smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)[C@H]1CCCO1 1054835 PYPKJEBAJJXXHF-TVQRCGJNSA-N 332.312 1.999 5 50 EDBA O=[N+]([O-])c1cc[n+]([O-])cc1N1CCN(CCc2cccs2)CC1 408522048 CHTINBCLLFPPBQ-UHFFFAOYSA-N 334.401 1.654 5 50 EDBA O=C(CN1C(=O)COc2ccccc21)Nc1ncc([N+](=O)[O-])s1 9575870 JIJJUPSTURKFQG-UHFFFAOYSA-N 334.313 1.415 5 50 EDBA O=C(O)c1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 239046344 FOILVJIBZXSNNX-GYBADROVSA-N 330.296 1.829 5 50 EDBA C[C@](CO)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 612074395 SJBXQPXHYKKQHU-CRAIPNDOSA-N 346.383 1.832 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(Cc3cc[nH]n3)CC2)n1 1775987190 LCSALTNWCGGYPR-UHFFFAOYSA-N 345.359 1.959 5 50 EDBA Cn1[nH]c([C@@H]2CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])nc1=N 408516025 DNLODSXPJCSYPW-XEHSLEBBSA-N 342.359 1.513 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2cccnc2)CC1 19790319 DIZOFYINKDNWFB-UHFFFAOYSA-N 326.356 1.948 5 50 EDBA NC(=O)Cn1cnc2scc(-c3cccc([N+](=O)[O-])c3)c2c1=O 65093 LXIGBZLGKSMWJI-UHFFFAOYSA-N 330.325 1.519 5 50 EDBA CCn1cnnc1[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2CC)CCO1 225458476 YGNPOSNVZOSIIF-LLVKDONJSA-N 335.368 1.309 5 50 EDBA O=C(NCc1ccccc1CO)c1n[nH]c2ccc([N+](=O)[O-])cc12 127591832 MTMOLYLCRWBWMI-UHFFFAOYSA-N 326.312 1.893 5 50 EDBA CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359018684 MEFWHWMQZAPGBQ-NSHDSACASA-N 336.348 1.750 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1[C@H]2CCNC[C@H]1CC2 262788510 QZBZWRPQHYXOHN-DGCLKSJQSA-N 325.390 1.418 5 50 EDBA CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](O)C(F)(F)F 270801882 JVOLXBHYOGKGHI-VHSXEESVSA-N 342.295 1.575 5 50 EDBA COC(=O)[C@@H](C)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 412536858 DRYFOSRVNGDTEA-JTQLQIEISA-N 332.316 1.707 5 50 EDBA CCc1[nH]nc(C(=O)N[C@@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] 171804316 MDCNOGQQMWETDP-TUAOUCFPSA-N 337.424 1.977 5 50 EDBA COc1ccc(C(=O)CSc2nc(N)cc(=O)[nH]2)cc1[N+](=O)[O-] 15686426 RFMXYOHGHFEZTF-UHFFFAOYSA-N 336.329 1.244 5 50 EDBA Cc1nn(C)cc1CN(C)C(=O)Cn1nc([N+](=O)[O-])c(Cl)c1C 205000 UFNSRHPURVYJRJ-UHFFFAOYSA-N 340.771 1.454 5 50 EDBA COC(=O)[C@@H](C(C)=O)[C@H](C[N+](=O)[O-])c1ccc(OC)c(OC)c1 4783899 UHBZYRRWWAZFKP-RISCZKNCSA-N 325.317 1.442 5 50 EDBA O=C(NC[C@@H]1CCCO1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4839876 HZLKPRWQDICMMD-ZDUSSCGKSA-N 335.360 1.340 5 50 EDBA CCn1ncc(CN(C)C(=O)[C@H](C)n2cc([N+](=O)[O-])c(C)n2)c1C 2776977 PPYOYPCIWJXHRC-LBPRGKRZSA-N 334.380 1.844 5 50 EDBA Cc1sc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)c(C(N)=O)c1C 2084513 LLMRQNBTRPTMMJ-UHFFFAOYSA-N 337.361 1.516 5 50 EDBA CCc1n[nH]c(-n2ccc3nc4ccn(C5CC5)c(=O)c4cc3c2=O)n1 40399144 OCBMKISBMMPHAO-UHFFFAOYSA-N 348.366 1.716 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 101889225 JMCRGLJKBSCDIB-QYAIJTBZSA-N 344.323 1.917 5 50 EDBA O=c1c2cc3c(=O)n(Cc4ccccc4)ccc3nc2ccn1CCO 38829068 LUYCYEJMJZIRSI-UHFFFAOYSA-N 347.374 1.752 5 50 EDBA O=C(c1cc([N+](=O)[O-])ccc1O)N1CCCN(c2cccnn2)CC1 179506258 QQNHPQTZRQQDCK-UHFFFAOYSA-N 343.343 1.443 5 50 EDBA O=C1NC(=O)c2cc(N3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)ccc21 225620 QCBPJHZXHBTDLY-UHFFFAOYSA-N 337.247 1.279 5 50 EDBA COc1ccc(/C=C/c2c([N+](=O)[O-])c(=O)n(C)c(=O)n2C)c(OC)c1 4754396 RNMVSJNCZDXYAC-SOFGYWHQSA-N 347.327 1.180 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@]2(C(F)(F)F)CCOC2)cc1 253395222 SQFXVWSAUPSRKS-SNVBAGLBSA-N 340.279 1.595 5 50 EDBA Cn1cc(N2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2=O)cn1 253421382 VIPDXPGPZTVKJS-UHFFFAOYSA-N 333.323 1.316 5 50 EDBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32 243919565 BOXKKTMOTZGMSL-HCFJGQMDSA-N 332.312 1.740 5 50 EDBA O=c1[nH]cnc2c1C(c1cccc([N+](=O)[O-])c1)c1c(nc[nH]c1=O)O2 9034211 LESOOCUBLPKKLI-UHFFFAOYSA-N 339.267 1.047 5 50 EDBA C[C@@H]1CO[C@@H](c2ccccc2)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 229836556 RYMJVRHMDPNKHK-KBRIMQKVSA-N 346.387 1.614 5 50 EDBA C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H]2[C@H](C1)C2(C)C 246610704 CHLIYDLCGBLJJG-BPNCWPANSA-N 331.372 1.828 5 50 EDBA Cc1c(Nc2ncnc(N)c2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 3912608 XCQACPWTTRWRNX-UHFFFAOYSA-N 341.331 1.508 5 50 EDBA CCCCNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-] 4158830 QULOCNMYKFRGHW-UHFFFAOYSA-N 343.405 1.828 5 50 EDBA Cn1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cn1 173660320 AOOQOAXXDXDSGY-UHFFFAOYSA-N 333.323 1.430 5 50 EDBA O=C1Nc2ccccc2[C@]12CCN(c1cnc([N+](=O)[O-])c(O)c1)C2 952993657 IOGACBUXIQFLMN-MRXNPFEDSA-N 326.312 1.796 5 50 EDBA O=C(Nc1ncccc1O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 408513966 USSHTGDMIDXWCY-CYBMUJFWSA-N 328.284 1.827 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1[C@H]2CCc3ccccc3[C@@H]21 155122998 BLIWGFUZVWTVFD-CPUCHLNUSA-N 326.356 1.884 5 50 EDBA CN(CC(=O)Nc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 467540 YEADLDZAMDKRJI-UHFFFAOYSA-N 349.368 1.854 5 50 EDBA Cc1cc(C)n(CCCNC(=O)CCn2ncc([N+](=O)[O-])c2C)n1 2794335 KWYSMQGXOJJEAH-UHFFFAOYSA-N 334.380 1.510 5 50 EDBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCOCC3)c2)CC1 5050581 DHAIFDXBZFQKIN-UHFFFAOYSA-N 348.403 1.490 5 50 EDBA CCN1CCN(c2cc(N3CCOCC3)c(F)cc2[N+](=O)[O-])CC1 4168657 MRNPPYYGIPYPJD-UHFFFAOYSA-N 338.383 1.712 5 50 EDBA CS[C@@H](CO)[C@H](C)NS(=O)(=O)c1cc(C)c(C)c([N+](=O)[O-])c1 318722704 SGURYGWFQXLCMJ-GWCFXTLKSA-N 348.446 1.602 5 50 EDBA CC1(C)[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1O 408514030 CKJDZIRAPZREFH-QWHCGFSZSA-N 328.390 1.118 5 50 EDBA C[C@]1(NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO[C@H]1C1CC1 273085943 LYTMYJRGQBMQHJ-GJZGRUSLSA-N 340.401 1.972 5 50 EDBA Cn1c(=O)c(=O)n(C)c2cc([N+](=O)[O-])c(N3CCCCCC3)cc21 4856915 WITVKRCBFCORFO-UHFFFAOYSA-N 332.360 1.526 5 50 EDBA Cc1nc(N2CCC(C)CC2)nc(N2CCN(C)CC2)c1[N+](=O)[O-] 6472916 FTJKAJXSAKEFCU-UHFFFAOYSA-N 334.424 1.681 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCNCc3ccccc32)cc1 320985159 ZKOIPWQDYRJIQY-UHFFFAOYSA-N 333.369 1.893 5 50 EDBA CC1=NN(C(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)[C@@](O)(C(F)(F)F)C1 6395009 CJKJTRNYEAJKFC-XVKPBYJWSA-N 335.242 1.211 5 50 EDBA CCO[C@@H]1C[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@]12CCCO2 274152693 GEBURAKTCVBOGW-JJRVBVJISA-N 349.387 1.942 5 50 EDBA COc1ccc(C(=O)N2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-] 1056467 LEOYNIYIFRVDNY-UHFFFAOYSA-N 343.343 1.356 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)NC1(CO)C2CC3CC(C2)CC1C3 408520866 KCEUXADNAANBAM-UHFFFAOYSA-N 334.376 1.095 5 50 EDBA Cc1ccc(C)c(-n2nnnc2Sc2nc([N+](=O)[O-])nn2C)c1 542228 DJUKKTLAOTXVJG-UHFFFAOYSA-N 332.349 1.467 5 50 EDBA CC[C@H](C)NS(=O)(=O)c1ccc(N2CCCC2=O)c([N+](=O)[O-])c1 4611166 HWLFRUMOLYOLRN-JTQLQIEISA-N 341.389 1.798 5 50 EDBA CC1=NN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@@](O)(C(F)(F)F)C1 1019124 JNJHOOJRSSNKRW-JTQLQIEISA-N 335.242 1.109 5 50 EDBA CCCNC(=O)c1c(NC(=O)c2cccc([N+](=O)[O-])c2)cnn1C 2796355 IRHPMAJFVLEURR-UHFFFAOYSA-N 331.332 1.720 5 50 EDBA CC[C@@H](c1nc2c3cnn(C)c3ncn2n1)n1nc([N+](=O)[O-])cc1C 2802237 GXGLQUCCGIXTNH-JTQLQIEISA-N 341.335 1.424 5 50 EDBA COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cc([N+](=O)[O-])ccc1OC 311691 FNFQMRPEKSWAET-GFCCVEGCSA-N 337.357 1.569 5 50 EDBA Nc1n[nH]c(NC2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)n1 1775991861 WIMIXBDUTXWWJU-UHFFFAOYSA-N 338.759 1.424 5 50 EDBA O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C2OCCO2)C1 169979946 LLFLOYFCQYRSLF-ZDUSSCGKSA-N 335.360 1.889 5 50 EDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCc2nnc(-c3ccncc3)cc2C1 952892196 FMVFABZVTBBPQR-IUODEOHRSA-N 325.328 1.089 5 50 EDBA CN1Cc2nncn2C[C@H]1c1nc(-c2ccc([N+](=O)[O-])s2)no1 1775960489 OKUVNWRESGIHLQ-ZETCQYMHSA-N 333.333 1.485 5 50 EDBA NNc1cc([N+](=O)[O-])c(Oc2ccccc2)c(S(=O)(=O)O)c1 2575544 IWGLAXGTDPOLJU-UHFFFAOYSA-N 325.302 1.919 5 50 EDBA COc1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc(OC)c1OC 4869796 GZEAFJYFXFAOHT-UHFFFAOYSA-N 336.304 1.456 5 50 EDBA COc1ccccc1C(=O)NC(=O)OCCn1c(C)cnc1[N+](=O)[O-] 1424290 ODEJDJRIOMBXEY-UHFFFAOYSA-N 348.315 1.675 5 50 EDBA O=C(Nc1cc(SC[C@@H](O)CO)cc([N+](=O)[O-])c1)c1ccco1 2749463 VIZBEWZEDKSNRX-NSHDSACASA-N 338.341 1.885 5 50 EDBA CCCN1CC2=C(C1=O)[C@H](c1cccc([N+](=O)[O-])c1)NC(=O)N2C 4776442 PHQZAGYATGRYIH-AWEZNQCLSA-N 330.344 1.797 5 50 EDBA O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Nc1ccccn1 35349222 JLUXAQQYENDYCX-UHFFFAOYSA-N 341.371 1.751 5 50 EDBA Cc1nn(C)c(C)c1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 188468227 AGUSPTWAYDZNFP-UHFFFAOYSA-N 344.371 1.777 5 50 EDBA C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCS(=O)(=O)C1 192108717 NLCVWLXTPONECS-SNVBAGLBSA-N 339.373 1.603 5 50 EDBA O=[N+]([O-])c1cnc2ccc(N3CC[C@H](OCc4ccncc4)C3)nn12 192905169 UUROHEICKLWJBV-ZDUSSCGKSA-N 340.343 1.828 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H](C(=O)N(C)C)C2)n1 952874723 UZEUDFYEATYNCN-JTQLQIEISA-N 336.348 1.081 5 50 EDBA N[C@@H]1CCC[C@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]12 230141684 ALBTWRXTXGZYPE-ZLKJLUDKSA-N 325.390 1.343 5 50 EDBA COc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4C[C@H]2C[C@@H]43)c1 239274627 ALRXWJUBPONYSE-MAQCBKMQSA-N 332.312 1.740 5 50 EDBA COC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CCO1 408518397 FORUYUZSHUCZIN-VIFPVBQESA-N 344.751 1.886 5 50 EDBA C[C@H]1CCS(=O)(=O)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 191975029 HFNBEQXHDJTEQT-NSHDSACASA-N 341.389 1.313 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(c3ncccn3)CC2)n1 952876663 DHIRLPQGAFRWDF-UHFFFAOYSA-N 343.343 1.950 5 50 EDBA NNc1cc([N+](=O)[O-])cc2c1C(=O)N(Cc1ccccc1)[S@@]2=O 245236437 SYQJHWKHJNZWMU-HSZRJFAPSA-N 332.341 1.559 5 50 EDBA O=c1c2cc3c(=O)n(Cc4cccnc4)ccc3nc2ccn1CCO 38829159 YKTJOPSSHSPBKQ-UHFFFAOYSA-N 348.362 1.147 5 50 EDBA biogenic N[C@@H]1CCC[C@@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]21 225346713 ALBTWRXTXGZYPE-DDTOSNHZSA-N 325.390 1.343 5 50 EDBA O=C(CN1CCOCC1)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)s1 23634363 DNPDQMPUSCVYCB-UHFFFAOYSA-N 349.372 1.384 5 50 EDBA CC(=O)N1CCc2sc(C(=O)Cn3cc([N+](=O)[O-])cn3)cc2C1 163262453 UWJVVXXEDCTXAV-UHFFFAOYSA-N 334.357 1.640 5 50 EDBA NC(=O)C1(CNc2ccnc3c([N+](=O)[O-])cccc23)CCOCC1 432323619 RJHXTRPDFHEISQ-UHFFFAOYSA-N 330.344 1.837 5 50 EDBA Cc1nn(C)c(C)c1CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 14250049 DWTADQLAZDACIV-UHFFFAOYSA-N 338.389 1.766 5 50 EDBA CCOc1cc(CN2CCC(c3nc(=O)[nH][nH]3)CC2)ccc1[N+](=O)[O-] 289373812 INESWLHHAQDLCZ-UHFFFAOYSA-N 347.375 1.785 5 50 EDBA COCCC(C)(C)CNS(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1 273594434 KIFRDWGKCPHYOT-UHFFFAOYSA-N 346.405 1.944 5 50 EDBA O=[N+]([O-])c1ccccc1/C=C/CN1CCN(CCOCCO)CC1 2893762 OANUUVRSUMUBAP-HWKANZROSA-N 335.404 1.235 5 50 EDBA CCCn1c(=N)c(C(=O)NCC)cc2c(=O)n3cccc(C)c3nc21 100627772 DRCIAVLYIGHEAD-UHFFFAOYSA-N 339.399 1.597 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCS(=O)(=O)[C@H](C)[C@H]1C 121364305 SPSSEVDWYHYTSW-GHMZBOCLSA-N 326.374 1.551 5 50 EDBA CC[C@H](O)Cn1cnc2c(cnn2-c2ccc([N+](=O)[O-])cc2)c1=O 156413082 XZKZVVCZKBRBKS-LBPRGKRZSA-N 329.316 1.261 5 50 EDBA C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)C[C@H](C)O1 468361 PNQYUGPZNTWRKO-UWVGGRQHSA-N 332.312 1.951 5 50 EDBA COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C(=O)NCCF 282622895 YBWVIDXJRUTTEW-QMMMGPOBSA-N 328.300 1.199 5 50 EDBA C[C@H](NC(=O)c1nc(Cn2cc([N+](=O)[O-])cn2)no1)c1ccccc1 1431367 CPVJFHMNJWTMRJ-JTQLQIEISA-N 342.315 1.714 5 50 EDBA COc1cc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc(Br)c1O 85986 YXUKMPOZDZNNOS-KCJUWKMLSA-N 345.149 1.760 5 50 EDBA C[C@H](N[C@H]1CCCC[C@H]1C(N)=O)C(=O)Nc1cccc([N+](=O)[O-])c1 252485810 AJZHESPFPSKFCE-GDLCADMTSA-N 334.376 1.556 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCNC[C@H]2C)c1[N+](=O)[O-] 262745880 DQUOASRIPFJTKC-NEPJUHHUSA-N 327.406 1.488 5 50 EDBA C[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 177413683 BGZXUKDEWOVEFZ-GFCCVEGCSA-N 329.150 1.954 5 50 EDBA CN(C)c1ncnc2c1ncn2CCOc1ccc([N+](=O)[O-])cc1 195524038 NMXYSDUVSUBYCO-UHFFFAOYSA-N 328.332 1.880 5 50 EDBA CC(C)[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ncc[nH]1 225837930 GUAUOHJMAIWGJY-LBPRGKRZSA-N 331.332 1.770 5 50 EDBA Cc1sc(S(=O)(=O)NC[C@H](C2CC2)N(C)C)cc1[N+](=O)[O-] 123245354 WUQAEHFXSIMCQL-LLVKDONJSA-N 333.435 1.583 5 50 EDBA Cc1sc(NC(=O)c2nn(C)c(C)c2[N+](=O)[O-])c(C(N)=O)c1C 2781355 MAOIGLRHGLHZKX-UHFFFAOYSA-N 337.361 1.666 5 50 EDBA CS(=O)(=O)Nc1ccc([N+](=O)[O-])c(I)c1 242106258 WIGIGBXRYNYDHA-UHFFFAOYSA-N 342.114 1.571 5 50 EDBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@@H](c2cnccn2)C1 1475733836 FVEWMBSBCSOTOX-GFCCVEGCSA-N 348.384 1.871 5 50 EDBA O=C1N[C@H](Cc2ccc([N+](=O)[O-])cc2)C(=O)N1CCOCC(F)F 1775991603 RZRBKRLBOHDJLV-LLVKDONJSA-N 343.286 1.339 5 50 EDBA COC(=O)c1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 2325854299 WMYVQVOTUHMZEW-UHFFFAOYSA-N 337.313 1.577 5 50 EDBA CC(C)c1cc(C(N)=O)c(NC(=O)c2nn(C)cc2[N+](=O)[O-])s1 2735609 SPDOONCFSRCIAA-UHFFFAOYSA-N 337.361 1.864 5 50 EDBA CC(C)CN1CCO[C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1 240555802 GXIBWEBUJPTRIR-LBPRGKRZSA-N 336.392 1.462 5 50 EDBA O=C(NCc1ccco1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4189255 JSAVCWTWXLBEQH-UHFFFAOYSA-N 331.328 1.954 5 50 EDBA COc1ccc([N+](=O)[O-])c(NC(=O)[C@@H]2[C@H]3C[C@@H]4OC(=O)[C@@H]2[C@H]4C3)c1 239274626 ALRXWJUBPONYSE-KEHYKAFYSA-N 332.312 1.740 5 50 EDBA COC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CCCCN2C(C)C)c1=O 408525217 PPPKSTOUZVDFFO-LBPRGKRZSA-N 337.376 1.806 5 50 EDBA COC(=O)c1nc(N2CC[C@@H](C)C2)nc(N2CC[C@H](C)C2)c1[N+](=O)[O-] 408524547 VMIWQWIIPHLQDT-WDEREUQCSA-N 349.391 1.864 5 50 EDBA CCn1nccc1N1CCC[C@H](Nc2ncc([N+](=O)[O-])s2)C1=O 192548777 CRNLJKBBKZGUPE-VIFPVBQESA-N 336.377 1.875 5 50 EDBA O=C(OC[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 12174214 CTDJVXKTFRESFV-MRVPVSSYSA-N 344.301 1.095 5 50 EDBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCOCC2)C[C@@H](C)N1 4599820 SXEODHPFMLTBQZ-BETUJISGSA-N 348.403 1.254 5 50 EDBA CN(Cc1ccccc1)C1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 286362124 NGZHSAOCUYJHKH-UHFFFAOYSA-N 341.371 1.409 5 50 EDBA CC1([C@@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)CCO2)N=N1 1775998896 KDXKLOPPMDNLFT-NSHDSACASA-N 330.304 1.494 5 50 EDBA O=C(O)CN(c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1 4974100 LVQISGLPSDQDKH-UHFFFAOYSA-N 336.325 1.875 5 50 EDBA COc1ccc([N+](=O)[O-])c(C(=O)N[C@@](C)(C(N)=O)c2ccccc2)c1 150784387 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5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cnn(Cc2ccc(F)cc2)c1 4821287 YEQXBGAQDVYAGF-UHFFFAOYSA-N 344.306 1.814 5 50 EDBA CN(C)c1nccc(N2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)n1 408515944 BONUORUBSQLWJN-UHFFFAOYSA-N 343.391 1.360 5 50 EDBA CCOc1cc(NC(=O)N2C[C@@H]3C[C@H]2C[S@]3=O)ccc1[N+](=O)[O-] 1626005307 DUOJUIAYIDYEES-JOMGAKPTSA-N 339.373 1.731 5 50 EDBA CCOc1cccnc1N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 952994888 VXNDERAYGMBJTH-UHFFFAOYSA-N 345.363 1.087 5 50 EDBA Cc1c(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cnn1C 20028669 ZZEDEOMZPPDJMR-UHFFFAOYSA-N 343.387 1.595 5 50 EDBA CCc1ccccc1NC(=O)CN(C)Cc1nn(C)cc1[N+](=O)[O-] 2325784268 NXTASFRGNVAEBS-UHFFFAOYSA-N 331.376 1.961 5 50 EDBA CN(Cc1ccc(-n2cccn2)cc1)C(=O)Cn1cc([N+](=O)[O-])cn1 2755152 XRKKYRSZRJOEDN-UHFFFAOYSA-N 340.343 1.636 5 50 EDBA COc1cccc(Cn2c(-c3ccc([N+](=O)[O-])cc3)noc2=O)n1 171990502 LFYFRKNSXCIMOJ-UHFFFAOYSA-N 328.284 1.863 5 50 EDBA CNS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4CC[C@@H](C4)[C@@H]32)c([N+](=O)[O-])c1 242302082 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O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)cn1 195427411 APUVQRJYKYLPDE-FVQBIDKESA-N 345.380 1.997 5 50 EDBA CCOc1cc(NC(=O)N[C@@H](CO)c2ncc[nH]2)ccc1[N+](=O)[O-] 952879463 ISIDPTWHGGUVCQ-JTQLQIEISA-N 335.320 1.572 5 50 EDBA CCOC(=O)C1=C(C)NC(=O)N(C=O)[C@@H]1c1ccc([N+](=O)[O-])cc1 1384411 YRRKLSIBQMZIEK-CYBMUJFWSA-N 333.300 1.655 5 50 EDBA NC(=O)c1ccc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nn1 173986578 ZNBCAAMDIDEKSV-UHFFFAOYSA-N 343.343 1.532 5 50 EDBA Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ccc(-n2cccn2)cc1 2731729 UGFVYAZLGJXVGI-UHFFFAOYSA-N 326.316 1.444 5 50 EDBA Cc1ccc(C(=O)NC(=O)OCCn2c(C)cnc2[N+](=O)[O-])cc1 1425521 ZMLDPBUXPZYIKF-UHFFFAOYSA-N 332.316 1.975 5 50 EDBA