N+](=O)[O-])ccc1NC(=O)/C=C/C(=O)O 4661019 GMNCTMJKDGTIJZ-SNAWJCMRSA-N 266.209 1.183 5 50 CDBA CCn1cc(C(=O)O)c(=O)c2ccc([N+](=O)[O-])cc21 6425916 LPNLQEZNMAWJTJ-UHFFFAOYSA-N 262.221 1.628 5 50 CDBA C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)O 20557905 DZPYKYTXQZEIAJ-ZCFIWIBFSA-N 253.214 1.189 5 50 CDBA O=C(O)CSCC(=O)Nc1ccc([N+](=O)[O-])cc1 4517835 WTYGLOKOYDUETF-UHFFFAOYSA-N 270.266 1.351 5 50 CDBA Nc1c([N+](=O)[O-])cc(F)c(NCCO)c1Br 4689253 NQXJBWDIWFRTOQ-UHFFFAOYSA-N 294.080 1.483 5 50 CDBA COc1ccc(Cn2cnc([N+](=O)[O-])c2C=O)cc1 215757448 WUHWNYXEMWMPDK-UHFFFAOYSA-N 261.237 1.661 5 50 CDBA C[C@@H]1CCCCN1[C@@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21 4845058 WBEUKNYVFYYBEX-OTYXRUKQSA-N 291.307 1.566 5 50 CDBA CCOc1cc(N2CCNCC2)ccc1[N+](=O)[O-] 111044577 AFYYDDWMIXLCNV-UHFFFAOYSA-N 251.286 1.403 5 50 CDBA in-vitro O=C(NCCCn1ccnc1)c1cccc([N+](=O)[O-])c1 13533745 BOENZJLHLMXPPE-UHFFFAOYSA-N 274.280 1.611 5 50 CDBA C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ncn(C)n1 391976772 MDEXQVZMJAWJPK-SNVBAGLBSA-N 275.312 1.617 5 50 CDBA CN1C[C@H](C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC1=O 120907066 MGGRPFVVXCTALI-SSDOTTSWSA-N 281.243 1.151 5 50 CDBA COC(=O)c1ccccc1Nc1ncnc(N)c1[N+](=O)[O-] 3912572 VHGLRFGENONIJH-UHFFFAOYSA-N 289.251 1.497 5 50 CDBA Nc1ncc(I)cc1[N+](=O)[O-] 25725757 MDJUWRHSXKZSOJ-UHFFFAOYSA-N 265.010 1.177 5 50 CDBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)on2)n1 356110 KSWOZDMJICZZHV-UHFFFAOYSA-N 265.229 1.360 5 50 CDBA Cc1cccnc1NC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1 4820295 UKTKIOXBPGBBBO-VIFPVBQESA-N 275.268 1.694 5 50 CDBA Cn1nccc1[C@@H]1C[C@H]1CNc1cccnc1[N+](=O)[O-] 1775990523 MUMVRKNQZQHZOP-VHSXEESVSA-N 273.296 1.939 5 50 CDBA O=[N+]([O-])c1cc([N+](=O)[O-])c(SCCO)c([N+](=O)[O-])c1 100290946 ZJTJZEBQOQZCTI-UHFFFAOYSA-N 289.225 1.496 5 50 CDBA CCOc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 1428111 JDQPAJGIOFXSDV-UHFFFAOYSA-N 290.279 1.829 5 50 CDBA Cc1nc2ccccc2n2cc3c(=O)n(C)c(=O)n(C)c3c12 529497 VVKKKFCURMYPLA-UHFFFAOYSA-N 294.314 1.347 5 50 CDBA Cc1ccc(C(=O)NC[C@H](C)CN(C)C)cc1[N+](=O)[O-] 2935530 QEAVLLDXMJVFPM-JTQLQIEISA-N 279.340 1.831 5 50 CDBA O=C(NCCn1ccccc1=O)c1ccc([N+](=O)[O-])cc1 