CN1CCCN(S(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)CCC1 1776005196 DGMPYLFCLBWQQT-UHFFFAOYSA-N 331.369 1.450 5 50 EDBA CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](CC(N)=O)c1ccccc1 225439780 BTGQOIKCUOOVCR-HNNXBMFYSA-N 342.355 1.866 5 50 EDBA O=C([C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCCCO1 188106002 CZJUPJHMERPMON-JTQLQIEISA-N 337.307 1.641 5 50 EDBA NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 379815 XLKDXICZOMOOPU-UHFFFAOYSA-N 335.341 1.275 5 50 EDBA Cc1nc(C)c(CNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])[nH]1 952992476 FWNWCSVNGVQAQI-UHFFFAOYSA-N 325.350 1.194 5 50 EDBA CN1CCN(CCCNc2c([N+](=O)[O-])c(=O)oc3ccccc23)CC1 3896376 JKTMNPGWRZOVJZ-UHFFFAOYSA-N 346.387 1.751 5 50 EDBA Cc1noc([C@@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1 285038350 WAKUTOYIBFBPRX-HNNXBMFYSA-N 331.376 1.817 5 50 EDBA O=C(c1cc[nH]c(=O)c1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 133888861 WYOJRBSLZIGMKZ-UHFFFAOYSA-N 343.339 1.967 5 50 EDBA CON1CCC(N(C)C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC1 457315811 UZCVOYDRXDPXHG-UHFFFAOYSA-N 336.392 1.515 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CCNC3)CC2)cc1 431022903 PHOUSLKOXQHEEZ-UHFFFAOYSA-N 325.390 1.359 5 50 EDBA O=C1CC2(CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)CC2)CN1 408025405 RBUSSAJJQJJZOO-UHFFFAOYSA-N 342.355 1.818 5 50 EDBA C[C@H](NC(=O)COc1ccsc1[N+](=O)[O-])C(=O)N1CCCCC1 408525094 KOHDYWDQWOZBTR-JTQLQIEISA-N 341.389 1.552 5 50 EDBA O=C(C1CC(N2CCOCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 1875361394 ZBCCRNFIEFCFSR-UHFFFAOYSA-N 331.372 1.595 5 50 EDBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2cnn(CC(F)(F)F)c2)n1 2786002 XILRGBVAQAGMHG-UHFFFAOYSA-N 332.242 1.822 5 50 EDBA C[C@H](NC(=O)c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1ncon1 155544067 XMKAOBIYUUJNLR-QMMMGPOBSA-N 328.288 1.859 5 50 EDBA Cc1nc([N+](=O)[O-])c(N[C@@H]2CCN(c3ccccc3C(N)=O)C2)n1C 1875257788 NSXCYDOMQMOBHG-LLVKDONJSA-N 344.375 1.426 5 50 EDBA COC[C@H](O)CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 19300915 RQMSCGBYCPPRLN-GFCCVEGCSA-N 329.784 1.378 5 50 EDBA COC(=O)C[C@@H]1SC(=O)N(CNc2ccc([N+](=O)[O-])cc2)C1=O 3904152 JBPITLXHUZTIIP-JTQLQIEISA-N 339.329 1.591 5 50 EDBA C[C@@H](C(=O)NCCc1nc2ccccc2[nH]1)n1cc([N+](=O)[O-])cn1 1432091 FWGCYFJQEQQTIX-JTQLQIEISA-N 328.332 1.588 5 50 EDBA N[C@H]1CCC[C@]12CCN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C2 170611015 YOJOUWAEYLTUAH-UONOGXRCSA-N 325.390 1.487 5 50 EDBA NC(=O)[C@@]1(O)CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 286292636 TXJSQKJOIHRTAF-MRXNPFEDSA-N 346.343 1.062 5 50 EDBA O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC(Nc2cccnn2)CC1 253418663 VEWALRIJANERIS-UHFFFAOYSA-N 343.343 1.807 5 50 EDBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@@H](Cn2ccnn2)C1 162686458 XUIHAZDJFMNMFM-LLVKDONJSA-N 331.332 1.444 5 50 EDBA COC(=O)CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 4818917 KDDZSTUCUWHUJS-UHFFFAOYSA-N 342.251 1.473 5 50 EDBA CC1(C)[C@H](C(=O)O)[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 34926368 NXOJDWWMFVLDHT-KBPBESRZSA-N 347.371 1.600 5 50 EDBA O=C(N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O)C1CCSCC1 1875352943 GVDAKOJTRPLYRK-CYBMUJFWSA-N 338.385 1.850 5 50 EDBA Cc1ccc(-n2nnnc2Sc2nc([N+](=O)[O-])nn2C)c(C)c1 621269 CTPWWHGJMRNGPD-UHFFFAOYSA-N 332.349 1.467 5 50 EDBA COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 4866245 IZMCEPBVFRXWOR-ZDUSSCGKSA-N 335.316 1.412 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccn(Cc2ccccc2)n1 374926 FWHXTCQFWJNAJA-UHFFFAOYSA-N 326.316 1.675 5 50 EDBA CC1(C)NC(=O)N(CCOCCOc2ccc([N+](=O)[O-])cc2)C1=O 2862819 WYKZVPDINNZNPB-UHFFFAOYSA-N 337.332 1.321 5 50 EDBA COc1ccc(C(=O)NCC(=O)Nc2cnc(C)nc2)cc1[N+](=O)[O-] 343891766 ZIRVGFNTGWLALR-UHFFFAOYSA-N 345.315 1.070 5 50 EDBA O=C1CCc2cc([N+](=O)[O-])c(N3CCC[C@H](c4nnc[nH]4)C3)cc2N1 253430785 OBECPINKELWCEP-NSHDSACASA-N 342.359 1.982 5 50 EDBA COC(=O)c1cn([C@H]2CCCN(c3cc(N)ccc3[N+](=O)[O-])C2)nn1 241435118 NKUFXYVOFHARNJ-NSHDSACASA-N 346.347 1.397 5 50 EDBA CC(=O)[C@@H]1CCCCN1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 408523740 MUWHXZOWHXYWAM-HNNXBMFYSA-N 340.401 1.812 5 50 EDBA Nc1ccc([N+](=O)[O-])cc1C(=O)NCCCc1nnc2ccccn12 170604999 KJQVFLCCLLAWRL-UHFFFAOYSA-N 340.343 1.582 5 50 EDBA COc1cc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc([N+](=O)[O-])c1 8836519 NTZMLTFXEYSJGB-UHFFFAOYSA-N 349.303 1.964 5 50 EDBA CNC(=O)c1ccn([C@@H]2CCCN(c3c([N+](=O)[O-])c(C)nn3C)C2)n1 239654527 BOENRFXXIAKQAU-LLVKDONJSA-N 347.379 1.034 5 50 EDBA O=C(COc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccn2)CC1 18221747 BQTMTUXJUCCSIM-UHFFFAOYSA-N 342.355 1.717 5 50 EDBA CS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 4499338 CWQWNXULJGPZRF-UHFFFAOYSA-N 336.373 1.225 5 50 EDBA C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](n2cncn2)C1 229820487 WQFXGVRVPTUMDY-CHWSQXEVSA-N 344.375 1.850 5 50 EDBA Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccn(-c2ccccc2)n1 241135416 JPCVNWKQUZWFNI-UHFFFAOYSA-N 338.327 1.688 5 50 EDBA CC[C@H](c1nc2c3cnn(C)c3ncn2n1)n1cc([N+](=O)[O-])cn1 2802168 BNUAFZWPOXRMFE-SNVBAGLBSA-N 327.308 1.115 5 50 EDBA COc1ccc(S(=O)(=O)Nc2ccc3nn[nH]c3c2)c([N+](=O)[O-])c1 408513090 BFRJFUGJFPDIPH-UHFFFAOYSA-N 349.328 1.676 5 50 EDBA CC(C)c1[nH]nc(C(=O)NC[C@]2(N(C)C)CCSC2)c1[N+](=O)[O-] 269524694 QXONTVLQCGRQBE-CQSZACIVSA-N 341.437 1.608 5 50 EDBA Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 191699076 ZGATWWKVVAAMTF-GFCCVEGCSA-N 344.375 1.585 5 50 EDBA COc1cc(OC)cc(C(=O)NCCn2nc([N+](=O)[O-])cc2C)c1 2799022 GVVAULWNZCEHHK-UHFFFAOYSA-N 334.332 1.547 5 50 EDBA Cc1[nH]c2ccccc2c1CCNC(=O)Cn1cnc([N+](=O)[O-])n1 32848 LQGSXABQFZTPPP-UHFFFAOYSA-N 328.332 1.335 5 50 EDBA Cc1cc(S(=O)(=O)N[C@H](CC(C)C)C(=O)O)ccc1[N+](=O)[O-] 261688837 MSMLXVMLVDWREZ-LLVKDONJSA-N 330.362 1.681 5 50 EDBA COC(=O)c1cc(C)nc(N2CCC[C@@H](c3nc[nH]n3)C2)c1[N+](=O)[O-] 367278812 NMZNKXHKZUVIFF-SNVBAGLBSA-N 346.347 1.587 5 50 EDBA CN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1CO 952881818 HJRIXZXPHCHPFP-JTQLQIEISA-N 328.756 1.388 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CC2CCNCC2)CC1 178974792 OMLJCWLMNSCBJE-UHFFFAOYSA-N 332.404 1.352 5 50 EDBA O=C(CN1CCN2CCC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1Cl 239309548 HRIZPXKGDJRAJT-LBPRGKRZSA-N 338.795 1.967 5 50 EDBA Cc1nc(NCC[C@@]2(O)C(=O)Nc3ccccc32)ccc1[N+](=O)[O-] 877870859 HDZPCCVVWWFEJG-INIZCTEOSA-N 328.328 1.940 5 50 EDBA Cc1cccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1[N+](=O)[O-] 465898 NCGZOAZVVWNQRT-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA C[C@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1S(C)(=O)=O 4117402 OQGHLSPKDQJJAF-VIFPVBQESA-N 333.797 1.718 5 50 EDBA CN(C[C@H](O)COCc1ccccc1)c1ccnc([N+](=O)[O-])c1N 253433071 RJZFLBJZXVIOAQ-ZDUSSCGKSA-N 332.360 1.586 5 50 EDBA Cc1ccc(S(=O)(=O)N2CCCN3CCC[C@H]3C2)c([N+](=O)[O-])c1 248009628 IFVQMVAUOUJKHW-ZDUSSCGKSA-N 339.417 1.762 5 50 EDBA O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@H](Cn2ccnn2)C1 162686342 XUIHAZDJFMNMFM-NSHDSACASA-N 331.332 1.444 5 50 EDBA COC(=O)c1ccnc(NCc2cnn3c2CCCC3)c1[N+](=O)[O-] 1262210014 JDYNQGRHXYGWDT-UHFFFAOYSA-N 331.332 1.921 5 50 EDBA Cc1cccc(N2CCN(c3ncccc3C(N)=O)CC2)c1[N+](=O)[O-] 225458950 OFBYOIYLNAYLGY-UHFFFAOYSA-N 341.371 1.724 5 50 EDBA COc1ccc(NC(=O)[C@@H](C)N(C)CCC(=O)O)c([N+](=O)[O-])c1 262684737 XKFLXXXTKLMPFD-SECBINFHSA-N 325.321 1.337 5 50 EDBA O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1ccccc1O 188998 ITSCEWJEXXLFBI-UHFFFAOYSA-N 341.279 1.535 5 50 EDBA CNC(=O)N[C@@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 341530219 HBLQLONJTJBRSF-SNVBAGLBSA-N 332.320 1.153 5 50 EDBA CS(=O)(=O)N(CC(=O)NC1CCCC1)c1cccc([N+](=O)[O-])c1 555669 ZUZITJYTDBEKJL-UHFFFAOYSA-N 341.389 1.420 5 50 EDBA Cc1ccc([N+](=O)[O-])c(N2CCC(CN3CCN(C)CC3)CC2)n1 122127986 YMIVINNDUBTRIH-UHFFFAOYSA-N 333.436 1.762 5 50 EDBA COC(=O)CCCc1nc(COc2ccc(N)c([N+](=O)[O-])c2)no1 241126085 JJKLPPVQHJZCBZ-UHFFFAOYSA-N 336.304 1.635 5 50 EDBA CCc1[nH]nc(C(=O)N[C@@H](CO)Cc2ccc(C)cc2)c1[N+](=O)[O-] 192933708 QTFJFMGORAGABX-GFCCVEGCSA-N 332.360 1.522 5 50 EDBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2 35826289 BOXKKTMOTZGMSL-AUWAKTMTSA-N 332.312 1.740 5 50 EDBA CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2ccccc2)C(=O)C1 361013042 HZPGESBRWRVTJY-UHFFFAOYSA-N 329.360 1.973 5 50 EDBA Cc1cc(NC(=O)C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)no1 242302301 YRERELBSEPOYHT-UHFFFAOYSA-N 332.320 1.536 5 50 EDBA Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N2CCN[C@H](C)C2)c1 193279897 NLYBJLKRDGJRML-SECBINFHSA-N 333.797 1.539 5 50 EDBA CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@]12CCCO2 274152687 GEBURAKTCVBOGW-CKEIUWERSA-N 349.387 1.942 5 50 EDBA CNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(C(C)C)c1=N 100677518 WDXKKHCTSLAHPJ-UHFFFAOYSA-N 325.372 1.378 5 50 EDBA aggregator O=[N+]([O-])C1=C(Nc2cc(Br)ccc2O)CS(=O)(=O)C1 22782307 IQJGLPBIDBEICA-UHFFFAOYSA-N 349.162 1.483 5 50 EDBA CC[C@@H](C)NS(=O)(=O)c1ccc(N2CCCC2=O)c([N+](=O)[O-])c1 4611165 HWLFRUMOLYOLRN-SNVBAGLBSA-N 341.389 1.798 5 50 EDBA COc1cccc([C@H]2CCCN2C(=O)Cn2ncc([N+](=O)[O-])c2N)c1 127545962 HLOCXVUIRSCFSM-CYBMUJFWSA-N 345.359 1.746 5 50 EDBA Cc1c(F)cc(S(=O)(=O)Nc2cc(C)n(C)n2)cc1[N+](=O)[O-] 170599565 BAJUIXPUFOBAJF-UHFFFAOYSA-N 328.325 1.885 5 50 EDBA C[C@@H]1OCC[C@@]12CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C[C@@H](C)O2 279234643 GSPHNFQZDXYVIL-OHUAYANFSA-N 335.360 1.586 5 50 EDBA CN1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1CO 864090976 HOTWVNLSLJMNBB-OAHLLOKOSA-N 332.360 1.358 5 50 EDBA O=C(CN1CCC[C@H](c2cnn[nH]2)C1)Nc1ccccc1[N+](=O)[O-] 1875273769 BCLXKVRHONCRGM-NSHDSACASA-N 330.348 1.531 5 50 EDBA C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)[C@H]1CCCO1 1054836 PYPKJEBAJJXXHF-NOZJJQNGSA-N 332.312 1.999 5 50 EDBA CC1=NN(C(=O)[C@H](C)n2nc([N+](=O)[O-])cc2C)[C@](O)(C(F)F)C1 6922280 JWTBURMIOYXIOA-QPUJVOFHSA-N 331.279 1.223 5 50 EDBA COC(=O)C1=C(C)Nc2ncnn2[C@@H]1/C=C/c1ccc([N+](=O)[O-])o1 1066070 DELJTDIOLUXRNW-RXNUUUNCSA-N 331.288 1.906 5 50 EDBA CCN(CC(OC)OC)C[C@H](O)COc1cccc([N+](=O)[O-])c1 952880857 MIPPHUSARWYFGJ-ZDUSSCGKSA-N 328.365 1.275 5 50 EDBA N=c1c(C(N)=O)cc2c(=O)n3ccccc3nc2n1Cc1ccccc1 100398361 IZMBZGJPJJNMPS-UHFFFAOYSA-N 345.362 1.276 5 50 EDBA NC[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 170684848 MXZFDMDWNQPYMA-ZANVPECISA-N 331.369 1.530 5 50 EDBA Cc1ccc(S(=O)(=O)Nc2ccccc2C(N)=O)c([N+](=O)[O-])c1 614218 IDYLDZAOTJKBSV-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA COc1ccc(CCNC(=O)c2cc(C)nc(O)c2[N+](=O)[O-])cc1 253406106 VYDHRFHZIBELII-UHFFFAOYSA-N 331.328 1.985 5 50 EDBA Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCc2ncnn2C1 191382822 AREYXLFMJFAZPF-NSHDSACASA-N 330.348 1.940 5 50 EDBA O=C(CCCn1cc([N+](=O)[O-])cn1)Nc1ncc([N+](=O)[O-])s1 12428311 UEIOIOKMTJKOHQ-UHFFFAOYSA-N 326.294 1.575 5 50 EDBA C[C@H]1CNCCN1S(=O)(=O)c1ccc([N+](=O)[O-])c2cccnc12 193246778 HUZMFQJRUHKCHF-JTQLQIEISA-N 336.373 1.125 5 50 EDBA CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@@]12CCCO2 274152690 GEBURAKTCVBOGW-CPUCHLNUSA-N 349.387 1.942 5 50 EDBA COC(=O)CN1C(=O)S/C(=C/c2cccc([N+](=O)[O-])c2O)C1=O 13880765 VWVWEGUHELJMAP-WEVVVXLNSA-N 338.297 1.510 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccc(-n2cccc2)cc1 1426624 ZGOIPNWHBGNLOK-UHFFFAOYSA-N 325.328 1.898 5 50 EDBA COc1ccc(NC(=O)[C@H](C)N(C)CCC(=O)O)c([N+](=O)[O-])c1 262684738 XKFLXXXTKLMPFD-VIFPVBQESA-N 325.321 1.337 5 50 EDBA COC(=O)[C@@H]1C[C@@H](O)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 170090996 ZNEAXJPIORTDSQ-OCCSQVGLSA-N 343.339 1.769 5 50 EDBA Cc1noc(CNC(=O)c2cccc([N+](=O)[O-])c2Br)n1 159077562 MYASLKMJAPRFBF-UHFFFAOYSA-N 341.121 1.979 5 50 EDBA CC1=NN(C(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)[C@@](O)(C(F)(F)F)C1 6394919 CJKJTRNYEAJKFC-XCBNKYQSSA-N 335.242 1.211 5 50 EDBA COC(=O)c1cn([C@H]2CCCN(c3ccc([N+](=O)[O-])c(C)n3)C2)nn1 253429394 SEFCEASPFXYAOA-NSHDSACASA-N 346.347 1.518 5 50 EDBA CCNC(=O)CN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 314699505 APEJXGDNPOMDIY-UHFFFAOYSA-N 349.796 1.395 5 50 EDBA CC(C)(CO)Nc1cc(N2CCOCC2)c([N+](=O)[O-])cc1[N+](=O)[O-] 3880483 KBORAUJAPBGUAS-UHFFFAOYSA-N 340.336 1.522 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1NCC[C@]1(O)C(=O)Nc2ccccc21 877871905 WXRLFIHGDCMXJK-MRXNPFEDSA-N 345.359 1.762 5 50 EDBA O=C([C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)N1CCCCO1 188105978 CZJUPJHMERPMON-SNVBAGLBSA-N 337.307 1.641 5 50 EDBA Cc1ccc(S(=O)(=O)NCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 5794719 RKPVARJOWZGDSF-UHFFFAOYSA-N 349.368 1.820 5 50 EDBA O=c1[nH]c(/C=C/c2coc3ccccc3c2=O)nc(O)c1[N+](=O)[O-] 17056406 YPWUBPOUWBRUIA-AATRIKPKSA-N 327.252 1.661 5 50 EDBA COC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@H]12 34929112 INMSNIOAXIMXNT-CKUKBARFSA-N 331.328 1.400 5 50 EDBA C[C@@H]1OCC[C@]12CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C[C@@H](C)O2 279234632 GSPHNFQZDXYVIL-GDLVEWKHSA-N 335.360 1.586 5 50 EDBA COC(=O)c1cc(C)nc(N2CCC[C@H](c3nc[nH]n3)C2)c1[N+](=O)[O-] 367278811 NMZNKXHKZUVIFF-JTQLQIEISA-N 346.347 1.587 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCOc2c(Cl)cccc21 158295611 WCMMTTBXCFMBLJ-UHFFFAOYSA-N 349.730 1.836 5 50 EDBA CCOC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N[C@]1(C)O 245238394 MZJXZKVHHNSFHZ-COPLHBTASA-N 339.373 1.001 5 50 EDBA CC(C)Oc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)nn1 408514798 ZRGHUSVIJKFSAB-UHFFFAOYSA-N 338.345 1.973 5 50 EDBA CN(C)Cc1nc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])co1 952878657 CWEFAXFFVGPITQ-UHFFFAOYSA-N 340.361 1.123 5 50 EDBA CC(C)(CO)[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 239672679 BURGHTVEUSMEFD-JKSUJKDBSA-N 348.403 1.502 5 50 EDBA C[C@@H]1CN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C[C@@H](C2CC2)O1 280466568 MRSFDEDZUIVNPH-OTYXRUKQSA-N 341.389 1.246 5 50 EDBA Cc1cc(C(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc([N+](=O)[O-])c1 263015628 SRMCXZINFLDSDG-CQSZACIVSA-N 336.344 1.760 5 50 EDBA CC[C@H](NC(=O)[C@H]1C[C@H](O)CN1C(C)=O)c1cccc([N+](=O)[O-])c1 277716923 PHHYTDHWBTVDKW-SOUVJXGZSA-N 335.360 1.144 5 50 EDBA CC(=O)c1cc(NC[C@H]2CCN(S(C)(=O)=O)C2)ccc1[N+](=O)[O-] 225822789 BHVQJQAREHPEQM-LLVKDONJSA-N 341.389 1.491 5 50 EDBA O=C(Nc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C(=O)Nc2ccccc21 1875390521 NTXHUFRZADUPKC-ZDUSSCGKSA-N 325.280 1.838 5 50 EDBA O=C(c1cccc(/C=C/N2CCOCC2)c1[N+](=O)[O-])N1CCOCC1 49574147 OKFLZDXWVLCGMM-SNAWJCMRSA-N 347.371 1.370 5 50 EDBA COC(=O)[C@]1(C)CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H]1C 242389565 ZYIYEHYWYGASRK-SJKOYZFVSA-N 349.387 1.978 5 50 EDBA COc1ccc(C(=O)CSc2nc(C)cc(=O)[nH]2)cc1[N+](=O)[O-] 5060877 WWLDSSDQKXXGOM-UHFFFAOYSA-N 335.341 1.970 5 50 EDBA O=C(c1cc(N2CCOCC2)c(F)cc1[N+](=O)[O-])N1CCOCC1 4543772 HCEJDAOSRNGJOC-UHFFFAOYSA-N 339.323 1.043 5 50 EDBA CNC(=O)N[C@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1644556379 VECGNACYDHHGFT-NSHDSACASA-N 345.359 1.610 5 50 EDBA CCn1ncc(CN(C)C(=O)[C@@H](C)n2cc([N+](=O)[O-])c(C)n2)c1C 2776976 PPYOYPCIWJXHRC-GFCCVEGCSA-N 334.380 1.844 5 50 EDBA 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BVSHAMCQGWEPOJ-OAHLLOKOSA-N 332.360 1.169 5 50 EDBA COC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(OC)c(O)c([N+](=O)[O-])c1 35961608 UHYSDUWVTLGVSS-LLVKDONJSA-N 337.288 1.110 5 50 EDBA NC(=O)[C@]1(O)CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 286292630 TXJSQKJOIHRTAF-INIZCTEOSA-N 346.343 1.062 5 50 EDBA O=C(O)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 222495777 OWPVEEOWFPPUHS-WISYIIOYSA-N 338.703 1.841 5 50 EDBA COC(OC)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 408515686 YQVYOBITUCQLCF-AWEZNQCLSA-N 334.332 1.268 5 50 EDBA NC(=O)C(F)(F)[C@]1(O)CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 1775991705 TVXOWCTUGLOHQQ-NSHDSACASA-N 335.694 1.310 5 50 EDBA NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1CC(=O)Nc1ccc([N+](=O)[O-])cc1 229790098 VMBHBANHSUWHLA-UGFHNGPFSA-N 346.387 1.652 5 50 EDBA COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCN1CC=CCC1 253419556 PJJSBDQBOHGDSD-UHFFFAOYSA-N 341.389 1.144 5 50 EDBA CN(c1cccnn1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl 190402371 CJIDHKRQZDPCAX-UHFFFAOYSA-N 328.737 1.863 5 50 EDBA 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NS(=O)(=O)c1ccc(N2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 798415982 KCVWHCKXXRVTJC-LLVKDONJSA-N 348.384 1.631 5 50 EDBA O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N1C[C@@H]2CC[C@H](C1)O2 374092244 MVXKHQAXGSEDRC-DTORHVGOSA-N 348.327 1.959 5 50 EDBA Cc1cnc(N(C)C2CCN(S(C)(=O)=O)CC2)c([N+](=O)[O-])c1 268298450 XBUMUOTYZCGVHF-UHFFFAOYSA-N 328.394 1.158 5 50 EDBA CCCn1c(=O)c(F)cn(Cc2ccc(OC)c([N+](=O)[O-])c2)c1=O 380800 OYMCDBNBZMNZLV-UHFFFAOYSA-N 337.307 1.524 5 50 EDBA COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1cnn(C)c1C(N)=O 17068729 FXFIWORBSFOYDP-UHFFFAOYSA-N 334.292 1.080 5 50 EDBA O=[N+]([O-])c1cnn(C[C@H](O)CN2CCO[C@@H](c3ccsc3)C2)c1 229945501 LUDGILIDSUZINW-ZIAGYGMSSA-N 338.389 1.287 5 50 EDBA CC(C)(C)OC(=O)[C@]1(C)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 328597431 HDTNCJQCPRASKV-OAHLLOKOSA-N 338.364 1.372 5 50 EDBA Cc1ccc(S(=O)(=O)N2CCN3CCCC[C@H]3C2)cc1[N+](=O)[O-] 242167626 WYCDMBZQOYLYRN-ZDUSSCGKSA-N 339.417 1.762 5 50 EDBA COc1ccc([N+](=O)[O-])c(C(=O)N[C@](C)(C(N)=O)c2ccccc2)c1 150784413 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COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H]3C=C[C@@](C)(O3)[C@@H]2C1=O 101358157 ZIJPMAAJMQFPFS-QOFRNUMZSA-N 330.296 1.436 5 50 EDBA CC[N@+]1(C)[C@H]2C[C@@H](OC(=O)[C@@H](CO)c3ccccc3)C[C@H]1C[C@H]2O 245253985 XCNYCAGTMKJDDN-IHEFFSNCSA-N 334.436 1.436 5 50 EDBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](N2CC=CC2)C1 170604929 JRUJILOYUASCLR-CYBMUJFWSA-N 337.401 1.449 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCC(N2CCCNC2=O)CC1 192708382 VBXGGGKDXIYTHV-UHFFFAOYSA-N 336.396 1.504 5 50 EDBA CNc1cc(N2CCC[C@@H]2CNc2c([N+](=O)[O-])c(C)nn2C)ncn1 114709475 INNUDKBEXYYCRQ-LLVKDONJSA-N 346.395 1.549 5 50 EDBA O=[N+]([O-])c1ccc(N2CCN(c3ncccn3)CC2)c([N+](=O)[O-])c1 4054495 JDIDJBQLWLLWRX-UHFFFAOYSA-N 330.304 1.620 5 50 EDBA C[C@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1 186979272 FYAYATUMTHOQTH-WCQYABFASA-N 335.360 1.476 5 50 EDBA Cc1ccc(N(C)Cc2nnc3n2CCN(C)C3=O)c([N+](=O)[O-])c1 952993008 UNHLJJADFOHQPT-UHFFFAOYSA-N 330.348 1.217 5 50 EDBA O=C1CCc2cc(C(=O)Cn3cccc([N+](=O)[O-])c3=O)c(F)cc2N1 253393077 QDKNXYSPJIAXTM-UHFFFAOYSA-N 345.286 1.663 5 50 EDBA Cc1c(CC(=O)N2CCC(N3CCNC3=O)CC2)cccc1[N+](=O)[O-] 162237956 XHIXQOXUTMZXJD-UHFFFAOYSA-N 346.387 1.462 5 50 EDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1[C@H]2CC[C@H]1CN(C)C2 952881130 FNENOAZGVDNZOB-RYUDHWBXSA-N 325.390 1.370 5 50 EDBA CC(=O)c1cc(=O)n(CC(=O)N(C2CC2)[C@@H](C)C2CC2)cc1[N+](=O)[O-] 1775998735 HLMXRHLBFXDHOX-JTQLQIEISA-N 347.371 1.749 5 50 EDBA O=C(COc1ccc([N+](=O)[O-])cc1)NN1C(=O)c2ccccc2C1=O 450526 QTTCUCJPCVMZSD-UHFFFAOYSA-N 341.279 1.301 5 50 EDBA CC(C)(C)NC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O 2813591 CGIKOLHXWHDHRU-UHFFFAOYSA-N 329.378 1.276 5 50 EDBA O=C(c1cccnc1)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19773644 JXOYYWSLUORUHH-UHFFFAOYSA-N 326.356 1.948 5 50 EDBA O=C(Nc1ccccc1)N[C@H](CO)[C@H](O)c1cccc([N+](=O)[O-])c1 25668054 NQHNSKIUPNZUCN-HUUCEWRRSA-N 331.328 1.811 5 50 EDBA COC(=O)c1sccc1NC(=O)Cn1cccc([N+](=O)[O-])c1=O 357026667 FPAUKXJNZJEKRE-UHFFFAOYSA-N 337.313 1.243 5 50 EDBA CN(C(=O)[C@H]1CSCN1C(=O)Cc1cccc([N+](=O)[O-])c1)C1CC1 173004996 JCCIYJNTNSIMMG-CQSZACIVSA-N 349.412 1.660 5 50 EDBA Nc1ccc([N+](=O)[O-])c(N2CCS(=O)(=O)c3ccccc3C2)c1 193505046 MSKRBMXERSSQGO-UHFFFAOYSA-N 333.369 1.971 5 50 EDBA CN1CC[C@@H]2CC[C@H](C1)N2C[C@@H](O)COc1cccc([N+](=O)[O-])c1 887268123 CHPZDPDUTORXFM-NUEKZKHPSA-N 335.404 1.503 5 50 EDBA C[C@]1(c2ccccc2)COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 408515228 KCUQOIMKILDCPA-MRXNPFEDSA-N 330.344 1.566 5 50 EDBA O=C(Cn1nc([N+](=O)[O-])nc1Br)Nc1ccccc1F 1433044 YOOQAHSXACAQOB-UHFFFAOYSA-N 344.100 1.727 5 50 EDBA C[C@@H](O)CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 194016112 VGKOUZLEGLJKDC-GHMZBOCLSA-N 325.340 1.261 5 50 EDBA C[C@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1 177262637 PSPHKHMIVKOPMK-YOEHRIQHSA-N 335.404 1.626 5 50 EDBA Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCc2ncnn2C1 191382803 AREYXLFMJFAZPF-LLVKDONJSA-N 330.348 1.940 5 50 EDBA CS(=O)(=O)N(CC(=O)c1ccccc1)c1ccc([N+](=O)[O-])nc1 196212217 RLHPRPGSJJWKIS-UHFFFAOYSA-N 335.341 1.639 5 50 EDBA CC(C)(CC(=O)Nc1cc([N+](=O)[O-])n[nH]1)NC(=O)OC(C)(C)C 1471841196 FZXXZIFOMCFTCU-UHFFFAOYSA-N 327.341 1.950 5 50 EDBA O=C1C[C@@H](NNc2ccc([N+](=O)[O-])cc2)C(=O)N1c1ccc(O)cc1 101128317 HTEMGQFKCWXZDE-CQSZACIVSA-N 342.311 1.549 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCNC[C@H]2C)c1[N+](=O)[O-] 262745887 DQUOASRIPFJTKC-VXGBXAGGSA-N 327.406 1.488 5 50 EDBA CC(C)C[C@H]1C(=O)NCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 408519723 VVDLAMJHONGZTI-KBPBESRZSA-N 335.360 1.001 5 50 EDBA COC(=O)c1cc(C)nc(N2CC[C@@H](c3cnccn3)C2)c1[N+](=O)[O-] 952877027 KZJKGOKPDXPHDC-LLVKDONJSA-N 343.343 1.869 5 50 EDBA Cc1ccc(S(=O)(=O)N2c3ncnn3CC[C@H]2C)cc1[N+](=O)[O-] 952994791 QZJDXKGLJMTBRN-SNVBAGLBSA-N 337.361 1.482 5 50 EDBA Cn1nnnc1-c1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 172716842 BDFSWURSRFTWPK-UHFFFAOYSA-N 338.327 1.967 5 50 EDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 238899456 GLPVABDMHWQFSD-ULQWKZLWSA-N 328.324 1.435 5 50 EDBA CC[C@H]1[C@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@@H]2[C@@H]5O)[N@@+]3(C)[C@@H]1O 252461622 NCFABVDNFAPWSM-GOYARJDXSA-N 341.475 1.699 5 50 EDBA biogenic CC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](O)c1c(F)cccc1F 272283018 UBNGERPVZCUJOQ-TVQRCGJNSA-N 340.286 1.838 5 50 EDBA O=[N+]([O-])c1cnc(N2CCC[C@@H](N3CCCS3(=O)=O)C2)c(F)c1 408462622 AEMSXDFNICUBJC-SNVBAGLBSA-N 344.368 1.133 5 50 EDBA CC1(C)[C@H](O)C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 408514028 CKJDZIRAPZREFH-CHWSQXEVSA-N 328.390 1.118 5 50 EDBA Cc1ccc(S(=O)(=O)N2c3ncnn3CC[C@@H]2C)cc1[N+](=O)[O-] 952994790 QZJDXKGLJMTBRN-JTQLQIEISA-N 337.361 1.482 5 50 EDBA COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@H]2C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 101359978 JZWIDVBSRXHVQQ-OQMKEHIESA-N 330.296 1.436 5 50 EDBA COc1cc(C(=O)N2CCC(c3nn[nH]n3)CC2)cc([N+](=O)[O-])c1C 864234214 QWFKHUYYHMMXCE-UHFFFAOYSA-N 346.347 1.445 5 50 EDBA CS(=O)(=O)N1CCC[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)C1 1060605 UTCFKFMBDIUDDS-JTQLQIEISA-N 327.362 1.205 5 50 EDBA CN1CCN(CCc2nnc(S)n2-c2ccc([N+](=O)[O-])cc2)CC1 22590867 KNNVFHIHBHQESY-UHFFFAOYSA-N 348.432 1.254 5 50 EDBA COC(=O)C(C(=O)OC)c1ccc(Br)cc1[N+](=O)[O-] 34734363 NJAONFWUEGWOPG-UHFFFAOYSA-N 332.106 1.787 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2CN(c3ccccc3)C[C@H]2C1 408518709 VYBLQIZBMGVJEB-KBPBESRZSA-N 341.371 1.386 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])c(NC(=O)[C@@H]2CCCO2)c1)[C@@H]1CCCO1 4901999 LNSSGSMRMLZMLW-KBPBESRZSA-N 349.343 1.830 5 50 EDBA CCOC(=O)[C@@H](CC(C)C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3026362 QQHWDWJDLZAGEL-CYBMUJFWSA-N 344.389 1.851 5 50 EDBA Cc1nc(N2CCCC[C@H]2CCNS(C)(=O)=O)ccc1[N+](=O)[O-] 268481236 LKRBWHRCIQKLCH-LBPRGKRZSA-N 342.421 1.596 5 50 EDBA O=C1C[C@H](NNc2ccc([N+](=O)[O-])cc2)C(=O)N1c1ccc(O)cc1 4808843 HTEMGQFKCWXZDE-AWEZNQCLSA-N 342.311 1.549 5 50 EDBA NS(=O)(=O)c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 71769604 UUZKJPOBWQCXEM-UHFFFAOYSA-N 336.329 1.886 5 50 EDBA O=C(COc1ccc([N+](=O)[O-])cc1Br)N1CCOCC1 133663403 VXWBVIDEPHOWJJ-UHFFFAOYSA-N 345.149 1.595 5 50 EDBA Cn1ccc(N2CCC[C@H](NC(=O)c3ccc([N+](=O)[O-])s3)C2=O)n1 172848722 MTUOZAMTSRDOBJ-VIFPVBQESA-N 349.372 1.315 5 50 EDBA O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCN2CCCC[C@H]2C1 242047988 VRUARNYJDULMHC-LSDHHAIUSA-N 335.404 1.505 5 50 EDBA Cc1cc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2n1 1423770 MIPHRMPRSCNYGQ-UHFFFAOYSA-N 325.328 1.964 5 50 EDBA COc1ccc([N+](=O)[O-])c(CC(=O)NCCN2CCCCC2)c1F 408521425 TZIHSIKRXGZNTG-UHFFFAOYSA-N 339.367 1.887 5 50 EDBA C[C@H]1C[C@H](NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])NC(=S)N1 3900043 NSEZPKCKNUNQKV-WKEGUHRASA-N 326.338 1.002 5 50 EDBA Cc1nn([C@H](C)c2nc3c4cnn(C)c4ncn3n2)cc1[N+](=O)[O-] 2802661 PLDKCBNJJKQUQJ-MRVPVSSYSA-N 327.308 1.033 5 50 EDBA CC1=NN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@](O)(C(F)(F)F)C1 6394800 AOMSKJNRMHAZPM-NSHDSACASA-N 349.269 1.386 5 50 EDBA COc1ccc(Cn2ccc3nc4ccn(N)c(=O)c4cc3c2=O)cc1 40398627 ZZAFNYZQTLKOSZ-UHFFFAOYSA-N 348.362 1.482 5 50 EDBA Cc1nccn1C[C@@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] 192740144 PGXQVMGZUUETCG-ZDUSSCGKSA-N 329.360 1.868 5 50 EDBA C[C@@](CO)(NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 612074406 SJBXQPXHYKKQHU-YJBOKZPZSA-N 346.383 1.832 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC2(CCNC2)CC1 431024865 QGTHUBBRDUWFQF-UHFFFAOYSA-N 325.390 1.359 5 50 EDBA C[C@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1 186979236 FYAYATUMTHOQTH-AAEUAGOBSA-N 335.360 1.476 5 50 EDBA Cn1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N)c(C(F)(F)F)n1 188510965 QUBFMGXDRINPPK-UHFFFAOYSA-N 343.265 1.859 5 50 EDBA O=C(OC[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 12174213 CTDJVXKTFRESFV-QMMMGPOBSA-N 344.301 1.095 5 50 EDBA Cc1cc2nc3c(=O)n(Cc4ccccc4)c(=O)[nH]c3nc2cc1N 13550196 BOJTYVQFSDEEIX-UHFFFAOYSA-N 333.351 1.572 5 50 EDBA COc1ccc(CCNC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4525759 RSSJNFBMTUVXMZ-UHFFFAOYSA-N 343.339 1.901 5 50 EDBA COC(=O)c1ccc(CNC(=O)CCCn2cc([N+](=O)[O-])cn2)cc1 4753648 LRPZLCNAPCBIDX-UHFFFAOYSA-N 346.343 1.675 5 50 EDBA CCn1ncc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C 14226757 QWSRZRMPYFUYFZ-UHFFFAOYSA-N 338.389 1.940 5 50 EDBA CC(C)(C)NC(=O)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 1893971 ACXVTHGAWNOIRN-UHFFFAOYSA-N 329.378 1.178 5 50 EDBA CC[C@@H](C(=O)N1N=C(C)C[C@@]1(O)C(F)F)n1nc([N+](=O)[O-])cc1C 6554834 FWYPJWNJJMKTSJ-TVQRCGJNSA-N 345.306 1.613 5 50 EDBA Cc1nccc(N2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)n1 183810765 TWVIJCXZJFOGRD-UHFFFAOYSA-N 343.387 1.894 5 50 EDBA CC(C)C[C@H](CN)CC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 408525588 GJURTPZWMMNJPQ-LBPRGKRZSA-N 325.365 1.311 5 50 EDBA CO[C@H]1C[C@@H](CC(=O)O)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 262890418 CICHINUZFPNOKL-KBPBESRZSA-N 336.344 1.618 5 50 EDBA O=[N+]([O-])c1cc(F)cc(S(=O)(=O)N2CCN3CCCC[C@H]2C3)c1 1875289346 KHDLTWKCHOTDKW-LBPRGKRZSA-N 343.380 1.593 5 50 EDBA CN(C)S(=O)(=O)c1cnn(CCOc2cccc([N+](=O)[O-])c2)c1 348115796 MMPDAMDJYYWLIH-UHFFFAOYSA-N 340.361 1.121 5 50 EDBA CN(CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2cnn(C)c2)C1=O 253417310 RFCONUUHVUEUQL-INIZCTEOSA-N 343.387 1.608 5 50 EDBA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 456346 MLCFFFRBDGOQGA-LLVKDONJSA-N 342.373 1.559 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cn2cccn2)cc1 1011993 MQBKEOYFNCSQBW-UHFFFAOYSA-N 326.316 1.675 5 50 EDBA Cn1ncnc1S(=O)(=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 191074433 NINNCLUYLAFSHS-UHFFFAOYSA-N 349.328 1.352 5 50 EDBA O=C(NCc1cccnc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4842596 JXWKQOXNDCBKNF-UHFFFAOYSA-N 342.355 1.756 5 50 EDBA CC(C)(CO)[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 239672677 BURGHTVEUSMEFD-HOTGVXAUSA-N 348.403 1.502 5 50 EDBA Nc1nnc(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)s1 2324554 FGTHQARLBMBPPJ-UHFFFAOYSA-N 329.338 1.898 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)OCc1cccc([N+](=O)[O-])c1 466948 VPCQHZCNECFSCO-UHFFFAOYSA-N 340.291 1.934 5 50 EDBA C[C@@H]1C[C@@H](NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])NC(=S)N1 3900044 NSEZPKCKNUNQKV-LHLIQPBNSA-N 326.338 1.002 5 50 EDBA Cc1cc([N+](=O)[O-])nn1C[C@@H](C)c1nc2c3cnn(C)c3ncn2n1 2802900 DHWKDTUFIJKUBS-MRVPVSSYSA-N 341.335 1.228 5 50 EDBA Cc1cccc(N2CCC(NC(=O)Cn3ccc([N+](=O)[O-])n3)CC2)n1 253426397 GFPLLVKTKCORNA-UHFFFAOYSA-N 344.375 1.280 5 50 EDBA CCOC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 180460 ZLECPLUZUDDNQM-UHFFFAOYSA-N 343.361 1.058 5 50 EDBA C[C@H](CC1CC1)NC(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1 247135481 XODKOTKLDHCKSS-ONERCXAPSA-N 337.376 1.477 5 50 EDBA O=C(NCc1ccoc1)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 171870307 JMDBIJCIKFZAFE-NSHDSACASA-N 347.302 1.996 5 50 EDBA COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2C(=O)C[C@H]1c1c2cccc1[N+](=O)[O-] 216289943 KDQBUWYUZUHUGY-ISTUKMMPSA-N 333.296 1.327 5 50 EDBA CS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 4046639 UVEYUMHNGPWTSR-UHFFFAOYSA-N 336.373 1.225 5 50 EDBA C[N+]1(C[C@H](O)COC(=O)C23CC4CC(CC(C4)C2)C3)CCOCC1 15636891 NJUXGAZLOMHHSL-WCWCZOKXSA-N 338.468 1.584 5 50 EDBA Nc1nc(N2CC3(CCN3Cc3ccccc3)C2)ncc1[N+](=O)[O-] 952882402 MBPOIYVDKFECOS-UHFFFAOYSA-N 326.360 1.432 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCC([C@@H](O)c2ncc[nH]2)CC1 225459955 PQTNWVFYHLYYMB-CYBMUJFWSA-N 334.380 1.793 5 50 EDBA C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1 177262622 PSPHKHMIVKOPMK-PBHICJAKSA-N 335.404 1.626 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1=O 100744283 JMCRGLJKBSCDIB-WBRVRECLSA-N 344.323 1.917 5 50 EDBA C[C@H](N[C@@H]1CCCC[C@H]1C(N)=O)C(=O)Nc1cccc([N+](=O)[O-])c1 252485811 AJZHESPFPSKFCE-ZLKJLUDKSA-N 334.376 1.556 5 50 EDBA Cc1ccc([N+](=O)[O-])c(OCCCCNCCN2CCOCC2)c1 4832426 BSCRMBMWQSSYDT-UHFFFAOYSA-N 337.420 1.984 5 50 EDBA CCOC(=O)c1ccc(NC(=O)Cn2nc([N+](=O)[O-])cc2C)cc1 1429873 ZMDKNWFVAJVZAR-UHFFFAOYSA-N 332.316 1.915 5 50 EDBA COC(=O)C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1Cl 241590519 PFMGCPVCXWCPRA-ADEWGFFLSA-N 326.736 1.726 5 50 EDBA CN(C)C(=O)c1c[nH]nc1NC(=O)CCNc1ccccc1[N+](=O)[O-] 952994483 PRVOVAACUQRAIH-UHFFFAOYSA-N 346.347 1.460 5 50 EDBA O=C(CNC(=O)c1ccco1)OCC(=O)c1ccc([N+](=O)[O-])cc1 2826040 XEHHJKGFLUHKLP-UHFFFAOYSA-N 332.268 1.344 5 50 EDBA O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H](O)c2ccc(F)cc2)c1 185824002 ZSNDTFOWFOQBFM-CQSZACIVSA-N 340.332 1.746 5 50 EDBA C=CC(=O)N1CCC(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 1875365726 SZIHZFFUEGPREA-UHFFFAOYSA-N 329.356 1.909 5 50 EDBA N[C@@H]1CCC[C@@H]2CN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]21 230141677 ALBTWRXTXGZYPE-LERXQTSPSA-N 325.390 1.343 5 50 EDBA CN1CCN(CCCn2cc(Br)c([N+](=O)[O-])n2)CC1 170599535 QLQSMURDQAQWBI-UHFFFAOYSA-N 332.202 1.191 5 50 EDBA COC(=O)c1cc(C)nc(NCCN=S(C)(C)=O)c1[N+](=O)[O-] 1164181659 BPAHKRZVYIMIPU-UHFFFAOYSA-N 330.366 1.224 5 50 EDBA Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(Cn2cccn2)cc1 2735506 HIINAXAMCACOMN-UHFFFAOYSA-N 326.316 1.825 5 50 EDBA CC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](O)c1c(F)cccc1F 272283019 UBNGERPVZCUJOQ-ZANVPECISA-N 340.286 1.838 5 50 EDBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cccc3c2CNCC3)c1O 1875322411 RWYFZAZHPOLOHD-UHFFFAOYSA-N 349.368 1.747 5 50 EDBA CCOC(=O)N1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 616115 AEJAVXGKESTPNP-UHFFFAOYSA-N 337.332 1.274 5 50 EDBA CC1CN(S(=O)(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 170597242 OVARGMAAXZUMIJ-UHFFFAOYSA-N 335.179 1.998 5 50 EDBA CCn1ncc(Cl)c1CNC(=O)CCn1ncc([N+](=O)[O-])c1C 2808487 ISRODVUMDPLTLL-UHFFFAOYSA-N 340.771 1.676 5 50 EDBA COC(=O)C1=CN(C)C=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1 223167 KGXXOQWQDMAGBE-UHFFFAOYSA-N 332.312 1.738 5 50 EDBA Cn1cnc([N+](=O)[O-])c1-c1noc(-c2n[nH]c(=O)c3ccccc23)n1 225553362 LLEJKDYNSCPGQL-UHFFFAOYSA-N 339.271 1.282 5 50 EDBA CC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@](O)(c2cccnc2)C1 77900 RURSDYTURFKPPS-QGZVFWFLSA-N 340.339 1.986 5 50 EDBA COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)N[C@H](C)C1 3877914 MRIHNUXPGVKEED-PHIMTYICSA-N 336.392 1.492 5 50 EDBA C[C@H]1C[C@@H](CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1 271268053 MVJIVEURCFPBLF-AAEUAGOBSA-N 328.390 1.829 5 50 EDBA CCCc1[nH]nc(C(=O)NC[C@H](CO)c2cccnc2)c1[N+](=O)[O-] 360446141 OUFIYRXGOSFPSO-LLVKDONJSA-N 333.348 1.171 5 50 EDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@@H](CCN(C)C)C1 952880240 CDPUHSYKDCQKJU-CYBMUJFWSA-N 341.433 1.866 5 50 EDBA CC[C@H](c1nc2c3cnn(C)c3ncn2n1)n1nc([N+](=O)[O-])cc1C 2802238 GXGLQUCCGIXTNH-SNVBAGLBSA-N 341.335 1.424 5 50 EDBA COc1cccc(-c2nnn(CCn3cc([N+](=O)[O-])ccc3=O)n2)c1 124435222 NVVQJTNHPBOXSZ-UHFFFAOYSA-N 342.315 1.119 5 50 EDBA C[N+]1(C[C@@H](O)COC(=O)C23CC4CC(CC(C4)C2)C3)CCOCC1 15636889 NJUXGAZLOMHHSL-YMVOSSCXSA-N 338.468 1.584 5 50 EDBA CNS(=O)(=O)c1ccc(N2CCc3nocc3C2)c([N+](=O)[O-])c1 888101007 NMFZVFRQUNUKGI-UHFFFAOYSA-N 338.345 1.054 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(NCc2cnn3c2CCCC3)n1 1333658983 BSPODGURRRIWEA-UHFFFAOYSA-N 331.332 1.921 5 50 EDBA O=C(NCc1cccnc1-n1cccn1)c1ccc(O)c([N+](=O)[O-])c1 164339628 OJJNJBUSRBXDPX-UHFFFAOYSA-N 339.311 1.811 5 50 EDBA