353631193 OCNGETWQOXTZSZ-UHFFFAOYSA-N 287.275 1.187 5 50 CDBA O=C1NC(=O)/C(=C\c2cccc([N+](=O)[O-])c2)S1 1774538 HWOVMANHBOBQRW-VMPITWQZSA-N 250.235 1.919 5 50 CDBA O=C(Cn1ccc([N+](=O)[O-])n1)OCc1ccccc1 4821142 KVDFBDUWGMKSCK-UHFFFAOYSA-N 261.237 1.535 5 50 CDBA COC(=O)C(=Cc1cccc([N+](=O)[O-])c1)C(=O)OC 1715187 KGGZPRWQLRHPHV-UHFFFAOYSA-N 265.221 1.324 5 50 CDBA Nc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4773027 ACJNABKXDUDYAM-UHFFFAOYSA-N 293.304 1.978 5 50 CDBA O=C1CS/C(=C\[N+](=O)[O-])N1c1ccc(F)cc1 1387337 PLCIVLLSHNGGQO-YHYXMXQVSA-N 254.242 1.981 5 50 CDBA CC(=O)CC(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5495273 FGVXALCWFWMFBD-UHFFFAOYSA-N 267.197 1.421 5 50 CDBA CN1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)OC1=S 4579063 KYGBOONPFINVDS-RMKNXTFCSA-N 264.262 1.709 5 50 CDBA COC(=O)c1ncc([N+](=O)[O-])c(C)c1Br 32914818 WDQAQQWKIJKMSZ-UHFFFAOYSA-N 275.058 1.847 5 50 CDBA COCCN(c1ccccc1[N+](=O)[O-])S(C)(=O)=O 242592250 OOYTWBMAMOEVMC-UHFFFAOYSA-N 274.298 1.007 5 50 CDBA O=[N+]([O-])c1ccc(NCCCN2CCOCC2)nc1 19640142 CSYAEPYKNUNJLE-UHFFFAOYSA-N 266.301 1.124 5 50 CDBA CCCC(=O)N(CCC(N)=O)c1ncc([N+](=O)[O-])s1 5371648 ZQMLMBWKTMVFTC-UHFFFAOYSA-N 286.313 1.060 5 50 CDBA Cc1nn(CC(=O)Nc2cccnc2)c(C)c1[N+](=O)[O-] 1068728 XWOHQUKPOZORRI-UHFFFAOYSA-N 275.268 1.442 5 50 CDBA Cn1cnnc1SCc1nc2ccc([N+](=O)[O-])cc2[nH]1 4149214 RRMLVMZKTQYGQP-UHFFFAOYSA-N 290.308 1.892 5 50 CDBA Cn1c(=O)c(=NO)c2ccccc2c2ccccc21 301054952 QVRCJTODZXUHRW-UHFFFAOYSA-N 252.273 1.982 5 50 CDBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2nccs2)n1 995080 ZAZIMXHSFQDZMS-UHFFFAOYSA-N 253.243 1.037 5 50 CDBA COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cccc([N+](=O)[O-])c1C 185536120 FHKDRSCIMSELFL-YPMHNXCESA-N 294.307 1.011 5 50 CDBA CCC1(CC)CNC(=O)[C@@H]1Nc1ncccc1[N+](=O)[O-] 929084561 BEEGVYPGPQDBOR-JTQLQIEISA-N 278.312 1.707 5 50 CDBA COC(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C 306061 UOOPVBNHUUAZSR-UHFFFAOYSA-N 266.253 1.795 5 50 CDBA Cn1ccs/c1=N\C(=O)c1cccc([N+](=O)[O-])c1O 130369850 JTAJLVUWYHGLNH-QXMHVHEDSA-N 279.277 1.442 5 50 CDBA O=[N+]([O-])c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 81567751 XGFQEYJJFKJJCC-UHFFFAOYSA-N 274.273 1.518 5 50 CDBA