C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCCO1 1054837 PYPKJEBAJJXXHF-ZANVPECISA-N 332.312 1.999 5 50 EDBA COCCN(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 416374177 STAGQAUSLWRRKD-UHFFFAOYSA-N 342.295 1.881 5 50 EDBA Nc1nc(N[C@H]2[C@@H]3CN(Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] 370737784 MDCMUXOZYYMXGX-IMRBUKKESA-N 326.360 1.509 5 50 EDBA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccc([N+](=O)[O-])cc1 101697251 WBUODGPYXKUAHZ-NBLIUIFLSA-N 341.323 1.340 5 50 EDBA COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(c2nn[nH]n2)CC1 737116853 SCPNRNZBEUKOMK-UHFFFAOYSA-N 347.335 1.528 5 50 EDBA CC[C@H](C(=O)N1N=C(C)C[C@]1(O)C(F)(F)F)n1cc([N+](=O)[O-])cn1 6555278 JTQAQIJHXMAAMT-KOLCDFICSA-N 349.269 1.602 5 50 EDBA CC(F)(F)CN1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 1309897407 HZEFDRWEFCBBLH-UHFFFAOYSA-N 349.359 1.556 5 50 EDBA CCn1ncc(CN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1C 14226816 IAPJPHWTGCYUDN-UHFFFAOYSA-N 338.389 1.940 5 50 EDBA Cc1ccc([N+](=O)[O-])c(N(C)Cc2nnc3n2CCN(C)C3=O)c1 952992907 DMRYOKNWBCVDCH-UHFFFAOYSA-N 330.348 1.217 5 50 EDBA COc1ccccc1N1CCN(c2ncnc(N)c2[N+](=O)[O-])CC1 3912679 IKZRQTQJSZXONX-UHFFFAOYSA-N 330.348 1.302 5 50 EDBA CC(C)C(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4748697 WTMFLWBFZXUKNX-UHFFFAOYSA-N 336.417 1.774 5 50 EDBA O=C1NC[C@H](COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)O1 225607094 XCFNLCZQUYLFOM-LLVKDONJSA-N 335.316 1.460 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N(CCO)c1cccc(F)c1 122443866 DDRWFQFAJPWMQZ-UHFFFAOYSA-N 340.332 1.922 5 50 EDBA O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC(c2ccncc2)CC1 192280310 DXYILZHYXLSSLM-UHFFFAOYSA-N 329.360 1.983 5 50 EDBA CCOC(=O)C1=C(C)NC2=C(C(=O)OC2)[C@@H]1c1cccc([N+](=O)[O-])c1 19800343 ZYQOLGCHSLBXFG-CQSZACIVSA-N 344.323 1.930 5 50 EDBA CCOC(=O)c1ccnc(N2CCC[C@@H](C3=NCCN3)C2)c1[N+](=O)[O-] 1775990118 KCQOOIRQTXUOME-LLVKDONJSA-N 347.375 1.385 5 50 EDBA COc1ccc(C(=O)c2ccc([N+](=O)[O-])cc2)cc1S(N)(=O)=O 458701 GIKTXLYWROUDJH-UHFFFAOYSA-N 336.325 1.482 5 50 EDBA O=C(C[C@@H](NCc1ccco1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280071 AHXPNBIDKBOPNB-CYBMUJFWSA-N 333.300 1.759 5 50 EDBA CS(=O)(=O)c1ccc(N2CCN3CCC[C@H]3C2)c([N+](=O)[O-])c1 247546422 UPXJQCVAHGCRAQ-NSHDSACASA-N 325.390 1.283 5 50 EDBA Cc1nn(Cc2nc(N)nc(N3CCCCC3)n2)c(C)c1[N+](=O)[O-] 6668843 KGWNPNOQMUDNIK-UHFFFAOYSA-N 332.368 1.214 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N(C1CCNCC1)C1CC1 378255160 WNPQDNDTKCJUOO-UHFFFAOYSA-N 325.390 1.500 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@@H]2CCCO2)CC1 5041734 OHVKEARREQXGNE-AWEZNQCLSA-N 348.359 1.450 5 50 EDBA Cc1cc([N+](=O)[O-])nn1C[C@H](C)c1nc2c3cnn(C)c3ncn2n1 2802901 DHWKDTUFIJKUBS-QMMMGPOBSA-N 341.335 1.228 5 50 EDBA NC(=O)C(F)(F)[C@@]1(O)CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 1775991700 TVXOWCTUGLOHQQ-LLVKDONJSA-N 335.694 1.310 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCN(CC(F)(F)F)C1 408518406 GCCUYPAVQPCBBZ-JTQLQIEISA-N 349.313 1.182 5 50 EDBA Cc1cccc([N+](=O)[O-])c1C(=O)NCCc1cccc(C(N)=O)c1 194550757 BVWNCWPSIADXFL-UHFFFAOYSA-N 327.340 1.975 5 50 EDBA COC(=O)[C@H]1C(=O)[C@@H](C(=O)c2ccc([N+](=O)[O-])cc2)C(=O)CC1(C)C 100319429 OZFPJTMBFYINOL-CHWSQXEVSA-N 347.323 1.751 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2 725373159 OVAFAAGCFSCPHC-ZSBIGDGJSA-N 325.390 1.404 5 50 EDBA O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 1455723118 WBZCCXIPBOBMOQ-ZJUUUORDSA-N 330.300 1.831 5 50 EDBA Nc1nc(NC[C@@H]2CCCC[C@@H]2N2CCOCC2)ncc1[N+](=O)[O-] 1119556601 RAJDZWBOUBCBCG-RYUDHWBXSA-N 336.396 1.270 5 50 EDBA COc1ccc(-n2nc([N+](=O)[O-])c(NCc3ccccn3)[n+]2[O-])cc1 4758227 JLPPICIBRXVUIT-UHFFFAOYSA-N 342.315 1.430 5 50 EDBA CCCc1[nH]nc(C(=O)NC[C@H](C)Cn2ccnc2C)c1[N+](=O)[O-] 171804070 CHBYKZQQFLLTHV-JTQLQIEISA-N 334.380 1.841 5 50 EDBA O=C(C[C@@H]1CCCO1)NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 850888892 OTCHSRHEJYLCOI-VIFPVBQESA-N 332.309 1.108 5 50 EDBA O=C(C[C@@H]1N[C@H]2CCCC[C@@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1 4702818 PDUFJMZIZWSOSY-IHRRRGAJSA-N 332.360 1.323 5 50 EDBA O=C(OCC[C@H]1Oc2cccnc2NC1=O)c1ccc([N+](=O)[O-])cc1 1393669 KTTWQXALBQTKIN-CYBMUJFWSA-N 343.295 1.936 5 50 EDBA O=[N+]([O-])c1cnc(N2CCN(Cc3nccn3C(F)F)CC2)s1 195511238 PQQPKBGLDQZUED-UHFFFAOYSA-N 344.347 1.965 5 50 EDBA Cc1cnn(C[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CCO2)c1 134336557 AZYAKJQKSNOMAO-ZDUSSCGKSA-N 348.334 1.780 5 50 EDBA C[C@@H]1CCS(=O)(=O)CCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 191975026 HFNBEQXHDJTEQT-LLVKDONJSA-N 341.389 1.313 5 50 EDBA C[C@@H](O)CN(C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] 952881467 HNFBKONFNARHKE-SSDOTTSWSA-N 339.320 1.231 5 50 EDBA CN(C)C1CN(c2c(I)cncc2[N+](=O)[O-])C1 418889795 BLAOQHKDAVYISZ-UHFFFAOYSA-N 348.144 1.345 5 50 EDBA CS[C@H](CO)[C@H](C)NS(=O)(=O)c1cc(C)c(C)c([N+](=O)[O-])c1 318722706 SGURYGWFQXLCMJ-GXFFZTMASA-N 348.446 1.602 5 50 EDBA Cn1cnnc1-c1cncc(NC(=O)c2cc([N+](=O)[O-])ccc2O)c1 182155710 VVDVLKDJUPYTTD-UHFFFAOYSA-N 340.299 1.743 5 50 EDBA COc1c(O)cc2c(=O)oc3c(OC)c(O)cc4c(=O)oc1c2c34 1280637 KLAGYIBJNXLDTL-UHFFFAOYSA-N 330.248 1.919 5 50 EDBA biogenic,in-vitro CCN1CCN(CC[C@H]2Oc3cc([N+](=O)[O-])ccc3NC2=O)CC1 4036905 DPDKRTVUERIABE-CQSZACIVSA-N 334.376 1.322 5 50 EDBA CN1CC[C@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 358051108 QVIFOHGWRCCTOQ-HNNXBMFYSA-N 335.385 1.606 5 50 EDBA NC[C@@H]1CCCC[C@H]1NS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 170684845 MXZFDMDWNQPYMA-TVQRCGJNSA-N 331.369 1.530 5 50 EDBA CCOC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 1536477 QQHWDWJDLZAGEL-ZDUSSCGKSA-N 344.389 1.851 5 50 EDBA CN(Cc1c(Cl)cnn1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 20602077 KHNYADBTBZDXNM-UHFFFAOYSA-N 344.780 1.802 5 50 EDBA COCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-] 17068741 AZKDAZSUIQKBHM-LBPRGKRZSA-N 334.328 1.662 5 50 EDBA O=C(OCn1nnc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1 67168 GKUHBECZAORDBA-UHFFFAOYSA-N 326.268 1.514 5 50 EDBA CC(C)CN1CCO[C@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1 240555801 GXIBWEBUJPTRIR-GFCCVEGCSA-N 336.392 1.462 5 50 EDBA C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCc2nc[nH]c(=O)c2C1 170616712 AOAMHHVVLUFWGW-SNVBAGLBSA-N 343.343 1.063 5 50 EDBA O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1COCCN1C1CCCC1 189354253 PPCLQADODPBOPR-AWEZNQCLSA-N 335.360 1.882 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)cn1 195427417 APUVQRJYKYLPDE-NUEKZKHPSA-N 345.380 1.997 5 50 EDBA CCOC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@@H]12 15022887 NHOQVTSGODSKOH-HYSWKAIVSA-N 345.355 1.790 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCCN(Cc2cnn(C)c2)CC1 192571241 QCFWVEXGQRPIBX-UHFFFAOYSA-N 347.423 1.565 5 50 EDBA COc1cc(CN2CCN(c3ncccn3)CC2)cc([N+](=O)[O-])c1O 5357255 WUKUJEXHGKPNFT-UHFFFAOYSA-N 345.359 1.421 5 50 EDBA O=c1[nH]c2ccc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2[nH]1 13497478 DFJNAHZXFFHPDU-UHFFFAOYSA-N 334.313 1.565 5 50 EDBA O=C(O)COc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1 15009229 HLJNIPMFPFDHFQ-ZZXKWVIFSA-N 333.256 1.018 5 50 EDBA CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 34926366 NXOJDWWMFVLDHT-UONOGXRCSA-N 347.371 1.600 5 50 EDBA O=C(NCc1cccnc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4820835 MSZGQKMHHJNXOZ-UHFFFAOYSA-N 342.355 1.756 5 50 EDBA O=C(NCc1ccoc1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 171870306 JMDBIJCIKFZAFE-LLVKDONJSA-N 347.302 1.996 5 50 EDBA Cc1nn(CC(=O)NCc2ccc3c(c2)OCO3)c(C)c1[N+](=O)[O-] 2884633 DNBQUKZSRCPDFU-UHFFFAOYSA-N 332.316 1.453 5 50 EDBA CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 3263844 BJFJVGFGKCJELH-VIFPVBQESA-N 332.765 1.507 5 50 EDBA O=[N+]([O-])c1ccc(N2CCN(CCO)CC2)cc1N1CCCCC1 23549909 DNEVZPLOMTZOSW-UHFFFAOYSA-N 334.420 1.699 5 50 EDBA O=C(COc1ccccc1[N+](=O)[O-])NN1C(=O)c2ccccc2C1=O 1064776 MYNKCPIMJBUHFP-UHFFFAOYSA-N 341.279 1.301 5 50 EDBA Cc1sc(S(=O)(=O)NC[C@@H](C2CC2)N(C)C)cc1[N+](=O)[O-] 123245107 WUQAEHFXSIMCQL-NSHDSACASA-N 333.435 1.583 5 50 EDBA CCN1CCc2nc(NC(=O)c3n[nH]c(C)c3[N+](=O)[O-])sc2C1 354312831 UQKCECZSTWYYBM-UHFFFAOYSA-N 336.377 1.713 5 50 EDBA Cc1cc(C(=O)NC[C@@H]2CN(C3CC3)CCO2)c(N)c([N+](=O)[O-])c1 127653873 BSXLEYCOWZXXHC-GFCCVEGCSA-N 334.376 1.078 5 50 EDBA CCc1ccc(C(=O)N[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(N)=O)cc1[N+](=O)[O-] 252679222 JQCBCSGOJOVEEZ-AZHAFVHUSA-N 331.372 1.787 5 50 EDBA Cc1nn(Cc2ccc(C(=O)NN3CCOCC3)o2)c(C)c1[N+](=O)[O-] 2778614 UGYIKCOESBDFAW-UHFFFAOYSA-N 349.347 1.026 5 50 EDBA CCOc1cc(NC(=O)N2C[C@@H]3C[C@H]2C[S@@]3=O)ccc1[N+](=O)[O-] 1626005306 DUOJUIAYIDYEES-LYSPQLLHSA-N 339.373 1.731 5 50 EDBA CCn1c(=O)c([N+](=O)[O-])c(N2CCN(CCO)CC2)c2ccccc21 19808079 ZMNXCBKWYHUWLL-UHFFFAOYSA-N 346.387 1.044 5 50 EDBA O=[N+]([O-])[C@@H]([C@@H]1NCCc2ccccc21)S(=O)(=O)c1ccccc1 5279595 DKQXXLNKHXUAAR-HZPDHXFCSA-N 332.381 1.950 5 50 EDBA CCc1nc(C2CCN(C(=O)c3n[nH]c(CC)c3[N+](=O)[O-])CC2)n[nH]1 191785877 WKPGHPPTPOIZNS-UHFFFAOYSA-N 347.379 1.581 5 50 EDBA CC1=NN(C(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)[C@](O)(C(F)(F)F)C1 6394409 CJKJTRNYEAJKFC-OIBJUYFYSA-N 335.242 1.211 5 50 EDBA C[C@@H]1CN(Cc2ccccc2NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 241588038 OZBWPWQMEWFCMD-ZNEHSRBWSA-N 333.388 1.900 5 50 EDBA CC[N@+]1(C)[C@H]2C[C@@H](OC(=O)[C@@H](CO)c3ccccc3)C[C@H]1C[C@@H]2O 245253982 XCNYCAGTMKJDDN-CPVUPJMFSA-N 334.436 1.436 5 50 EDBA O=C(O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 5103028 ALETTZCGJDGEAG-UHFFFAOYSA-N 336.325 1.875 5 50 EDBA O=c1[nH]c(O)nc(/C=C\c2cc3ccccc3oc2=O)c1[N+](=O)[O-] 32687761 XNBJSYMPFDLURM-WAYWQWQTSA-N 327.252 1.661 5 50 EDBA O=C(NCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1cccnc1 129482085 YPWNWMMPCMQBNE-UHFFFAOYSA-N 348.746 1.803 5 50 EDBA CC(C)C[C@@H]1C(=O)NCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 408519724 VVDLAMJHONGZTI-KGLIPLIRSA-N 335.360 1.001 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CC2)OCCO3)cc1 2889993 QLMFUNJWZMEGHL-UHFFFAOYSA-N 328.346 1.122 5 50 EDBA C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCS1(=O)=O 170613680 CTFGJJIEUHYYAW-SECBINFHSA-N 346.792 1.897 5 50 EDBA Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 191699063 ZGATWWKVVAAMTF-LBPRGKRZSA-N 344.375 1.585 5 50 EDBA Cc1c([N+](=O)[O-])c(-c2nn3c(C(F)(F)F)nnc3s2)nn1C 20606023 BDSSJBYMALHDKZ-UHFFFAOYSA-N 333.255 1.822 5 50 EDBA COc1ccc(NC(=O)CSc2nnc(N)s2)c([N+](=O)[O-])c1 9714184 OMBOOYATNNKLIT-UHFFFAOYSA-N 341.374 1.768 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1[C@H]2c3ccccc3CC[C@H]21 155122883 BLIWGFUZVWTVFD-VBQJREDUSA-N 326.356 1.884 5 50 EDBA CN1CC[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc([N+](=O)[O-])c1 887268122 CHPZDPDUTORXFM-IMJJTQAJSA-N 335.404 1.503 5 50 EDBA COC(=O)c1ccccc1NC(=O)CCCn1cnc([N+](=O)[O-])n1 215137 VXHFPFICPMYYBO-UHFFFAOYSA-N 333.304 1.392 5 50 EDBA Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1[N+](=O)[O-] 4263275 XKKDROVDSVBMRD-UHFFFAOYSA-N 342.373 1.697 5 50 EDBA Cn1nnnc1SCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 1000107 JQTVJEJKYDKFJG-UHFFFAOYSA-N 328.741 1.503 5 50 EDBA CC1=NN(C(=O)[C@@H](C)Oc2ccccc2[N+](=O)[O-])[C@@](O)(C(F)F)C1 6849518 GIXXWTOCRKPIFE-OTYXRUKQSA-N 343.286 1.924 5 50 EDBA CC1=NN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@](O)(C(F)(F)F)C1 6394199 AOMSKJNRMHAZPM-LLVKDONJSA-N 349.269 1.386 5 50 EDBA COCCOCCNC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O 408519340 AVRRCOKYLGJTHG-UHFFFAOYSA-N 343.311 1.085 5 50 EDBA Cn1c(CNC(=O)c2cc([N+](=O)[O-])ccc2N)nnc1C1CCC1 170605217 SUJSPVGNTPRMKH-UHFFFAOYSA-N 330.348 1.503 5 50 EDBA CC[C@@H](C(=O)N1N=C(C)C[C@@]1(O)C(F)(F)F)n1cc([N+](=O)[O-])cn1 6554832 JTQAQIJHXMAAMT-GXSJLCMTSA-N 349.269 1.602 5 50 EDBA O=[N+]([O-])c1cnc(N2CC[C@H](c3nc[nH]n3)C2)c(Br)c1 425290805 YDOUBGKZWJNDSX-ZETCQYMHSA-N 339.153 1.864 5 50 EDBA Cc1cc([N+](=O)[O-])nn1[C@@H](C)c1nc2c3cnn(C)c3ncn2n1 2802138 JNFFEKPAUPDFPH-QMMMGPOBSA-N 327.308 1.033 5 50 EDBA CN(c1ccccc1)c1ccc(CN2C[C@H](O)[C@H](O)C2)cc1[N+](=O)[O-] 611272172 UWZOKPNHQFCTAA-HDICACEKSA-N 343.383 1.900 5 50 EDBA Cn1ccc(N2CCC[C@@H](NC(=O)c3ccc([N+](=O)[O-])s3)C2=O)n1 172848727 MTUOZAMTSRDOBJ-SECBINFHSA-N 349.372 1.315 5 50 EDBA NC[C@H]1CCCC[C@H]1NS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 170684839 MXZFDMDWNQPYMA-NOZJJQNGSA-N 331.369 1.530 5 50 EDBA Cc1c(CN(C)S(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cnn1C 1663165743 HTKYVCHYRMBIDX-UHFFFAOYSA-N 340.361 1.163 5 50 EDBA CCCS(=O)(=O)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 19842778 UWWULTFASUQHHK-UHFFFAOYSA-N 327.406 1.452 5 50 EDBA CN1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1CO 864090972 HOTWVNLSLJMNBB-HNNXBMFYSA-N 332.360 1.358 5 50 EDBA Nc1nonc1C(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 4151769 HGAWDDNIERUUJY-UHFFFAOYSA-N 326.700 1.055 5 50 EDBA Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCN(C)C1 416493837 GOZKGUNVIIIMPT-LBPRGKRZSA-N 327.406 1.442 5 50 EDBA COc1ccccc1CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 132759734 UWJUZOKVLUSBTG-UHFFFAOYSA-N 345.359 1.285 5 50 EDBA O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CCCc2[nH]ncc21 177319258 YVCCGTFLWFQIOD-NSHDSACASA-N 329.360 1.966 5 50 EDBA O=C(COc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CCSC1=O 266112584 NFLJBAFLLSMGRG-MRVPVSSYSA-N 330.749 1.775 5 50 EDBA C[C@@H]1CN([C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)C[C@@H](C)O1 15230633 GETWLWUJAFSOBZ-JTNHKYCSSA-N 333.344 1.336 5 50 EDBA Nc1cccc([N+](=O)[O-])c1C(=O)NCCN1C(=O)Cc2ccccc21 181012093 ZBPZCLKNFKWLNO-UHFFFAOYSA-N 340.339 1.496 5 50 EDBA Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)c3ccccc3O)CC2)n1 269026490 QUPQORFCQNYPQK-UHFFFAOYSA-N 342.355 1.966 5 50 EDBA CCCN1CC2=C(C1=O)[C@@H](c1cccc([N+](=O)[O-])c1)NC(=O)N2C 4776445 PHQZAGYATGRYIH-CQSZACIVSA-N 330.344 1.797 5 50 EDBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(Cc2cccc(F)c2)CC1 20608363 VHHDGPYDHQECHS-UHFFFAOYSA-N 333.323 1.415 5 50 EDBA O=C(OCC[C@@H]1Oc2cccnc2NC1=O)c1ccc([N+](=O)[O-])cc1 1393670 KTTWQXALBQTKIN-ZDUSSCGKSA-N 343.295 1.936 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(F)(c2ccccn2)CC1 328593374 IITUUNPGZIDVPD-UHFFFAOYSA-N 333.323 1.674 5 50 EDBA CCCC(=O)N(C)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 19926216 KBWPXGFKHUZICA-UHFFFAOYSA-N 345.333 1.669 5 50 EDBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1OB(O)c2ccccc21 1875365931 SDGAGNWAGUPZCY-SCOAYWHSSA-N 338.128 1.183 5 50 EDBA O=C(c1ccc2nc3cc(Cl)ccc3c(=O)n2c1)N1CCOCC1 425584 AZXFOXFMFDGUSR-UHFFFAOYSA-N 343.770 1.974 5 50 EDBA O=C(CNS(=O)(=O)c1ccccc1)Nc1cccc([N+](=O)[O-])c1 469306 OYDNYPSIOINBEI-UHFFFAOYSA-N 335.341 1.512 5 50 EDBA O=C(NCc1ccc([N+](=O)[O-])cc1)N1CCC(Cn2ccnn2)CC1 163933062 GXJFFYRSYLQTIQ-UHFFFAOYSA-N 344.375 1.808 5 50 EDBA COC(=O)c1cc(C)nc(N2CC[C@H](c3ncccn3)C2)c1[N+](=O)[O-] 1307215375 HLJHIMYFIBRSNM-NSHDSACASA-N 343.343 1.869 5 50 EDBA C[C@H](O)CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 249152448 VGKOUZLEGLJKDC-QWRGUYRKSA-N 325.340 1.261 5 50 EDBA NC(=O)c1cc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccn1 131115643 QLHNLCWDOPHMCO-UHFFFAOYSA-N 327.344 1.415 5 50 EDBA CNC(=O)c1ccn([C@H]2CCCN(c3ncc(C)cc3[N+](=O)[O-])C2)n1 253393202 FMZGMWRPZICTCR-LBPRGKRZSA-N 344.375 1.696 5 50 EDBA O=C(NCc1cccs1)c1nc(Cn2ccc([N+](=O)[O-])n2)no1 12374986 WRAYEUVKKPHSEZ-UHFFFAOYSA-N 334.317 1.214 5 50 EDBA O=C(NC(=O)c1ccccc1O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3129809 VZRGVAULGXEGHZ-UHFFFAOYSA-N 331.240 1.779 5 50 EDBA C[C@@H]1CN2CCC[C@H]2CN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 239636963 BHUURPVVEPYOIA-QLFBSQMISA-N 335.404 1.503 5 50 EDBA O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 100518149 AGMPDTXVUKOXFW-QQXRRDQMSA-N 344.283 1.637 5 50 EDBA O=C1[C@@H]2[C@@H](C(=O)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C=C[C@H]2C1 100518151 AGMPDTXVUKOXFW-XMUKKISLSA-N 344.283 1.637 5 50 EDBA O=C1CCCCN1Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O 170593652 KFHGSSMJIJJCRH-UHFFFAOYSA-N 328.328 1.789 5 50 EDBA CCOC(=O)Cc1ccccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 356119301 HDFTVDKBNJJCOC-UHFFFAOYSA-N 332.316 1.536 5 50 EDBA Cc1nn(CCN(Cc2ccccc2)S(C)(=O)=O)cc1[N+](=O)[O-] 170611132 CISYGNVSLUNBSB-UHFFFAOYSA-N 338.389 1.562 5 50 EDBA COc1cccc(N2CCN(C(=O)c3ccccn3)CC2)c1[N+](=O)[O-] 185166797 VNZQNAZAIQHKDX-UHFFFAOYSA-N 342.355 1.961 5 50 EDBA C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1O 189655315 IFWDOHONBGLFSX-YGRLFVJLSA-N 325.340 1.765 5 50 EDBA COCCn1ccc2nc3ccn(-c4ccccn4)c(=O)c3cc2c1=O 38828980 ZXLVPAOPSHTQNX-UHFFFAOYSA-N 348.362 1.742 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCNC[C@H]1c1ccccc1 313374909 KUPNOQWUEBABJK-HNNXBMFYSA-N 347.396 1.930 5 50 EDBA Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)ccc1[N+](=O)[O-] 241171012 KDOFGSHAWBAVCI-RKUHIEFHSA-N 343.383 1.794 5 50 EDBA COC[C@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 19300913 USCJKDUSKMNBTO-GFCCVEGCSA-N 329.784 1.378 5 50 EDBA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 456345 MLCFFFRBDGOQGA-NSHDSACASA-N 342.373 1.559 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCNC[C@@H]1c1ccccc1 313374912 KUPNOQWUEBABJK-OAHLLOKOSA-N 347.396 1.930 5 50 EDBA CCn1c(-c2ccc([N+](=O)[O-])s2)nc2c1c(=O)[nH]c(=O)n2CC 170593852 CVAVRULJTVWXJH-UHFFFAOYSA-N 335.345 1.563 5 50 EDBA CC(C)S(=O)(=O)N1CCC(Nc2ncc([N+](=O)[O-])s2)CC1 253394949 ICNCPNUJXIDRIY-UHFFFAOYSA-N 334.423 1.666 5 50 EDBA CN1CCC2(CCN(C(=O)c3ccc([N+](=O)[O-])c(O)c3)CC2)C1=O 376028348 JKUBILZZGCLGGX-UHFFFAOYSA-N 333.344 1.385 5 50 EDBA O=[N+]([O-])c1ccc(N2CCN(CCO)CC2)cc1NCc1ccco1 19807895 KHQBKAZNNDGEHO-UHFFFAOYSA-N 346.387 1.914 5 50 EDBA C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCS(=O)(=O)C1 192108723 NLCVWLXTPONECS-JTQLQIEISA-N 339.373 1.603 5 50 EDBA O=c1c2nnc(CCNc3ccc([N+](=O)[O-])cc3)n2ccn1C1CC1 952995289 HKDWABNVJDIIIL-UHFFFAOYSA-N 340.343 1.789 5 50 EDBA Cc1cc(C(=O)NC[C@H]2CN(C3CC3)CCO2)c(N)c([N+](=O)[O-])c1 127654127 BSXLEYCOWZXXHC-LBPRGKRZSA-N 334.376 1.078 5 50 EDBA Cc1cc(C(=O)N2CC[C@H](C)S(=O)(=O)CC2)c(N)c([N+](=O)[O-])c1 170613676 VFEVZXORCXAGSS-JTQLQIEISA-N 341.389 1.135 5 50 EDBA Cc1nn(C)c(NCc2ccc(CN3CCOCC3)o2)c1[N+](=O)[O-] 170595667 ZLXVRCPOWGQPJG-UHFFFAOYSA-N 335.364 1.674 5 50 EDBA CC(C)NS(=O)(=O)CCNc1ccc([N+](=O)[O-])c2cnccc12 195248466 MQPUVVFNSVXLAM-UHFFFAOYSA-N 338.389 1.883 5 50 EDBA COc1ccc(CNC(=O)CCCn2cc([N+](=O)[O-])cn2)cc1OC 4753338 QEGAMMQARSAOKW-UHFFFAOYSA-N 348.359 1.905 5 50 EDBA Cc1ccnc(NCc2nnc3ccc(N(C)C)nn23)c1[N+](=O)[O-] 952993679 PJOLVBPLNNUTCA-UHFFFAOYSA-N 328.336 1.414 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCCOc1cncc(Cl)c1 408516031 FAKJWRIKYDPRGH-UHFFFAOYSA-N 325.712 1.035 5 50 EDBA CN(CCCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)Cc1ccncc1 408516534 CZTYHDWDMZTAGF-UHFFFAOYSA-N 346.391 1.167 5 50 EDBA O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1NC[C@H]1CCCO1 4809050 ZHNQTGNUGRLCFQ-LLVKDONJSA-N 339.739 1.658 5 50 EDBA COC(=O)c1c([N+](=O)[O-])ccc(N2C[C@@H](C)[C@H](C(N)=O)C2)c1Cl 408524569 VTCDTGVASWMKBP-HTQZYQBOSA-N 341.751 1.592 5 50 EDBA Cn1c(=O)c([N+](=O)[O-])c(NCCN2CCOCC2)c2ccccc21 19807904 FIXJXYHRAZYRNT-UHFFFAOYSA-N 332.360 1.191 5 50 EDBA O=C(NCCNS(=O)(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 2827585 MXZMFBGRUBFLAJ-UHFFFAOYSA-N 349.368 1.303 5 50 EDBA CC[C@@H](NC(=O)[C@H]1C[C@H](O)CN1C(C)=O)c1cccc([N+](=O)[O-])c1 277716917 PHHYTDHWBTVDKW-RRFJBIMHSA-N 335.360 1.144 5 50 EDBA C[C@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H]1CO 190687195 GBBUQUOYFLJBFN-GZMMTYOYSA-N 334.781 1.640 5 50 EDBA COc1cc([N+](=O)[O-])ccc1N1CCC(N2CCN(C)CC2)CC1 204000596 UQTCIVXKZRYJMQ-UHFFFAOYSA-N 334.420 1.820 5 50 EDBA in-vitro COc1ccc(C(=O)N2CCN(c3ccccn3)CC2)cc1[N+](=O)[O-] 461921 RNHPGNCUODKFBH-UHFFFAOYSA-N 342.355 1.961 5 50 EDBA CC(C)C[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(=O)O 2166975 DIOBIOPCRMWGAT-NSHDSACASA-N 325.277 1.732 5 50 EDBA COC(=O)CCCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3185689 QCSYXIAKHSOXMG-UHFFFAOYSA-N 339.304 1.966 5 50 EDBA NCC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4544866 KNDZCZRECXTRHP-OAHLLOKOSA-N 342.355 1.220 5 50 EDBA Cc1cc([N+](=O)[O-])cnc1N1CC[C@H](S(=O)(=O)N2CCCC2)C1 253431339 RFIRQMAWBMVFPP-ZDUSSCGKSA-N 340.405 1.303 5 50 EDBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CCN(C)C[C@@H]2C1 864091536 ZYXOYHDNPBCUCH-HZSPNIEDSA-N 332.404 1.805 5 50 EDBA COc1cccc(C(=O)NCCn2nc([N+](=O)[O-])cc2C)c1OC 2799600 YAQRCXJCAUSNKD-UHFFFAOYSA-N 334.332 1.547 5 50 EDBA CCCNc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(=O)[C@@H](C)OC 864088118 YYPFDSIVYQGDNS-SECBINFHSA-N 345.377 1.257 5 50 EDBA O=c1c([N+](=O)[O-])cc(Br)cn1CCCn1ccnc1 185569101 OKSHJFOJCJLVQT-UHFFFAOYSA-N 327.138 1.806 5 50 EDBA CN1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCCCC2)CC1 4881941 MBRXEOWIRYGQIH-UHFFFAOYSA-N 332.404 1.973 5 50 EDBA O=C(CN1CSCC1=O)Nc1ccc([N+](=O)[O-])c2ncccc12 253427718 DHWHTKYOALZYEW-UHFFFAOYSA-N 332.341 1.614 5 50 EDBA CC(C)C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(=O)O 1593782 DIOBIOPCRMWGAT-LLVKDONJSA-N 325.277 1.732 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](c2ncccn2)C1 1309904590 WMNAYDWPAAHYPN-LBPRGKRZSA-N 348.384 1.871 5 50 EDBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccn2)CC1 4700911 DSKLLABMPRSCCP-UHFFFAOYSA-N 326.356 1.881 5 50 EDBA CCn1cc([C@H](C)NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)c(C)n1 17066884 HXHDUGDJEQOQER-LURJTMIESA-N 326.744 1.987 5 50 EDBA COc1cc(C(=O)Nc2ccc(C(N)=O)cc2)c([N+](=O)[O-])cc1OC 184097 BULPARYMZQDASZ-UHFFFAOYSA-N 345.311 1.963 5 50 EDBA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 455972 KGRYPXNHBWXIGQ-NSHDSACASA-N 342.373 1.559 5 50 EDBA O=[N+]([O-])c1ccc(CSC(=S)N[C@H]2CCS(=O)(=O)C2)cc1 3904420 QLXSKISOUXDVMK-JTQLQIEISA-N 346.455 1.890 5 50 EDBA Cc1cc(C(=O)N2CCN(c3cnn(C)c3)CC2)cc([N+](=O)[O-])c1 173675997 IGVRZPDGZXKPNL-UHFFFAOYSA-N 329.360 1.599 5 50 EDBA O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1nccs1 1807594 DENBFZKBPIAYTP-UHFFFAOYSA-N 346.324 1.676 5 50 EDBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1S(C)(=O)=O 4117555 YGCSFYWXSMBDES-VIFPVBQESA-N 333.797 1.718 5 50 EDBA CCn1cnnc1[C@@H]1CN(c2c([N+](=O)[O-])c(C)nn2CC)CCO1 225458508 YGNPOSNVZOSIIF-NSHDSACASA-N 335.368 1.309 5 50 EDBA CCCc1nc(C(N)=O)nn1Cc1cc([N+](=O)[O-])cc2c1OCOC2 253431054 SUWFNKCYBXBGHT-UHFFFAOYSA-N 347.331 1.153 5 50 EDBA COc1ccccc1N1CCN(c2ccc([N+](=O)[O-])c(N)n2)CC1 227144822 IVUOUNUPNDGSLF-UHFFFAOYSA-N 329.360 1.907 5 50 EDBA COC[C@@]1(C(=O)O)CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)C1 262918171 FYXONGBJXQUWBL-OAHLLOKOSA-N 348.315 1.034 5 50 EDBA Cc1ccnc(NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 301668187 XTKCRUPGJLOEPJ-UHFFFAOYSA-N 336.373 1.689 5 50 EDBA CCNCC1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 237055298 DZDGHGRUZYPXOG-UHFFFAOYSA-N 327.406 1.605 5 50 EDBA O=[N+]([O-])c1ccc2nc(N3CCOCC3)c(N3CCOCC3)nc2c1 226685 LHDKFHKPKKHJDU-UHFFFAOYSA-N 345.359 1.211 5 50 EDBA Cn1cc(N2CCC[C@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)cn1 154056204 GLFFNKMVPZBSEL-AWEZNQCLSA-N 343.387 1.656 5 50 EDBA CNC(=O)N[C@@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 1644556378 VECGNACYDHHGFT-LLVKDONJSA-N 345.359 1.610 5 50 EDBA Cc1c(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cccc1[N+](=O)[O-] 311377 GTUQLHVHHBREJC-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA CCOC(=O)c1cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cn1C 354533171 KVONKMGBTJACSS-UHFFFAOYSA-N 332.316 1.945 5 50 EDBA O=[N+]([O-])c1cnn(Cc2nnnn2-c2ccc(OC(F)F)cc2)c1 328586870 UCCIQMICMYZFHO-UHFFFAOYSA-N 337.246 1.417 5 50 EDBA Cn1cc([C@@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2(C)C)cn1 328597160 FBEBMQVDVOFQQR-ZDUSSCGKSA-N 332.364 1.177 5 50 EDBA CC[C@H]1[C@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@H]2[C@@H]5O)[N@@+]3(C)[C@@H]1O 252461624 NCFABVDNFAPWSM-HDKVIUHXSA-N 341.475 1.699 5 50 EDBA biogenic CN(C)CCCNc1c2c(=O)n(C)c(=O)nc-2n(C)c2ccccc12 1589248 LNRUPMPQQGPSQT-UHFFFAOYSA-N 341.415 1.101 5 50 EDBA in-vitro C[C@@H](CC(=O)O)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 17070589 WWUFESNLDATWJB-GFCCVEGCSA-N 335.360 1.744 5 50 EDBA CCCCOC[C@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 19336837 ZXVCQNADWARJBU-QGZVFWFLSA-N 337.420 1.894 5 50 EDBA O=[N+]([O-])c1cn[nH]c1-c1nnc(Nc2ccc3c(c2)OCCO3)o1 12375173 USOOWGBJKXIQSE-UHFFFAOYSA-N 330.260 1.883 5 50 EDBA COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C(=O)NCCF 282622891 YBWVIDXJRUTTEW-MRVPVSSYSA-N 328.300 1.199 5 50 EDBA O=C(NCCCN1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] 19800448 NQKVIUQQUPIAFQ-UHFFFAOYSA-N 327.768 1.700 5 50 EDBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)NCCCN1CCOCC1 20312031 XJHASSMKFHLOPI-ZDUSSCGKSA-N 337.376 1.201 5 50 EDBA Cc1ccc(N2CCCN(c3cc(N)ccc3[N+](=O)[O-])CC2)nn1 193467018 KEYPCHACTFONOH-UHFFFAOYSA-N 328.376 1.992 5 50 EDBA COC[C@]1(O)CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)CC1 1875278956 HPCBLQPFPWWJNU-INIZCTEOSA-N 348.359 1.475 5 50 EDBA O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1CCC(n2cncn2)CC1 120275716 MBYCDCNBTSOSOV-UHFFFAOYSA-N 341.331 1.540 5 50 EDBA CC(C)(C)OC(=O)[C@@]1(C)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 328597430 HDTNCJQCPRASKV-HNNXBMFYSA-N 338.364 1.372 5 50 EDBA COC(=O)[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])n1C)c1ccc(F)cc1 362234744 NKFCQJRMPSAIGZ-INIZCTEOSA-N 349.318 1.891 5 50 EDBA O=C(O)[C@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 222495841 OWPVEEOWFPPUHS-WYUUTHIRSA-N 338.703 1.841 5 50 EDBA COCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 2059129 NFVFZWCRIORGTI-CQSZACIVSA-N 349.343 1.755 5 50 EDBA O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@H]2CCC[C@H]21 280709050 HIYXELJMVQTAEX-KGLIPLIRSA-N 345.359 1.934 5 50 EDBA Cc1nn(CC(=O)NCCc2nc3ccccc3[nH]2)c(C)c1[N+](=O)[O-] 4625440 YJGQSAZJRPRNBR-UHFFFAOYSA-N 342.359 1.643 5 50 EDBA Cc1nonc1OCCNc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 4151237 BGXBEMJCUUJCAD-UHFFFAOYSA-N 349.347 1.614 5 50 EDBA Cc1nn(CCC(=O)N2N=CC[C@@]2(O)C(F)(F)F)c(C)c1[N+](=O)[O-] 6526301 FVVYNLXRYOCWKX-LLVKDONJSA-N 349.269 1.267 5 50 EDBA C[C@@H](NC(=O)c1c[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1ncon1 155544176 XMKAOBIYUUJNLR-MRVPVSSYSA-N 328.288 1.859 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)CN1CCN(C)CC1 163104249 QEXXBUYOJUTIFP-ZDUSSCGKSA-N 335.408 1.661 5 50 EDBA C[C@@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1 186979255 FYAYATUMTHOQTH-DGCLKSJQSA-N 335.360 1.476 5 50 EDBA CCn1cnnc1[C@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])CCO1 370050359 PNNVLIYUMAGMAH-CYBMUJFWSA-N 345.359 1.728 5 50 EDBA NC(=O)c1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])sc2c1CCCC2 8306578 XVPBDJIQUVIOSR-UHFFFAOYSA-N 335.345 1.609 5 50 EDBA CS[C@@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1N(C)C 270674063 SDDHUOZBBZBYDN-UONOGXRCSA-N 338.433 1.171 5 50 EDBA NC(=O)Cn1cc(Nc2ccc([N+](=O)[O-])cc2Br)cn1 253419770 CZSCHRISBJCPAP-UHFFFAOYSA-N 340.137 1.783 5 50 EDBA Cc1nn(C)c(C(=O)N[C@@]2(C(=O)O)CC23CCCCC3)c1[N+](=O)[O-] 2325826771 MGOMFGQAJSAYAQ-OAHLLOKOSA-N 336.348 1.544 5 50 EDBA CC(C)(C)C(=O)COC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 572066 AQJWWQGNSOPFHI-UHFFFAOYSA-N 348.311 1.349 5 50 EDBA Cn1ccc(NC(=O)c2ccn(COc3ccccc3[N+](=O)[O-])n2)n1 2800599 HYGGPXWZXZVCNH-UHFFFAOYSA-N 342.315 1.814 5 50 EDBA Cc1cc(O)nc(N2CCC(Nc3ncccc3[N+](=O)[O-])CC2)n1 952992659 IQNABYCGFXNREH-UHFFFAOYSA-N 330.348 1.875 5 50 EDBA CCc1nc(CN2C(=O)N[C@H](Cc3ccc([N+](=O)[O-])cc3)C2=O)no1 1775990463 MGYFAEWTJZFPCQ-LLVKDONJSA-N 345.315 1.203 5 50 EDBA O=C(COc1cccc([N+](=O)[O-])c1)NN1C(=O)c2ccccc2C1=O 449219 ADOGSOUGBKHTSW-UHFFFAOYSA-N 341.279 1.301 5 50 EDBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1ccc([N+](=O)[O-])cc1 242038553 VMBHBANHSUWHLA-GLQYFDAESA-N 346.387 1.652 5 50 EDBA O=C(CN1CCC[C@@H](c2cnn[nH]2)C1)Nc1ccccc1[N+](=O)[O-] 1875273768 BCLXKVRHONCRGM-LLVKDONJSA-N 330.348 1.531 5 50 EDBA O=C(O)Cn1nc(Br)c([N+](=O)[O-])c1Br 14007243 GUUZTGPTWKIBET-UHFFFAOYSA-N 328.904 1.401 5 50 EDBA COC(=O)CCN1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1 180392749 MEBTYFIQRYPNRP-CYBMUJFWSA-N 349.387 1.613 5 50 EDBA COc1cccc(NC(=O)CNC(=O)c2ccc([N+](=O)[O-])cc2)c1 1051594 AHALAVQLEZKORM-UHFFFAOYSA-N 329.312 1.972 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H](CO)Cc2ccc(C)cc2)c1[N+](=O)[O-] 192933694 QTFJFMGORAGABX-LBPRGKRZSA-N 332.360 1.522 5 50 EDBA CCOC(=O)c1ccnc(NCCc2ccnc(N)c2)c1[N+](=O)[O-] 1775999734 WYSNMNCOEUBTPI-UHFFFAOYSA-N 331.332 1.798 5 50 EDBA O=c1c2cc3c(=O)n(-c4ccncc4)ccc3nc2ccn1CCO 38828963 GSJBDOLGFAHPRB-UHFFFAOYSA-N 334.335 1.088 5 50 EDBA C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1 241644668 PSPHKHMIVKOPMK-RHSMWYFYSA-N 335.404 1.626 5 50 EDBA CC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@](O)(C(F)(F)F)C1 67519 RNFUYCGRUNGHDC-GFCCVEGCSA-N 331.250 1.996 5 50 EDBA Cc1nn([C@H](C)c2nc3c4cnn(C)c4ncn3n2)c(C)c1[N+](=O)[O-] 2800217 GXWLPNRLVIGVBQ-SECBINFHSA-N 341.335 1.342 5 50 EDBA Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N[C@@H]2CCN[C@H](C)C2)c1 262746063 DYRIYMJVKUKTIL-NXEZZACHSA-N 347.824 1.975 5 50 EDBA CCCN(C1CCNCC1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 236879209 BWXSEJTZRZEEEE-UHFFFAOYSA-N 327.406 1.748 5 50 EDBA Cc1ccccc1Cn1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 4820979 LGWXWVLDQFTJKC-UHFFFAOYSA-N 340.343 1.983 5 50 EDBA CCN1CCC[C@H](Nc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1 193717676 UPPLFKKZBUNUKB-JTQLQIEISA-N 328.394 1.138 5 50 EDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(c2nccc(N3CCCC3)n2)CC1 952891578 GOOVYOPMXZPSLA-ZIAGYGMSSA-N 345.403 1.448 5 50 EDBA C[S@@](=O)Cc1noc(-c2ccn(-c3cccc([N+](=O)[O-])c3)n2)n1 328593783 JDUQHJMENCDRGM-HSZRJFAPSA-N 333.329 1.709 5 50 EDBA Nc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2O)s1 9170617 BSHRRICBYFJEJT-UHFFFAOYSA-N 327.347 1.465 5 50 EDBA CCn1cc(CN(C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1 14226312 WJXAPJYGYRRNTI-UHFFFAOYSA-N 338.389 1.940 5 50 EDBA CCS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4687404 XMVFGMTXZMFWRF-UHFFFAOYSA-N 333.797 1.720 5 50 EDBA CCOC(=O)c1cc(OCCOC)c(OCCOC)cc1[N+](=O)[O-] 38343034 VOHOFZNVWZWVMA-UHFFFAOYSA-N 343.332 1.822 5 50 EDBA CCCCOC[C@@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 19336833 ZXVCQNADWARJBU-KRWDZBQOSA-N 337.420 1.894 5 50 EDBA CS(=O)(=O)N1CCC[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)C1 1060602 UTCFKFMBDIUDDS-SNVBAGLBSA-N 327.362 1.205 5 50 EDBA COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](OC)C(=O)O)cc1SC 263052112 GIPWWVMQFIXCNX-JTQLQIEISA-N 344.345 1.155 5 50 EDBA COC(=O)[C@@H]1[C@H]2CC(=O)[C@@H](c3cccc([N+](=O)[O-])c32)[C@H]1C(=O)OC 247827907 KDQBUWYUZUHUGY-OKVQYTGBSA-N 333.296 1.327 5 50 EDBA CNc1nccc(C(=O)N2CCOC3(CCCCC3)C2)c1[N+](=O)[O-] 408517105 FEJOGKMSFTYFHS-UHFFFAOYSA-N 334.376 2.207 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc(F)c([N+](=O)[O-])c1 6535827 SBEFGWHNBMIEMN-UHFFFAOYSA-N 343.270 1.969 5 50 EDBA Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC(F)(c2ccccn2)CC1 935884014 ZSHZPMJMIAZXTA-UHFFFAOYSA-N 347.350 1.982 5 50 EDBA Cc1ccc(S(=O)(=O)NCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 469462 VFHKXAIMOFHXNY-UHFFFAOYSA-N 349.368 1.820 5 50 EDBA CS(=O)(=O)Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 4772910 JGXUHUJGYWAUGQ-UHFFFAOYSA-N 329.212 1.893 5 50 EDBA CN(c1nncs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl 184979187 UIUYZZRASZBVDT-UHFFFAOYSA-N 334.766 1.925 5 50 EDBA NS(=O)(=O)c1ccc(N2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 798415983 KCVWHCKXXRVTJC-NSHDSACASA-N 348.384 1.631 5 50 EDBA COc1ccc(OC)c(S(=O)(=O)n2c([N+](=O)[O-])cnc2C)c1 53202 AZDQYBKQNLDUDO-UHFFFAOYSA-N 327.318 1.354 5 50 EDBA CN(CCCO)S(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 416530053 SDIQRVWKCVEHBZ-UHFFFAOYSA-N 342.295 1.617 5 50 EDBA Cc1cc(S(=O)(=O)N2CC[C@@H]3CNC[C@@H]3CC2)ccc1[N+](=O)[O-] 420422056 MBCODHNCGMSDAO-BETUJISGSA-N 339.417 1.523 5 50 EDBA O=C(Nc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1C(=O)Nc2ccccc21 1875390520 NTXHUFRZADUPKC-CYBMUJFWSA-N 325.280 1.838 5 50 EDBA O=c1[nH]c2ccc(S(=O)(=O)N3CCOCC3)cc2c2ccccc12 4625977 AWWLKRZOQZDTQF-UHFFFAOYSA-N 344.392 1.702 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1[C@@H]2CCc3ccccc3[C@H]21 155122649 BLIWGFUZVWTVFD-JJRVBVJISA-N 326.356 1.884 5 50 EDBA O=[N+]([O-])[C@@H]([C@H]1NCCc2ccccc21)S(=O)(=O)c1ccccc1 5279593 DKQXXLNKHXUAAR-JKSUJKDBSA-N 332.381 1.950 5 50 EDBA NC[C@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 725373270 PESMGLSBKGTIGZ-NSHDSACASA-N 333.369 1.846 5 50 EDBA O=C1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CN1CC1CC1 412310173 SMDBUOLMYRCLQH-LSDHHAIUSA-N 329.356 1.737 5 50 EDBA O=C(NC(=S)N[C@H]1CCSC1=O)c1ccc([N+](=O)[O-])cc1 2910612 YVJGENXTVNFROS-VIFPVBQESA-N 325.371 1.231 5 50 EDBA CCCCNC(=O)OCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 4012584 VZYZMPAXLUDJNE-UHFFFAOYSA-N 345.377 1.399 5 50 EDBA CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H](O)C(F)(F)F 270801883 JVOLXBHYOGKGHI-ZJUUUORDSA-N 342.295 1.575 5 50 EDBA Cc1ccc(NCCCNC(=O)[C@H](O)c2cnn(C)c2)c([N+](=O)[O-])c1 252486120 HHLXEJVNMMAMDI-OAHLLOKOSA-N 347.375 1.289 5 50 EDBA O=c1c2cc3c(=O)n(-c4ccccc4)ccc3nc2ccn1CCO 38828951 ZHNZRDWWOLADOK-UHFFFAOYSA-N 333.347 1.693 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCNCc2ccccc21 336869122 YEOASVHPWCMPGY-UHFFFAOYSA-N 333.369 1.893 5 50 EDBA CC(=O)Nc1cccc2c1CCN(C(=O)c1c[nH]nc1[N+](=O)[O-])C2 170617929 GFLPKUJHHOXYGE-UHFFFAOYSA-N 329.316 1.475 5 50 EDBA COC(=O)c1cc([N+](=O)[O-])cn(C[C@H]2CCCCN2C(C)C)c1=O 408525216 PPPKSTOUZVDFFO-GFCCVEGCSA-N 337.376 1.806 5 50 EDBA Cc1nccn1C[C@@H]1CCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 178750436 FVAVZQTZWHXICM-HNNXBMFYSA-N 343.387 1.863 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ncn(-c2ccccc2)n1 181366003 BYCXJRURJCLEIY-UHFFFAOYSA-N 345.340 1.976 5 50 EDBA CC1=NN(C(=O)[C@H](C)n2nc([N+](=O)[O-])cc2C)[C@@](O)(C(F)(F)F)C1 6922282 JSNWRVSANOKHDQ-KWQFWETISA-N 349.269 1.520 5 50 EDBA CC(C)C[C@H]1C(=O)NCCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 408519725 VVDLAMJHONGZTI-UONOGXRCSA-N 335.360 1.001 5 50 EDBA C[C@]1(NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO[C@@H]1C1CC1 273085941 LYTMYJRGQBMQHJ-CABCVRRESA-N 340.401 1.972 5 50 EDBA O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1cc([N+](=O)[O-])c[nH]1 170613500 QRQJBCDSTZILAR-UHFFFAOYSA-N 326.316 1.681 5 50 EDBA CN(Cc1cn[nH]c1)c1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] 952994897 WFDJKWVVRNRLMH-UHFFFAOYSA-N 346.315 1.951 5 50 EDBA C[C@H](CC1CC1)NC(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1 247135474 XODKOTKLDHCKSS-KMUNFCNLSA-N 337.376 1.477 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1[N+](=O)[O-] 171804321 MDCNOGQQMWETDP-SDDRHHMPSA-N 337.424 1.977 5 50 EDBA O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCOc2cc(O)ccc2C1 289314494 WUINBRLLYVEMOU-UHFFFAOYSA-N 347.331 1.101 5 50 EDBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(Cc2ccc(F)cc2)CC1 20028658 TWJVIQZBKIHZCN-UHFFFAOYSA-N 333.323 1.415 5 50 EDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNc1cccc(F)c1[N+](=O)[O-] 301560189 KCTWLEIAEDRRRJ-DUBDDPSESA-N 345.330 1.953 5 50 EDBA O=[N+]([O-])c1ccc(CCS(=O)(=O)NCCc2ccnnc2)cc1 1775994769 CAAAPKSGTGVQIT-UHFFFAOYSA-N 336.373 1.089 5 50 EDBA O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCC(=O)c1ccccc1 2820996 RYRBVLHQBLYQMC-UHFFFAOYSA-N 342.307 1.751 5 50 EDBA O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOCC1 4819015 SOXACEAEXXQZAL-UHFFFAOYSA-N 333.266 1.884 5 50 EDBA CN(C)C(=O)N1CCC(c2nc(-c3c([N+](=O)[O-])ncn3C)no2)CC1 225553323 PODSQFBGUVQUCR-UHFFFAOYSA-N 349.351 1.239 5 50 EDBA CNS(=O)(=O)c1ccc(N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)c([N+](=O)[O-])c1 242302083 YPJBENXHYGUTHQ-PCVQNBPASA-N 337.401 1.738 5 50 EDBA C[C@H]1CCCN(c2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])C1 238950283 XLTLTBALGAXJRF-WDEREUQCSA-N 336.396 1.794 5 50 EDBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(c2ncccn2)CC1 2773402 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LKRBWHRCIQKLCH-GFCCVEGCSA-N 342.421 1.596 5 50 EDBA NCC1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1ccc([N+](=O)[O-])cc1 170051084 CCHHJXBOGARAEY-VGPLMAKISA-N 325.390 1.485 5 50 EDBA C[C@@H](C(=O)NCCCNc1ncnc2ccc([N+](=O)[O-])cc12)C1CC1 408516748 WANIXHFZHBZJQS-LLVKDONJSA-N 343.387 2.502 5 50 EDBA CCOC(=O)C(C(=O)OCC)[C@@H](C[N+](=O)[O-])c1ccc(OC)cc1 5044469 LKFSAWLBGBANNQ-ZDUSSCGKSA-N 339.344 1.798 5 50 EDBA Cc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-] 102037 FYJMWNFFHMVQFU-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA Cc1ccc(CN2CCC(C(=O)N3CCOCC3)CC2)cc1[N+](=O)[O-] 179689260 MZQANTDECMELBQ-UHFFFAOYSA-N 347.415 1.974 5 50 EDBA Cc1nc([N+](=O)[O-])c(N[C@H]2CCN(c3ccccc3C(N)=O)C2)n1C 1875257789 NSXCYDOMQMOBHG-NSHDSACASA-N 344.375 1.426 5 50 EDBA COc1cc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])cc(Br)c1O 85980 YXUKMPOZDZNNOS-KWQFWETISA-N 345.149 1.760 5 50 EDBA COc1ccc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)cc1[N+](=O)[O-] 22023353 XSBHBWYZSREINK-HWKANZROSA-N 334.244 1.471 5 50 EDBA Cc1ccc([N+](=O)[O-])c(NCCc2ccc(S(N)(=O)=O)cc2)n1 128912605 WZLABNPGSPHTIU-UHFFFAOYSA-N 336.373 1.600 5 50 EDBA Cc1cc(C(=O)N2CCCN(CC(F)F)CC2)c(N)c([N+](=O)[O-])c1 130547817 SPWMDPGLOBKJCQ-UHFFFAOYSA-N 342.346 1.898 5 50 EDBA C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1S(C)(=O)=O 4117407 BZERGBHMTPXECF-VIFPVBQESA-N 333.797 1.718 5 50 EDBA O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1ccc(F)cc1 67174 CHBBZTGBCOJHRO-UHFFFAOYSA-N 343.270 1.969 5 50 EDBA O=C1CC[C@@H]([N+](=O)[O-])[C@H](c2cc3c(cc2Br)OCO3)N1 112066 PRJGMUUNRHWKBF-PELKAZGASA-N 343.133 1.774 5 50 EDBA O=C(O)c1cc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)ccc1O 197158 HHZCBPVNGVHZOI-UHFFFAOYSA-N 328.236 1.799 5 50 EDBA O=C(O)c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1O 244151 RPBIYPXFSLTUKR-UHFFFAOYSA-N 328.236 1.799 5 50 EDBA CN(c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@H]1CCN(C2CC2)C1 354079483 HVCNOHUGHSLJCM-LBPRGKRZSA-N 339.417 1.671 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc2c(s1)CCCC2 193536033 WDONSHUEFZZPFB-UHFFFAOYSA-N 334.357 1.731 5 50 EDBA C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)N1CCc2ccccc2C1 356461370 OWWZADPQZPEFNA-GFCCVEGCSA-N 343.387 1.505 5 50 EDBA NC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 160159442 WCYBWXDKNVNAME-AWEZNQCLSA-N 327.406 1.781 5 50 EDBA NC(=O)Cn1nc(I)c2ccc([N+](=O)[O-])cc21 225825439 BXSYBYSFVQFKNT-UHFFFAOYSA-N 346.084 1.034 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC(=O)N(C2CC2)C1 281940441 LINUBHURVMYPAT-SNVBAGLBSA-N 348.359 1.878 5 50 EDBA CCC[C@H](NC(=O)c1c([N+](=O)[O-])c(C)nn1C)C(=O)OC(C)(C)C 161311843 BYKRUNCFQMZICK-JTQLQIEISA-N 340.380 1.877 5 50 EDBA Brc1ccc(OC[C@@H]2C[N+]34CCO[B-]3(OCC4)O2)cc1 169794809 OSJNPTYVZKBLMW-HLIUYOAVSA-N 341.998 1.540 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] 171804318 MDCNOGQQMWETDP-GRYCIOLGSA-N 337.424 1.977 5 50 EDBA CNS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]32)c([N+](=O)[O-])c1 242302080 YPJBENXHYGUTHQ-JOXOIDLHSA-N 337.401 1.738 5 50 EDBA CC[N+](CC)(CC)CCNC(=O)c1c(O)nc2c(c1O)CCCC2 299738328 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O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]1C1CC1 170594691 YJGJRTGXQGVIET-KBPBESRZSA-N 338.385 1.531 5 50 EDBA O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@H]1OB(O)c2ccccc21 1875365932 SDGAGNWAGUPZCY-ZNFPLGDCSA-N 338.128 1.183 5 50 EDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1S(C)(=O)=O 4117554 YGCSFYWXSMBDES-SECBINFHSA-N 333.797 1.718 5 50 EDBA O=C(C[C@H]1CCCO1)NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 850886077 OTCHSRHEJYLCOI-SECBINFHSA-N 332.309 1.108 5 50 EDBA CC(=O)c1cc(=O)n(CC(=O)N(C2CC2)[C@H](C)C2CC2)cc1[N+](=O)[O-] 1775998736 HLMXRHLBFXDHOX-SNVBAGLBSA-N 347.371 1.749 5 50 EDBA Cc1nn(C(=O)Cn2ccc([N+](=O)[O-])n2)c(C)c1Br 1069209 ZAITUPNAOYZUID-UHFFFAOYSA-N 328.126 1.708 5 50 EDBA Cc1nnnn1CC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 154601352 SOPAQOYGQNMPQX-UHFFFAOYSA-N 330.226 1.547 5 50 EDBA CCCCn1ccc2nc3ccn(-c4ncn[nH]4)c(=O)c3cc2c1=O 40372900 ILLPGIBLVSTOMW-UHFFFAOYSA-N 336.355 1.619 5 50 EDBA CS[C@@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1N(C)C 270674068 SDDHUOZBBZBYDN-ZIAGYGMSSA-N 338.433 1.171 5 50 EDBA Cc1nn(C(=O)c2nn(C)cc2[N+](=O)[O-])c(C)c1Br 78642 MEIVWFDITVNVFN-UHFFFAOYSA-N 328.126 1.593 5 50 EDBA COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)N[C@H](C)C1 3877917 MRIHNUXPGVKEED-GHMZBOCLSA-N 336.392 1.492 5 50 EDBA Cc1nn(C)c(C(=O)NCc2ccc(-n3cccn3)cc2)c1[N+](=O)[O-] 2735438 GDXTWSJUIYLUFK-UHFFFAOYSA-N 340.343 1.752 5 50 EDBA Cc1c([N+](=O)[O-])cnn1CCC(=O)NCc1c(Cl)cnn1C 2802921 PVDWRFLSCQAUSG-UHFFFAOYSA-N 326.744 1.193 5 50 EDBA CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O 2379673 WKOHDYUJJUVBQB-VIFPVBQESA-N 326.305 1.821 5 50 EDBA CS(=O)(=O)N(CC(=O)c1ccccc1)c1cccnc1[N+](=O)[O-] 196212206 YBZOFSKKKYZDJS-UHFFFAOYSA-N 335.341 1.639 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](n2ccnn2)C1 874433835 SIMFJDFMZABNKW-GFCCVEGCSA-N 337.361 1.130 5 50 EDBA Cc1cc(O)nc(N2CC[C@H](Nc3cc(C)c([N+](=O)[O-])cn3)C2)n1 952994691 TZJVZWHYSKTMJE-NSHDSACASA-N 330.348 1.793 5 50 EDBA CS(=O)(=O)NCCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 4551519 LDADRZMGEMWSFZ-UHFFFAOYSA-N 341.311 1.965 5 50 EDBA CN(c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])S(C)(=O)=O 4800249 ABGZAZGRKBMOFS-UHFFFAOYSA-N 343.239 1.918 5 50 EDBA Cc1c(CN2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cnn1C 20028672 UOCADDHIHMOHEZ-UHFFFAOYSA-N 343.387 1.595 5 50 EDBA C[C@@H]1CCCC[C@@]1(CN)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 170683113 LMARCVWKEFMMAB-RISCZKNCSA-N 327.406 1.781 5 50 EDBA CCCOC(=O)Nc1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 25667366 HKNCTIRSPLAHIV-UHFFFAOYSA-N 347.305 1.865 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(CN2CCOCC2)c1 20602155 XVGKRKVPXOZJGO-UHFFFAOYSA-N 345.359 1.262 5 50 EDBA O=C1CN(CCCNc2ccc([N+](=O)[O-])c3cnccc23)CCN1 269978619 QLFVEOBGGMYRLX-UHFFFAOYSA-N 329.360 1.377 5 50 EDBA CCO[C@@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1OC 252511782 KLPUQGDNUNJSQS-YNEHKIRRSA-N 330.362 1.066 5 50 EDBA CN(c1ncc(Cl)cc1[N+](=O)[O-])C1CCN(S(C)(=O)=O)CC1 269345451 DDTLDXUQDPGAKG-UHFFFAOYSA-N 348.812 1.503 5 50 EDBA C[C@H]1CN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C[C@@H](C2CC2)O1 280466570 MRSFDEDZUIVNPH-XPTSAGLGSA-N 341.389 1.246 5 50 EDBA O=[N+]([O-])c1cn[nH]c1-c1n[nH]c(Nc2ccc3c(c2)OCCO3)n1 12375170 BGPRUAJNCFJAPP-UHFFFAOYSA-N 329.276 1.618 5 50 EDBA O=[N+]([O-])c1ccc(F)cc1S(=O)(=O)Nc1ccc2[nH]nnc2c1 130775558 IISPZVJZYFSTRE-UHFFFAOYSA-N 337.292 1.806 5 50 EDBA Cn1nccc1C1=CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 1875273790 HOTLBTSRSNOWHI-UHFFFAOYSA-N 327.344 1.666 5 50 EDBA COCCC(=O)N1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1 408514962 WZYMBOFOKUHFRS-UHFFFAOYSA-N 335.360 1.224 5 50 EDBA NS(=O)(=O)c1ccc(CCNC(=O)c2cccc([N+](=O)[O-])c2)cc1 182447 CNORYVRKXBDIGK-UHFFFAOYSA-N 349.368 1.215 5 50 EDBA O=C1Nc2nccc([N+](=O)[O-])c2C1(Br)Br 261494174 RLXXOYWALDXSLV-UHFFFAOYSA-N 336.927 1.885 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(S(C)(=O)=O)CC1 610315 ASDUTNRWQGLLOS-UHFFFAOYSA-N 341.389 1.513 5 50 EDBA COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1 4866246 IZMCEPBVFRXWOR-CYBMUJFWSA-N 335.316 1.412 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1NCC[C@@]1(O)C(=O)Nc2ccccc21 877871904 WXRLFIHGDCMXJK-INIZCTEOSA-N 345.359 1.762 5 50 EDBA CC[C@@H](C)n1c(=N)c(C(=O)NC)cc2c(=O)n3ccccc3nc21 100894655 WIMLCYMRNPRYEF-SNVBAGLBSA-N 325.372 1.459 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(NCCn2ccc(C3CC3)n2)n1 1775989717 GTPREKKGWQSCND-UHFFFAOYSA-N 331.332 1.962 5 50 EDBA NC[C@H]1CCCC[C@@H]1NS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 170684842 MXZFDMDWNQPYMA-RNCFNFMXSA-N 331.369 1.530 5 50 EDBA COC(=O)C(C(=O)OC)c1cc(Br)ccc1[N+](=O)[O-] 261507664 KWBWIWMMGAYKFS-UHFFFAOYSA-N 332.106 1.787 5 50 EDBA Cc1nn(CCC(=O)N2N=CC[C@]2(O)C(F)(F)F)c(C)c1[N+](=O)[O-] 6526312 FVVYNLXRYOCWKX-NSHDSACASA-N 349.269 1.267 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cnc2c(c1)CNCC2 725373767 AFSRBOMJYDNFMP-UHFFFAOYSA-N 334.357 1.436 5 50 EDBA O=[N+]([O-])c1cnn(CCc2nnc(-c3ccn(C(F)F)n3)o2)c1 2788838 CGFMWSDMWUGOLB-UHFFFAOYSA-N 325.235 1.676 5 50 EDBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2 243919564 BOXKKTMOTZGMSL-AXCCWNJRSA-N 332.312 1.740 5 50 EDBA NC(=O)c1ccc(CSc2ncnc3[nH]cnc23)c([N+](=O)[O-])c1 161360006 PAHGJXCVAZNHJH-UHFFFAOYSA-N 330.329 1.652 5 50 EDBA Cc1nn(C)c(C)c1CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 14250091 USKDUNCQCUQSSM-UHFFFAOYSA-N 338.389 1.766 5 50 EDBA COC(=O)[C@H](C(C)=O)[C@@H](C[N+](=O)[O-])c1ccc(OC)c(OC)c1 4783897 UHBZYRRWWAZFKP-SMDDNHRTSA-N 325.317 1.442 5 50 EDBA CCOc1cccc(N2CCCN(S(C)(=O)=O)CC2)c1[N+](=O)[O-] 253421715 JAXYUTYOLRHGJH-UHFFFAOYSA-N 343.405 1.465 5 50 EDBA O=C(NCCn1c(=O)[nH]c2ccccc21)c1ccc(F)cc1[N+](=O)[O-] 134312900 UMJIHLAPEFWUGM-UHFFFAOYSA-N 344.302 1.807 5 50 EDBA Cc1ccnc(N[C@H]2CC(=O)N(C3CCN(C)CC3)C2)c1[N+](=O)[O-] 1776005245 DWSRTONTEPIKJS-LBPRGKRZSA-N 333.392 1.405 5 50 EDBA CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)n2nnnc2N1 4820552 NAAZHTPKBUSDCX-ZDUSSCGKSA-N 344.331 1.822 5 50 EDBA O=C1CC[C@H]([N+](=O)[O-])[C@H](c2cc3c(cc2Br)OCO3)N1 112058 PRJGMUUNRHWKBF-UFBFGSQYSA-N 343.133 1.774 5 50 EDBA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(CO)C=C[C@@]3(C)O2)cc1[N+](=O)[O-] 222238451 QLPXEIOCBJDFQX-GFOFROLCSA-N 344.323 1.099 5 50 EDBA COC(=O)c1ccnc(N2CCC[C@@H](C(=O)N(C)C)C2)c1[N+](=O)[O-] 1333659257 IHKJJTJWFCIPKC-SNVBAGLBSA-N 336.348 1.081 5 50 EDBA COC(=O)CC1CCN(C(=O)Cc2ccc([N+](=O)[O-])c(N)c2)CC1 408520865 JHXWHMBUKQEEQS-UHFFFAOYSA-N 335.360 1.521 5 50 EDBA CC[C@@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@@]45C[C@@H]([C@H]2[C@@H]5O)[N@+]3(C)[C@@H]1O 1772493020 NCFABVDNFAPWSM-BIMCYRLZSA-N 341.475 1.699 5 50 EDBA C[C@@H]1CO[C@H](c2ccccc2)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 229836562 RYMJVRHMDPNKHK-XYPHTWIQSA-N 346.387 1.614 5 50 EDBA CC[C@H](C(=O)N1N=C(C)C[C@@]1(O)C(F)(F)F)n1cc([N+](=O)[O-])cn1 6555268 JTQAQIJHXMAAMT-MWLCHTKSSA-N 349.269 1.602 5 50 EDBA O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Nc1nccs1 36289542 VMBASGIUVLNASL-UHFFFAOYSA-N 347.400 1.812 5 50 EDBA Cn1ncnc1C1(O)CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 952992052 IMONXOYDVCAMJK-UHFFFAOYSA-N 337.767 1.865 5 50 EDBA COC(=O)c1nc(N2CC[C@H](C)C2)nc(N2CC[C@@H](C)C2)c1[N+](=O)[O-] 408524545 VMIWQWIIPHLQDT-MNOVXSKESA-N 349.391 1.864 5 50 EDBA COc1ccnc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)n1 170618556 NNXSKCDVXKOEDV-UHFFFAOYSA-N 338.345 1.527 5 50 EDBA Cc1nn(C)c(N2CCC[C@@H](c3nc(N(C)C)no3)C2)c1[N+](=O)[O-] 241634630 PNXBZDSTNVQAPN-SNVBAGLBSA-N 335.368 1.470 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccn2)CC1 19782522 IRYWMXWDQHOXIH-UHFFFAOYSA-N 326.356 1.948 5 50 EDBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCc1ccns1 1309806672 ZXCLELHDRYEGSS-UHFFFAOYSA-N 327.387 1.881 5 50 EDBA CC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](O)c1c(F)cccc1F 272283016 UBNGERPVZCUJOQ-NOZJJQNGSA-N 340.286 1.838 5 50 EDBA COCc1nnc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 2497405 WELOGPWHNSAOHP-UHFFFAOYSA-N 330.347 1.394 5 50 EDBA CCC[C@@H](NC(=O)c1c([N+](=O)[O-])c(C)nn1C)C(=O)OC(C)(C)C 161311953 BYKRUNCFQMZICK-SNVBAGLBSA-N 340.380 1.877 5 50 EDBA O=C(CNc1cc(Br)cc([N+](=O)[O-])c1)N1CCOCC1 241923270 UEMCBGBDRVETAD-UHFFFAOYSA-N 344.165 1.628 5 50 EDBA NC(=O)C1CCN(c2cc(N3CCOCC3)ccc2[N+](=O)[O-])CC1 4703352 FRDKJMCFDIEXLF-UHFFFAOYSA-N 334.376 1.133 5 50 EDBA O=C(C[C@@H]1N[C@@H]2CCCC[C@@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1 13776766 PDUFJMZIZWSOSY-RDBSUJKOSA-N 332.360 1.323 5 50 EDBA COc1cc(OC)c(OC)cc1/C=C/c1nc(O)[nH]c(=O)c1[N+](=O)[O-] 4727687 YMKHEANJECGDTL-SNAWJCMRSA-N 349.299 1.580 5 50 EDBA Cc1ncc(CCNS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)o1 1775992446 ZMYCZDNWLROKFU-UHFFFAOYSA-N 327.318 1.118 5 50 EDBA CC(=O)N1CC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)C1 170596311 UOAQNGOZIRWDPS-LLVKDONJSA-N 328.328 1.950 5 50 EDBA O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1 5014308 XEGZKTUXGRZQMN-UHFFFAOYSA-N 343.295 1.578 5 50 EDBA N[C@@H]1CCC[C@@]12CCN(S(=O)(=O)c1ccc([N+](=O)[O-])cc1)C2 225357681 YOJOUWAEYLTUAH-KGLIPLIRSA-N 325.390 1.487 5 50 EDBA C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1O 225467065 IFWDOHONBGLFSX-QMTHXVAHSA-N 325.340 1.765 5 50 EDBA CCc1cc(N2CCN[C@@H](CO)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 952993320 WUIOGQBSKIUKLA-CQSZACIVSA-N 343.387 1.385 5 50 EDBA O=C(NCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccnc1 20109473 LOLPZCITKKAMRG-UHFFFAOYSA-N 341.371 1.499 5 50 EDBA CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(O)c([N+](=O)[O-])c1 35817513 YJOCNPKDGYJHKP-ZDUSSCGKSA-N 335.316 1.882 5 50 EDBA C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)CC(=O)O 262162284 CTTIWZOHIJJLJL-SNVBAGLBSA-N 332.316 1.621 5 50 EDBA Nc1cc(N2CCN(C(=O)c3cccc(F)c3)CC2)ncc1[N+](=O)[O-] 952992599 PPZBLJBLAJBMDC-UHFFFAOYSA-N 345.334 1.674 5 50 EDBA C[C@@H]1CN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C[C@H](C2CC2)O1 280467821 MRSFDEDZUIVNPH-YMTOWFKASA-N 341.389 1.246 5 50 EDBA Cn1c(=O)c([N+](=O)[O-])c(NCCCN2CCOCC2)c2ccccc21 19807960 GKOZCTOQNKJYOS-UHFFFAOYSA-N 346.387 1.581 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1C2CC3CC(C2)CC1C3 135658780 CPIQJAVRSCSGGT-UHFFFAOYSA-N 345.399 1.945 5 50 EDBA COC(=O)c1cn([C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C)n3)C2)nn1 253429385 SEFCEASPFXYAOA-LLVKDONJSA-N 346.347 1.518 5 50 EDBA COC(OC)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 408515687 YQVYOBITUCQLCF-CQSZACIVSA-N 334.332 1.268 5 50 EDBA COC(=O)[C@H]1[C@H]2CC(=O)[C@@H](c3cccc([N+](=O)[O-])c32)[C@H]1C(=O)OC 247827911 KDQBUWYUZUHUGY-ZLCVWYCYSA-N 333.296 1.327 5 50 EDBA COC(=O)c1ccnc(N2CCC[C@H](C(=O)N(C)C)C2)c1[N+](=O)[O-] 1333659256 IHKJJTJWFCIPKC-JTQLQIEISA-N 336.348 1.081 5 50 EDBA Nc1ncnc(N2CCN(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] 3912692 RRIDHNKFACQPKW-UHFFFAOYSA-N 334.767 1.947 5 50 EDBA CCOC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)c1=N 100318769 WGCDXNGWQYSZRH-UHFFFAOYSA-N 326.356 1.886 5 50 EDBA O=c1[nH]cnc2c1C(c1ccc([N+](=O)[O-])cc1)c1c(nc[nH]c1=O)O2 18202595 DXZUGVPAJKCKAS-UHFFFAOYSA-N 339.267 1.047 5 50 EDBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)NCc1ccco1 196060 FVISPXSECSDPKC-UHFFFAOYSA-N 343.137 1.772 5 50 EDBA Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(F)cn2)CC1 367673925 SQORUXRLPFTTPG-UHFFFAOYSA-N 345.334 1.795 5 50 EDBA C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] 194016124 VGKOUZLEGLJKDC-WDEREUQCSA-N 325.340 1.261 5 50 EDBA O=C(Cn1nnc2ccccc21)OCC(=O)c1ccc([N+](=O)[O-])cc1 367976 SXRLXEONSCZADL-UHFFFAOYSA-N 340.295 1.766 5 50 EDBA O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1=O)Nc1ccc([N+](=O)[O-])cc1 100830744 OXCOLCMOOINXIJ-CHPZLBCBSA-N 343.339 1.564 5 50 EDBA Cc1cc(=O)n(CCn2cnc3ccccc3c2=O)cc1[N+](=O)[O-] 342318976 JCGINPODMMSSEC-UHFFFAOYSA-N 326.312 1.475 5 50 EDBA CN(C)C(C)(C)CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CCC[C@@H]1O 170613458 WFWWHVAXKYDTIF-KGLIPLIRSA-N 338.408 1.619 5 50 EDBA O=C(O)C[C@@H](NCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4676818 ZUBIRYADMXXFAE-CYBMUJFWSA-N 333.300 1.759 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N(C2CCNCC2)C2CC2)cc1 378249482 GRWPNRNKCOZJLL-UHFFFAOYSA-N 325.390 1.500 5 50 EDBA CCS(=O)(=O)NC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 192657042 QIPYJOGALPBYEZ-UHFFFAOYSA-N 347.418 1.200 5 50 EDBA Cn1cc(N2CCC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)C2)cn1 154051407 RMOSPRDNENPZNH-CYBMUJFWSA-N 329.360 1.727 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3cn[nH]c3)C2)n1 952988897 MXQZKKRVJYFHDU-SNVBAGLBSA-N 331.332 1.884 5 50 EDBA CC1=NN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@](O)(C(F)(F)F)C1 67514 RNFUYCGRUNGHDC-LBPRGKRZSA-N 331.250 1.996 5 50 EDBA COc1ccccc1-c1nnc(Sc2nc([N+](=O)[O-])nn2C)o1 2851874 KIXAQAHEYFGFQB-UHFFFAOYSA-N 334.317 1.933 5 50 EDBA O=C(O)CCN(CCC(=O)O)c1nc2ccc([N+](=O)[O-])cc2s1 4697426 WXDDHKPJCLVUES-UHFFFAOYSA-N 339.329 1.960 5 50 EDBA C[C@H](NC(=O)c1nc(Cn2ccc([N+](=O)[O-])n2)no1)c1ccccc1 4727253 VMWZPDSWRCEKFD-JTQLQIEISA-N 342.315 1.714 5 50 EDBA Cc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(CO)C=C[C@@]3(C)O2)cc1[N+](=O)[O-] 101453039 QLPXEIOCBJDFQX-KFZJALRRSA-N 344.323 1.099 5 50 EDBA NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br 121094499 QKOMSXHUADEZLF-SNVBAGLBSA-N 342.149 1.447 5 50 EDBA COC(=O)c1cn([C@@H]2CCCN(c3cc(N)ccc3[N+](=O)[O-])C2)nn1 241435117 NKUFXYVOFHARNJ-LLVKDONJSA-N 346.347 1.397 5 50 EDBA C[C@H]1CN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C[C@H](C2CC2)O1 280466566 MRSFDEDZUIVNPH-LKFCYVNXSA-N 341.389 1.246 5 50 EDBA CCc1cnc(CN2C(=O)N[C@@H](Cc3ccc([N+](=O)[O-])cc3)C2=O)o1 1775991841 VWMJMVGAUHEUBJ-ZDUSSCGKSA-N 344.327 1.808 5 50 EDBA CCn1ncc(-n2c(S)nnc2CCn2cc([N+](=O)[O-])cn2)c1C 2802636 MBCGJOOUJVMGRR-UHFFFAOYSA-N 348.392 1.428 5 50 EDBA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1O 179444086 IIFPELOACQLVKN-VIFPVBQESA-N 347.293 1.914 5 50 EDBA CC[C@H](C)n1c(=N)c(C(=O)NC)cc2c(=O)n3ccccc3nc21 100894657 WIMLCYMRNPRYEF-JTQLQIEISA-N 325.372 1.459 5 50 EDBA C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@]2(CCO[C@@H]2C)O1 279235646 GSPHNFQZDXYVIL-UVWXRNBGSA-N 335.360 1.586 5 50 EDBA COC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@@H]12 14944574 INMSNIOAXIMXNT-AKWBHNSASA-N 331.328 1.400 5 50 EDBA Cc1nc(NCCc2cccc([N+](=O)[O-])c2)sc1S(N)(=O)=O 241738552 QYLFXBKKSIIBNL-UHFFFAOYSA-N 342.402 1.662 5 50 EDBA NC[C@@H]1CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 725373268 PESMGLSBKGTIGZ-LLVKDONJSA-N 333.369 1.846 5 50 EDBA O=[N+]([O-])c1cnc(N2CCC[C@H](N3CCCS3(=O)=O)C2)c(F)c1 408462619 AEMSXDFNICUBJC-JTQLQIEISA-N 344.368 1.133 5 50 EDBA CC[C@@]1(C)NC(=O)N(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C1=O 225489510 ABUPNUFAJIBXLW-XVJNWHFHSA-N 332.316 1.360 5 50 EDBA CSc1nc2c(c(=O)[nH]1)[C@@H](c1ccccc1[N+](=O)[O-])CC(=O)N2 111968580 PGUXGNSDARXUCJ-MRVPVSSYSA-N 332.341 1.874 5 50 EDBA CC1=NN(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)[C@](O)(C(F)(F)F)C1 374422 ZUQKAOGNIPFNHC-LLVKDONJSA-N 349.269 1.267 5 50 EDBA CC1=NN(C(=O)[C@@H](C)n2nc([N+](=O)[O-])cc2C)[C@@](O)(C(F)F)C1 6922289 JWTBURMIOYXIOA-PELKAZGASA-N 331.279 1.223 5 50 EDBA COC(=O)c1cc(C)nc(N2CC[C@H](c3cnccn3)C2)c1[N+](=O)[O-] 952877028 KZJKGOKPDXPHDC-NSHDSACASA-N 343.343 1.869 5 50 EDBA CN(C)C(C)(C)CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CCC[C@H]1O 170613463 WFWWHVAXKYDTIF-UONOGXRCSA-N 338.408 1.619 5 50 EDBA NC(=O)Cn1nc([N+](=O)[O-])nc1Oc1ccc(Br)cc1 1430433 NNEMBXQQLRDNRD-UHFFFAOYSA-N 342.109 1.226 5 50 EDBA CCOC(=O)C1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 4294266 NIXDQKZIOJKSKT-UHFFFAOYSA-N 342.373 1.559 5 50 EDBA COc1nscc1CN(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 952995560 QBEYGCFKYOMGPP-UHFFFAOYSA-N 343.386 1.881 5 50 EDBA O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCc1ccco1 117395 PGRKDTVAKPDXSI-UHFFFAOYSA-N 343.295 1.490 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCNC(=O)[C@@H]1CC 282014659 ROFINTZGRSSIKU-LBPRGKRZSA-N 336.348 1.736 5 50 EDBA CC(=O)c1cc(N2CCC(CS(N)(=O)=O)CC2)ccc1[N+](=O)[O-] 241965532 UTNIFWUHZYPPKO-UHFFFAOYSA-N 341.389 1.302 5 50 EDBA CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 242339321 ZGWBUAYJODRIFQ-QJPTWQEYSA-N 327.381 1.415 5 50 EDBA Cc1cc(O)nc(N2CC[C@H](Nc3nccc(C)c3[N+](=O)[O-])C2)n1 952881077 DVQCELXTTHQVKN-NSHDSACASA-N 330.348 1.793 5 50 EDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)[C@@H](O)c1ccccc1 408517544 KFXIJBCFJSVRMG-MLGOLLRUSA-N 332.360 1.762 5 50 EDBA COc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2[C@H]3C(=O)O[C@@H]4C[C@H]2C[C@H]34)c1 4811005 ALRXWJUBPONYSE-XAAVYOCOSA-N 332.312 1.740 5 50 EDBA O=C(Nc1ccc(O)nn1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 187429938 GQTADWYFQKRZAT-UHFFFAOYSA-N 329.316 1.943 5 50 EDBA O=c1[nH]c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2[nH]1 4756956 ZRRPZMKDULFLGP-UHFFFAOYSA-N 334.313 1.565 5 50 EDBA Cc1nn(CCC(=O)N(C)Cc2c(C)nn(C)c2C)cc1[N+](=O)[O-] 2779262 KRHNIWYCTPZEON-UHFFFAOYSA-N 334.380 1.499 5 50 EDBA O=C1c2ccccc2C(=O)N1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 286231 UMWSAWTUFDWHCY-UHFFFAOYSA-N 337.247 1.402 5 50 EDBA CN(C[C@@H]1CCCN1c1cccnn1)C(=O)c1ccc([N+](=O)[O-])n1C 346503884 HUYIGOLTTGANMR-LBPRGKRZSA-N 344.375 1.464 5 50 EDBA Cc1nc(N(C)CCN(C)C(=O)CCc2ncc[nH]2)ccc1[N+](=O)[O-] 1105394951 XUDQKNKHVNFDCN-UHFFFAOYSA-N 346.391 1.549 5 50 EDBA COc1cc(C(=O)N[C@@H]2CCN3CCCC[C@@H]23)c([N+](=O)[O-])cc1OC 229605227 JVXGYENOXAKMBE-OLZOCXBDSA-N 349.387 1.969 5 50 EDBA Cn1cc([N+](=O)[O-])c(-c2nc(-c3cc([N+](=O)[O-])ccc3N)no2)n1 253419575 PTPGNOUHQTVGFR-UHFFFAOYSA-N 331.248 1.536 5 50 EDBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC1(n2cccn2)CC1 952995682 VFZMZZRKYRLLDX-UHFFFAOYSA-N 336.373 1.567 5 50 EDBA C[C@H]1CCCC[C@@]1(CN)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 170683116 LMARCVWKEFMMAB-FZMZJTMJSA-N 327.406 1.781 5 50 EDBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCOCC2)C[C@@H](C)N1 4599822 SXEODHPFMLTBQZ-CHWSQXEVSA-N 348.403 1.254 5 50 EDBA C[C@H]1C(=O)NCCN1Cc1ccc(Br)c([N+](=O)[O-])c1 123015348 BEFPSMPBBSVPSH-QMMMGPOBSA-N 328.166 1.678 5 50 EDBA CO[C@H]1C[C@H](CC(=O)O)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 262890419 CICHINUZFPNOKL-KGLIPLIRSA-N 336.344 1.618 5 50 EDBA COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C 2779482 XYXYDSXHWSNXON-LLVKDONJSA-N 325.277 1.430 5 50 EDBA O=C(NC[C@H]1CCCO1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4839878 HZLKPRWQDICMMD-CYBMUJFWSA-N 335.360 1.340 5 50 EDBA CNC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 4977047 SOYBVCLGRSIEID-UHFFFAOYSA-N 349.368 1.536 5 50 EDBA O=[N+]([O-])c1ccc(N2CC(O)(c3cc[nH]n3)C2)c(Br)c1 1775987096 IAZDJYHEJJEMMF-UHFFFAOYSA-N 339.149 1.788 5 50 EDBA COC(=O)[C@H](C)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 412536859 DRYFOSRVNGDTEA-SNVBAGLBSA-N 332.316 1.707 5 50 EDBA O=C([C@H]1CCCCN1c1ncc([N+](=O)[O-])s1)N1CCOCC1 192475430 IEXMYIYIWLOAAW-SNVBAGLBSA-N 326.378 1.269 5 50 EDBA O=C(O)c1ccccc1NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 3884727 KJEWEPKDQIOROF-UHFFFAOYSA-N 338.297 1.799 5 50 EDBA in-vitro CCOC(=O)C1=C(C)NC2=C(C(=O)OC2)[C@H]1c1cccc([N+](=O)[O-])c1 19800344 ZYQOLGCHSLBXFG-AWEZNQCLSA-N 344.323 1.930 5 50 EDBA O=C(c1ccc2nc3ccc(Cl)cc3c(=O)n2c1)N1CCOCC1 425581 VIURMXCKGJBPOY-UHFFFAOYSA-N 343.770 1.974 5 50 EDBA CCc1ccc(C(=O)N[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(N)=O)cc1[N+](=O)[O-] 252679223 JQCBCSGOJOVEEZ-UOVKNHIHSA-N 331.372 1.787 5 50 EDBA CCCn1nccc1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 242305052 YUIQVBOFKTXXHT-UHFFFAOYSA-N 332.364 1.944 5 50 EDBA O=C(Nc1ccc(O)c([N+](=O)[O-])c1)C1CCN(c2cnccn2)CC1 183897961 ZPXYIBKHQSTFFG-UHFFFAOYSA-N 343.343 1.946 5 50 EDBA COc1cc(C(=O)N[C@H]2C[C@@H](Cn3cncn3)C2)cc([N+](=O)[O-])c1C 1776004028 LGKUHNTWOYSCIE-BJHJDKERSA-N 345.359 1.712 5 50 EDBA O=[N+]([O-])c1cc(Cl)c(N2CCOCC2)cc1N1CCOCC1 4299871 TYTDPCGMZUDVFZ-UHFFFAOYSA-N 327.768 1.921 5 50 EDBA O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccn2ccnc2c1 178069855 BZAVMWGUFJYOIV-UHFFFAOYSA-N 326.312 1.938 5 50 EDBA CCc1nc(CN2C(=O)N[C@@H](Cc3ccc([N+](=O)[O-])cc3)C2=O)no1 1775990465 MGYFAEWTJZFPCQ-NSHDSACASA-N 345.315 1.203 5 50 EDBA CCOC(=O)C1(O)CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 253415537 SQBHLQZRLIKJNY-UHFFFAOYSA-N 336.344 1.692 5 50 EDBA Cc1cc(NC(=O)C2CCN(c3c([N+](=O)[O-])c(C)nn3C)CC2)no1 253420142 ZLZZKIHWIYSDNG-UHFFFAOYSA-N 348.363 1.788 5 50 EDBA O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2ncccn2)CC1 2872618 VFBWYBPECZFPNZ-UHFFFAOYSA-N 327.344 1.276 5 50 EDBA NCCOc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 170620905 KAAJBCPSIYSFHB-UHFFFAOYSA-N 337.357 1.733 5 50 EDBA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c([N+](=O)[O-])c1 175436 OVGBZCYMWGVRKQ-CYBMUJFWSA-N 335.316 1.794 5 50 EDBA NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc(C(N)=O)c1 2485702 WWDFSVOVQDFEDC-UHFFFAOYSA-N 328.284 1.045 5 50 EDBA CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC[C@@H]3CCCO3)c2)CC1 4703599 FLCGNEGNDKWJOF-HNNXBMFYSA-N 348.403 1.854 5 50 EDBA Cc1cc([N+](=O)[O-])nn1CC(=O)NCCc1nc2ccccc2[nH]1 4625989 NTRJTFKIUFXGAB-UHFFFAOYSA-N 328.332 1.335 5 50 EDBA COC(=O)c1ccnc(N2CC[C@H](c3ncccn3)C2)c1[N+](=O)[O-] 952876837 GDJQIIZTBJKYFP-JTQLQIEISA-N 329.316 1.560 5 50 EDBA Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)N1CCOCC1 2884814 BSQLZEIOGKIFPN-MRVPVSSYSA-N 347.169 1.282 5 50 EDBA Nc1nnc(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 354849128 XKCPIQOTZOSCMD-UHFFFAOYSA-N 331.210 1.509 5 50 EDBA O=C(Nc1ccccc1)N[C@@H](CO)[C@H](O)c1cccc([N+](=O)[O-])c1 25668061 NQHNSKIUPNZUCN-LSDHHAIUSA-N 331.328 1.811 5 50 EDBA Cc1cc(N2C[C@@H]3OCCN(C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2n1 253369763 HYENLCWJSNXJAY-IRXDYDNUSA-N 328.372 1.971 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2C[C@@H]3CC[C@H](C2)N3)cc1 725375259 TZNUEKBJUANYOL-ZSBIGDGJSA-N 325.390 1.404 5 50 EDBA O=[N+]([O-])c1ccccc1CN1CCC(N2CCN(CCO)CC2)CC1 4703462 AVBSRQKFYQUYQC-UHFFFAOYSA-N 348.447 1.169 5 50 EDBA O=C(NCc1ccccc1CN1CCCC1)c1n[nH]cc1[N+](=O)[O-] 170057726 CWTRSAGMPBGSKB-UHFFFAOYSA-N 329.360 1.844 5 50 EDBA Cc1c(C(=O)NC2(CO)CC2)cc(Br)cc1[N+](=O)[O-] 170597140 YMDPJTIZYBSBDM-UHFFFAOYSA-N 329.150 1.920 5 50 EDBA CCO[C@@H]1C[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@@]12CCCO2 274152697 GEBURAKTCVBOGW-VBQJREDUSA-N 349.387 1.942 5 50 EDBA O=C(NCc1ccc(F)cc1)c1nc(Cn2cc([N+](=O)[O-])cn2)no1 4744675 GOJJBHRYFDFWLS-UHFFFAOYSA-N 346.278 1.292 5 50 EDBA CCC[C@]1(C(=O)OCC)CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 278146216 AYUDECSXAMJYGA-OAHLLOKOSA-N 338.364 1.516 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCC([C@H](O)c2ncc[nH]2)CC1 225459918 PQTNWVFYHLYYMB-ZDUSSCGKSA-N 334.380 1.793 5 50 EDBA CS[C@@H](CO)[C@@H](C)NS(=O)(=O)c1cc(C)c(C)c([N+](=O)[O-])c1 318722708 SGURYGWFQXLCMJ-MFKMUULPSA-N 348.446 1.602 5 50 EDBA CCCN(CCC)c1c([N+](=O)[O-])cc(S(N)(=O)=O)cc1[N+](=O)[O-] 5733096 UNAHYJYOSSSJHH-UHFFFAOYSA-N 346.365 1.777 5 50 EDBA biogenic,in-vitro CN1CCn2c(CNc3ccc(Cl)cc3[N+](=O)[O-])nnc2C1=O 1119249423 YYCKPFZGIZCQCF-UHFFFAOYSA-N 336.739 1.537 5 50 EDBA O=C(O)CCOCCOCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 79016551 ZZALENBFHFRJPM-UHFFFAOYSA-N 343.292 1.423 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(C2CCCC2)CC1 54991726 QFVDNQQIDAKMHJ-UHFFFAOYSA-N 339.417 1.844 5 50 EDBA NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1CC(=O)Nc1ccc([N+](=O)[O-])cc1 242038552 VMBHBANHSUWHLA-DFBGVHRSSA-N 346.387 1.652 5 50 EDBA O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(Cc2ccccc2F)CC1 20028660 KUAKVQGJRWTQSH-UHFFFAOYSA-N 333.323 1.415 5 50 EDBA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1C[C@H](O)c1ccc([N+](=O)[O-])cc1 238899458 GLPVABDMHWQFSD-XSXPHNMFSA-N 328.324 1.435 5 50 EDBA C[C@@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1 186979219 FYAYATUMTHOQTH-YPMHNXCESA-N 335.360 1.476 5 50 EDBA COc1ccc(C(=O)NC(=S)NCc2cccnc2)cc1[N+](=O)[O-] 452732 HMSMCIIZHWWZTF-UHFFFAOYSA-N 346.368 1.803 5 50 EDBA CNC(=O)c1ccn([C@H]2CCCN(c3c([N+](=O)[O-])c(C)nn3C)C2)n1 239654528 BOENRFXXIAKQAU-NSHDSACASA-N 347.379 1.034 5 50 EDBA CS(=O)(=O)N1CCC(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 6850046 APXSSIJARMHGPN-UHFFFAOYSA-N 327.362 1.205 5 50 EDBA Cc1cc(C(=O)N2CCN(c3cc(C)[nH]n3)CC2)c(N)c([N+](=O)[O-])c1 170603173 PEHUPTRNMXFFSA-UHFFFAOYSA-N 344.375 1.479 5 50 EDBA O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1CC(c2cccnc2)=NO1 170611073 QBTRHGNNHRFUKQ-OAHLLOKOSA-N 326.312 1.799 5 50 EDBA COc1ccc([N+](=O)[O-])c(NC(=O)[C@@H]2[C@H]3C[C@H]4OC(=O)[C@@H]2[C@H]4C3)c1 35826293 ALRXWJUBPONYSE-KFSYXBJXSA-N 332.312 1.740 5 50 EDBA C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1O 249262850 IFWDOHONBGLFSX-IINYFYTJSA-N 325.340 1.765 5 50 EDBA C[C@@]1(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCO[C@H]1C1CC1 282443902 GWBOSLDCWDGPKC-UONOGXRCSA-N 326.374 1.831 5 50 EDBA Cc1nc(NC(=O)Cc2ccc3c(c2)NC(=O)C3)ccc1[N+](=O)[O-] 183049867 GTNWXQUDALZNLF-UHFFFAOYSA-N 326.312 1.974 5 50 EDBA Cc1cc([N+](=O)[O-])nn1Cc1nn2c(-c3ccco3)nnc2s1 20606307 WIADUPDTPITGMX-UHFFFAOYSA-N 331.317 1.907 5 50 EDBA CC(C)C[C@@H](CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-])C(=O)O 321750285 QOAYEMLYKQAVNR-VIFPVBQESA-N 345.377 1.401 5 50 EDBA CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)Cc1cccc(C(N)=O)c1 918183972 YKCDDHWSEMOJKV-UHFFFAOYSA-N 342.355 1.690 5 50 EDBA CCCc1cc(=O)n2nc(NCc3cccc([N+](=O)[O-])c3)nc2[nH]1 100274043 RGQNWRHEQGTXGW-UHFFFAOYSA-N 328.332 1.890 5 50 EDBA COC[C@]1(C(=O)O)CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)C1 262918168 FYXONGBJXQUWBL-HNNXBMFYSA-N 348.315 1.034 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1C(=O)NCCN1CCN(C)C(C)(C)C1 281868621 WCGMBYYISCGDOU-UHFFFAOYSA-N 334.420 1.659 5 50 EDBA CSc1nc2c(c(=O)[nH]1)[C@H](c1ccccc1[N+](=O)[O-])CC(=O)N2 111968583 PGUXGNSDARXUCJ-QMMMGPOBSA-N 332.341 1.874 5 50 EDBA Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)N1N=CC[C@]1(O)C(F)(F)F 6922251 QJDROAJWPSQIJG-HQJQHLMTSA-N 349.269 1.205 5 50 EDBA Brc1ccc(OC[C@H]2C[N+]34CCO[B-]3(OCC4)O2)cc1 169794810 OSJNPTYVZKBLMW-VQCLRJIVSA-N 341.998 1.540 5 50 EDBA Cc1cc(=O)n(C)c(=O)n1CC[N+](C)(C)Cc1ccc([N+](=O)[O-])cc1 2383785 VLXXARMXZBUHMW-UHFFFAOYSA-N 347.395 1.040 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC(=O)N(C2CC2)C1 281940439 LINUBHURVMYPAT-JTQLQIEISA-N 348.359 1.878 5 50 EDBA CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](O)C(F)(F)F 270801878 JVOLXBHYOGKGHI-NXEZZACHSA-N 342.295 1.575 5 50 EDBA CCOC(=O)c1ccnc(NCCN2CCN=C2CC)c1[N+](=O)[O-] 1775993903 XCXGYBLWTCIKFD-UHFFFAOYSA-N 335.364 1.703 5 50 EDBA O=C1C[C@H](c2cccc([N+](=O)[O-])c2)c2c(O)nc3ncnn3c2N1 4625363 KMBPBQOKEPOJIN-SECBINFHSA-N 326.272 1.212 5 50 EDBA O=c1[nH]n2cc(-c3n[nH]cc3[N+](=O)[O-])cnc2c1Br 4343613 GPUSMPJXAIFKFV-UHFFFAOYSA-N 325.082 1.083 5 50 EDBA C[C@H]1CCSCCN1c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 170611259 AVVIUWQIKNXNCW-VIFPVBQESA-N 331.419 1.574 5 50 EDBA COC1(C)CN(c2c(I)cncc2[N+](=O)[O-])C1 418907500 XFRLQQUOYVRYLJ-UHFFFAOYSA-N 349.128 1.820 5 50 EDBA O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@H](c3ccc(F)cc3)C2)c1 229941208 QQJLDKHPSKQTTN-CZUORRHYSA-N 334.351 1.781 5 50 EDBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(N)=O)CCC3)n1 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336.344 1.696 5 50 EDBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC(O)(C(F)(F)F)CC1 165007780 RJTNIZNAUWJCJC-UHFFFAOYSA-N 334.250 1.830 5 50 EDBA CC1(C)CN(c2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])CCN1 842314479 YKTATYBLAXAEGI-UHFFFAOYSA-N 349.359 1.779 5 50 EDBA O=C(O)CSCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 17071085 PXOWMCBIPYZGNU-UHFFFAOYSA-N 339.373 1.061 5 50 EDBA C[C@@H](CCNc1c[n+]([O-])ccc1[N+](=O)[O-])NC(=O)OC(C)(C)C 408521959 AVNMZSIATCVXQT-JTQLQIEISA-N 326.353 1.943 5 50 EDBA CC(=O)c1ccc(N2CCN(c3ncnc(N)c3[N+](=O)[O-])CC2)cc1 3912682 HAXTWDFBHWZASM-UHFFFAOYSA-N 342.359 1.496 5 50 EDBA COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](C)N[C@@H](C)C1 3877915 MRIHNUXPGVKEED-QWRGUYRKSA-N 336.392 1.492 5 50 EDBA CC1CCN(c2cc3c(cc2[N+](=O)[O-])n(C)c(=O)c(=O)n3C)CC1 4865758 FBNJTBQEMAWQPC-UHFFFAOYSA-N 332.360 1.382 5 50 EDBA CC(C)(C)OC(=O)C[C@H](NSc1ncccc1[N+](=O)[O-])C(=O)O 28631473 VTEWXTHQMTVUOZ-QMMMGPOBSA-N 343.361 1.772 5 50 EDBA Cc1nn(Cc2nn3c(C(F)(F)F)nnc3s2)c(C)c1[N+](=O)[O-] 20606298 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O=[N+]([O-])c1cc2cn[nH]c2cc1NCC1(OCCO)CCOCC1 1775987088 XRDWQQHAWRZEPS-UHFFFAOYSA-N 336.348 1.441 5 50 EDBA CC1([C@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)CCO2)N=N1 1775998894 KDXKLOPPMDNLFT-LLVKDONJSA-N 330.304 1.494 5 50 EDBA CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H](N2CC=CC2)C1 170604928 JRUJILOYUASCLR-ZDUSSCGKSA-N 337.401 1.449 5 50 EDBA CCNC(=O)c1cc2c(=O)n3ccccc3nc2n(C(C)C)c1=N 100298683 RPLPLFJBAZSZES-UHFFFAOYSA-N 325.372 1.459 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 100744281 JMCRGLJKBSCDIB-LBLXLQPISA-N 344.323 1.917 5 50 EDBA Cc1nn(C)c(C(=O)N[C@]2(C(=O)O)CC23CCCCC3)c1[N+](=O)[O-] 2325826770 MGOMFGQAJSAYAQ-HNNXBMFYSA-N 336.348 1.544 5 50 EDBA CCC[C@@H](O)[C@H](CO)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 416991568 QPUSSJSLKMKSKO-CMPLNLGQSA-N 327.337 1.247 5 50 EDBA C[C@H](CC(=O)O)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 17070590 WWUFESNLDATWJB-LBPRGKRZSA-N 335.360 1.744 5 50 EDBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C(C(F)F)C[C@]1(O)C(F)F 17072502 OQOPZEAKKYUGKK-ZDUSSCGKSA-N 349.240 1.944 5 50 EDBA CCN1CCN(c2cc(N3CCOCC3)c([N+](=O)[O-])cc2F)CC1 4168625 WDQLWXRGHBMZLM-UHFFFAOYSA-N 338.383 1.712 5 50 EDBA O=[N+]([O-])c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 4459136 OBTPFOUBXZXIQB-UHFFFAOYSA-N 336.325 1.802 5 50 EDBA COC(=O)c1cc(Nc2ncnc(N)c2[N+](=O)[O-])cc(C(=O)OC)c1 3912603 VRZQSUJWBZTRAO-UHFFFAOYSA-N 347.287 1.284 5 50 EDBA COc1cccc([C@@H]2CCCN2C(=O)Cn2ncc([N+](=O)[O-])c2N)c1 127545727 HLOCXVUIRSCFSM-ZDUSSCGKSA-N 345.359 1.746 5 50 EDBA O=C(N[C@@H]1CCCN(c2cccnn2)C1)c1ccc(O)c([N+](=O)[O-])c1 164677076 DDDCANYMWOCMPM-GFCCVEGCSA-N 343.343 1.489 5 50 EDBA CC1(C)CCN(CCOc2ccc([N+](=O)[O-])cc2)CCS1(=O)=O 194957239 NUNDYYJMIMZGJN-UHFFFAOYSA-N 342.417 1.873 5 50 EDBA Cc1nnc(SCC(=O)NC(=O)c2cccc([N+](=O)[O-])c2)s1 848949194 KIDYRMZEXONMCN-UHFFFAOYSA-N 338.370 1.803 5 50 EDBA O=C(O)c1ccc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])cc1O 2978814 DHBCHJPJSITNEZ-UHFFFAOYSA-N 346.251 1.949 5 50 EDBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H]3C=C[C@@](C)(O3)[C@@H]2C1=O 101358158 ZIJPMAAJMQFPFS-YGSHXTJESA-N 330.296 1.436 5 50 EDBA NC(=O)c1cc([N+](=O)[O-])cnc1N1CCO[C@@H](c2ccccc2)C1 253424796 GLLCSBRQLZREML-CQSZACIVSA-N 328.328 1.667 5 50 EDBA O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCC[C@H](c2nnc3ccccn23)C1 253420795 JYNHIZUVOPCYHM-JTQLQIEISA-N 341.331 1.380 5 50 EDBA O=C(CCN1CCn2cnnc2C1)Nc1cc([N+](=O)[O-])ccc1F 128547677 OQKZWPIUHUMBLB-UHFFFAOYSA-N 334.311 1.170 5 50 EDBA C[C@@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC(C)(C)C 408520024 MJHMBYMVYFZXTA-JTQLQIEISA-N 326.353 1.228 5 50 EDBA Cc1cc(N2CCN(c3c([N+](=O)[O-])ccc4c3CCN4)CC2)n[nH]1 225516279 QNGRUEMXYZNLTP-UHFFFAOYSA-N 328.376 1.921 5 50 EDBA COc1ccccc1-n1ccc2nc3ccn(N)c(=O)c3cc2c1=O 40398601 FHVXDDFZOABIEC-UHFFFAOYSA-N 334.335 1.423 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccn(Cc2ccccc2F)n1 2739349 GWEWMTQAYMBKQS-UHFFFAOYSA-N 344.306 1.814 5 50 EDBA COC(=O)c1cc(C[N+](C)(C)C[C@H](O)CO)c(Cl)cc1Cl 305673 ZXUNZCCLJPJRQZ-JTQLQIEISA-N 337.223 1.710 5 50 EDBA CCCC(=O)Nc1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 25666783 DDCZCFVOVZREQS-UHFFFAOYSA-N 331.306 1.645 5 50 EDBA COC(=O)C1=C(C)NC(=S)N[C@H]1c1cc([N+](=O)[O-])ccc1OC 311693 FNFQMRPEKSWAET-LBPRGKRZSA-N 337.357 1.569 5 50 EDBA O=C(O)COc1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 455078 BCCLPHNUZKHYIW-UHFFFAOYSA-N 342.263 1.859 5 50 EDBA CN(C)CC1(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CCC1 225577114 KDYSBYBYVQIYAF-UHFFFAOYSA-N 327.406 1.895 5 50 EDBA O=C(NCc1ccccc1F)c1nc(Cn2cc([N+](=O)[O-])cn2)no1 4726678 LUMKGSNCDXLECT-UHFFFAOYSA-N 346.278 1.292 5 50 EDBA O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1n[nH]cc1[N+](=O)[O-] 130845619 MQMGFQYGDOAAGS-LBPRGKRZSA-N 344.249 1.498 5 50 EDBA CC[C@H]1[C@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@H]2[C@@H]5O)[N@+]3(C)[C@@H]1O 252461623 NCFABVDNFAPWSM-GVHWWTKRSA-N 341.475 1.699 5 50 EDBA biogenic Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)NC[C@@H]1CCCO1 197068 KOYYJLVDWOKNKO-QMMMGPOBSA-N 347.169 1.157 5 50 EDBA COCCNS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl 144916740 NSGFRWHHDJBMBL-UHFFFAOYSA-N 329.161 1.826 5 50 EDBA NC(=O)c1noc([C@@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 170617039 QWAYUSFXXAMSEF-JTQLQIEISA-N 346.303 1.446 5 50 EDBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1cccnc1 1069656 MWSRRGVLLXSARG-UHFFFAOYSA-N 340.137 1.896 5 50 EDBA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cn2)cc1 4289742 NYBMWIZKZORODE-UHFFFAOYSA-N 336.329 1.749 5 50 EDBA Cn1cc(CNC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)cn1 2777890 MPSCZVKCRAWEFB-UHFFFAOYSA-N 330.304 1.096 5 50 EDBA Cc1cccc(Cn2[nH]cc/c2=N\C(=O)Cn2cnc([N+](=O)[O-])c2)c1 128199116 LXFIDTIGLWKWHM-XMHGGMMESA-N 340.343 1.405 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)[C@H]2CCCO2)CC1 5041735 OHVKEARREQXGNE-CQSZACIVSA-N 348.359 1.450 5 50 EDBA CC1=NN(C(=O)[C@H](C)n2nc([N+](=O)[O-])cc2C)[C@](O)(C(F)(F)F)C1 6922279 JSNWRVSANOKHDQ-GZMMTYOYSA-N 349.269 1.520 5 50 EDBA CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)c([N+](=O)[O-])c1 35817509 YJOCNPKDGYJHKP-CYBMUJFWSA-N 335.316 1.882 5 50 EDBA CCN(CC)C(=O)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 1893969 XTCDLGZRIBZHIL-UHFFFAOYSA-N 329.378 1.132 5 50 EDBA COCCn1ccnc1[C@@H]1N(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1(C)C 952891054 UOBXDOJGNIIWTI-NSHDSACASA-N 348.363 1.384 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1 38953 QBSBUPQVAFPGBP-UHFFFAOYSA-N 336.325 1.802 5 50 EDBA Cc1ccc2nc3c(cc(C(N)=O)c(=N)n3Cc3ccco3)c(=O)n2c1 100722212 FMVZJNTYDLBWAQ-UHFFFAOYSA-N 349.350 1.177 5 50 EDBA O=[N+]([O-])c1ccc(NCCN2CCCS2(=O)=O)c2ccncc12 141186561 YVHPAEHUTNLUER-UHFFFAOYSA-N 336.373 1.590 5 50 EDBA CCOC(=O)N1CCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 471888 MFKUZUVQIAKGFF-LBPRGKRZSA-N 335.360 1.999 5 50 EDBA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 2844016 KGRYPXNHBWXIGQ-LLVKDONJSA-N 342.373 1.559 5 50 EDBA COCCN(Cc1ccc(C)o1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 120521395 HPNDGBYPGFQRJZ-UHFFFAOYSA-N 349.343 1.333 5 50 EDBA CCOc1cc(NC(=O)N[C@H]2CC[C@@H](O)[C@@H](O)C2)ccc1[N+](=O)[O-] 1673210859 GKNDTWPCDSZMLQ-BIMULSAOSA-N 339.348 1.389 5 50 EDBA COc1cc(NCCNC(=O)c2c([N+](=O)[O-])cnn2C)cc(OC)c1 347415580 SSTOQHYEFLNYBZ-UHFFFAOYSA-N 349.347 1.187 5 50 EDBA NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC(=O)Nc1ccc([N+](=O)[O-])cc1 229790081 VMBHBANHSUWHLA-CQDKDKBSSA-N 346.387 1.652 5 50 EDBA CCC(=O)/N=c1\sc([N+](=O)[O-])cn1CC(=O)N1CCCCC1 71767327 FWYFWRXUUFLPPF-YPKPFQOOSA-N 326.378 1.308 5 50 EDBA O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCC2(CCNCC2)CC1 323706962 HLGRWEWLROAMGH-UHFFFAOYSA-N 339.417 1.749 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccco2)CC1 441175 KWNSGORLQHWOJE-UHFFFAOYSA-N 329.312 1.786 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1[C@@H]1NC(=O)NC(C)=C1C(=O)OC 458154 PEGYMMDWYIZIBN-ZDUSSCGKSA-N 335.316 1.794 5 50 EDBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N(Cc1ccccc1)[C@H]1CN2CCC1CC2 247368375 GNCJUJRHRTWKAO-ZACQAIPSSA-N 329.400 1.775 5 50 EDBA Cn1nccc1COCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl 341679399 VYZVLVASMKJNKU-UHFFFAOYSA-N 338.751 1.815 5 50 EDBA COC(=O)c1cc(C)nc(N2CC[C@@H](c3ncccn3)C2)c1[N+](=O)[O-] 1307215374 HLJHIMYFIBRSNM-LLVKDONJSA-N 343.343 1.869 5 50 EDBA CNC(=O)c1cc2c(=O)n3ccccc3nc2n(Cc2ccco2)c1=N 100627234 FHWXFPHSDALWSY-UHFFFAOYSA-N 349.350 1.130 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCNC[C@@H]2C)c1[N+](=O)[O-] 262745884 DQUOASRIPFJTKC-RYUDHWBXSA-N 327.406 1.488 5 50 EDBA CS(=O)(=O)NC(=O)CCNc1ccc([N+](=O)[O-])c2cccnc12 170091041 XNXOJEPJVWCJQH-UHFFFAOYSA-N 338.345 1.021 5 50 EDBA CC1=NN(C(=O)[C@@H](C)n2nc([N+](=O)[O-])cc2C)[C@](O)(C(F)F)C1 6922286 JWTBURMIOYXIOA-PRHODGIISA-N 331.279 1.223 5 50 EDBA CN1C(=O)CCc2cc(Nc3ncc([N+](=O)[O-])cc3C(N)=O)ccc21 171564723 ZGWOQKFVDQLVOJ-UHFFFAOYSA-N 341.327 1.741 5 50 EDBA Cc1cc(NC(=O)Cn2nc([N+](=O)[O-])c(Br)c2C)no1 1067651 ZROXUYBHGMNQTO-UHFFFAOYSA-N 344.125 1.797 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cn1 195427422 APUVQRJYKYLPDE-VNQPRFMTSA-N 345.380 1.997 5 50 EDBA C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCCO1 1054839 PYPKJEBAJJXXHF-RNCFNFMXSA-N 332.312 1.999 5 50 EDBA O=[N+]([O-])c1ccc(NCCO)c(NCc2nnc3n2CCCC3)c1 253426655 ICMAVDGSPDMVFR-UHFFFAOYSA-N 332.364 1.539 5 50 EDBA C[C@H]1C[C@H](CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1 271268059 MVJIVEURCFPBLF-WCQYABFASA-N 328.390 1.829 5 50 EDBA CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 1698820 HUYDNMDXUKPVQA-UHFFFAOYSA-N 327.343 1.843 5 50 EDBA O=[N+]([O-])c1cc(CN2CCN(CCOCCO)CC2)ccc1Cl 6667435 MIGXKFJSLCEILK-UHFFFAOYSA-N 343.811 1.375 5 50 EDBA CC1(C)[C@]2(C)CC[C@@]1(C(=O)O[C@H]1CCCN/C1=C/[N+](=O)[O-])OC2=O 5465290 UUETUZDEZSKSSA-DXQURIOQSA-N 338.360 1.522 5 50 EDBA CCn1cnnc1CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 320120607 BGXQQQQATRCPMS-UHFFFAOYSA-N 345.768 1.338 5 50 EDBA Cc1cc(S(=O)(=O)Nc2ccc3[nH]nnc3c2)ccc1[N+](=O)[O-] 177828481 IBVIKCHSJZIHHZ-UHFFFAOYSA-N 333.329 1.975 5 50 EDBA COC(=O)c1cnoc1Cn1c(-c2ccc([N+](=O)[O-])cc2)noc1=O 408516354 MNWKJBLGDLMZEV-UHFFFAOYSA-N 346.255 1.234 5 50 EDBA CCCc1[nH]nc(C(=O)NCc2ccc(C(=O)OC)cn2)c1[N+](=O)[O-] 328589844 KCVABFPHMIYYDP-UHFFFAOYSA-N 347.331 1.382 5 50 EDBA O=C(NCc1cccc(N2CCOCC2)n1)c1ccc([N+](=O)[O-])s1 274728773 DLMJNRDSTBFUSO-UHFFFAOYSA-N 348.384 1.818 5 50 EDBA CC(C)NC(=O)CN1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 225387354 NOMYZXICFJSBSI-UHFFFAOYSA-N 340.811 1.895 5 50 EDBA CC(C)(C)OC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 266209228 FSQXTWPARQTOAB-UHFFFAOYSA-N 345.377 1.386 5 50 EDBA CCN(CC)CCCNC(=O)Cn1nc([N+](=O)[O-])c(Cl)c1C 3108907 FCWJBZQCSUOBTP-UHFFFAOYSA-N 331.804 1.601 5 50 EDBA CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1[N+](=O)[O-] 100302013 IEDAQDFPNMCNHG-CHPZLBCBSA-N 342.307 1.832 5 50 EDBA O=c1[nH]cnc2c1CN(c1ccc([N+](=O)[O-])c(OC(F)F)c1)CC2 170685838 OKASCQMOXFIKPG-UHFFFAOYSA-N 338.270 1.842 5 50 EDBA CC1(c2nnc(-c3cccc(F)c3)o2)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 952892283 NIGYSVMIKMJULV-VXGBXAGGSA-N 346.318 1.641 5 50 EDBA CNc1ccc(C(=O)N(C)[C@]2(C)CCS(=O)(=O)C2)cc1[N+](=O)[O-] 4759681 FOSDADLFRZKLEQ-CQSZACIVSA-N 341.389 1.286 5 50 EDBA Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1CCN(C)C1 416493836 GOZKGUNVIIIMPT-GFCCVEGCSA-N 327.406 1.442 5 50 EDBA Cc1nn([C@@H](C)c2nc3c4cnn(C)c4ncn3n2)cc1[N+](=O)[O-] 2802660 PLDKCBNJJKQUQJ-QMMMGPOBSA-N 327.308 1.033 5 50 EDBA O=[N+]([O-])c1ccc(CCS(=O)(=O)N2CCCc3n[nH]cc32)cc1 225389759 XJUZWBXZKWCMPR-UHFFFAOYSA-N 336.373 1.643 5 50 EDBA NC(=O)CN1CCCN(c2ccnc3c([N+](=O)[O-])cccc23)CC1 1330290318 RXWTYVFQMIODKO-UHFFFAOYSA-N 329.360 1.140 5 50 EDBA CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)n2nnnc2N1 4820555 NAAZHTPKBUSDCX-CYBMUJFWSA-N 344.331 1.822 5 50 EDBA CC(C)NC(=O)CN1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 170613097 GZDBLLBWOSVEIT-UHFFFAOYSA-N 346.391 1.118 5 50 EDBA CC[C@@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@@]45C[C@@H]([C@H]2[C@@H]5O)[N@@+]3(C)[C@@H]1O 1772493023 NCFABVDNFAPWSM-MMHQUPMWSA-N 341.475 1.699 5 50 EDBA O=[N+]([O-])c1cnn(CCN2CCO[C@@]3(CCc4ccccc43)C2)c1 170052761 ZTKUEMWQNGIWBW-KRWDZBQOSA-N 328.372 1.965 5 50 EDBA Cc1nc(NCc2nnc3ccc(N(C)C)nn23)ccc1[N+](=O)[O-] 1262210323 SICMDYGOXDYGJH-UHFFFAOYSA-N 328.336 1.414 5 50 EDBA CC[C@H]1[C@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]45C[C@@H]([C@@H]2[C@@H]5O)[N@+]3(C)[C@@H]1O 252461625 NCFABVDNFAPWSM-PIQOSXTISA-N 341.475 1.699 5 50 EDBA biogenic COC(=O)C[C@H]1SC(=O)N(CNc2ccc([N+](=O)[O-])cc2)C1=O 3904151 JBPITLXHUZTIIP-SNVBAGLBSA-N 339.329 1.591 5 50 EDBA C[C@H]1CN([C@@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)C[C@@H](C)O1 15230635 GETWLWUJAFSOBZ-UHIISALHSA-N 333.344 1.336 5 50 EDBA CC(=O)[C@H]1[C@H](c2ccc([N+](=O)[O-])cc2)[C@H](C(C)=O)C(=O)C[C@]1(C)O 33921898 BETKGCRBPSJYRL-NCOADZHNSA-N 333.340 1.813 5 50 EDBA O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 1455722701 WBZCCXIPBOBMOQ-UWVGGRQHSA-N 330.300 1.831 5 50 EDBA CN(c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[C@@H]1CCN(C2CC2)C1 354079482 HVCNOHUGHSLJCM-GFCCVEGCSA-N 339.417 1.671 5 50 EDBA Cc1c(F)cc(S(=O)(=O)N(C)[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] 170598917 LHPAIMILFCLDHF-LLVKDONJSA-N 345.396 1.757 5 50 EDBA O=[N+]([O-])c1ccc(CN2CCC(N3CCN(CCO)CC3)CC2)cc1 316678 MWVHMMRIEBETGI-UHFFFAOYSA-N 348.447 1.169 5 50 EDBA Cc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1C(N)=O 458671 LHUQRYYQVIHZCF-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA O=C(NCCc1ccccc1)c1nc(Cn2ccc([N+](=O)[O-])n2)no1 4727252 NIOAOQSNWTWCPC-UHFFFAOYSA-N 342.315 1.195 5 50 EDBA Cc1nn(C)c(N2CC[C@@H](Oc3cccnc3N(C)C)C2)c1[N+](=O)[O-] 241466192 NVJZWWBDWDVKHC-GFCCVEGCSA-N 346.391 1.755 5 50 EDBA COc1cc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc(OC)c1OC 15658902 LMTRFPOGEMWVGE-SNAWJCMRSA-N 349.299 1.580 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)CCN2C[C@@H]3C[C@H]2CS3)cc1 328597844 IZSVEXAGDBNNMQ-RYUDHWBXSA-N 328.415 1.558 5 50 EDBA NCCN(Cc1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 191928377 MIRCDQKUMHLKQI-UHFFFAOYSA-N 335.385 1.744 5 50 EDBA Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1C[C@H](O)C(C)(C)C1 408453356 UAOZZTUAVWKSHF-LBPRGKRZSA-N 328.390 1.603 5 50 EDBA O=C(NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1CCCCO1 850889205 URLNQTLISLSDGL-SNVBAGLBSA-N 332.309 1.108 5 50 EDBA CCCc1[nH]nc(C(=O)NC[C@@H](C)Cn2ccnc2C)c1[N+](=O)[O-] 171804069 CHBYKZQQFLLTHV-SNVBAGLBSA-N 334.380 1.841 5 50 EDBA Cc1c([N+](=O)[O-])ccc(S(=O)(=O)N2CCC(C(N)=O)CC2)c1C 528253 LYACPZTYSPRTPX-UHFFFAOYSA-N 341.389 1.098 5 50 EDBA O=C(CCCn1cc([N+](=O)[O-])cn1)NCc1ccc2c(c1)OCO2 4743131 CEAHXGHGRRKOQL-UHFFFAOYSA-N 332.316 1.617 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCS(=O)(=O)[C@H](C)[C@@H]1C 121364007 SPSSEVDWYHYTSW-WDEREUQCSA-N 326.374 1.551 5 50 EDBA C[C@@](CO)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 612074405 SJBXQPXHYKKQHU-QAPCUYQASA-N 346.383 1.832 5 50 EDBA CCOc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)N=C(N)S1 4305927 FSWQGIYMGJYJSG-JTQLQIEISA-N 338.345 1.279 5 50 EDBA CC(C)c1cc(C(N)=O)c(NC(=O)c2c([N+](=O)[O-])cnn2C)s1 2787601 WPRXWRWFGQGJFD-UHFFFAOYSA-N 337.361 1.864 5 50 EDBA COC[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CCO1 408518396 FORUYUZSHUCZIN-SECBINFHSA-N 344.751 1.886 5 50 EDBA COc1cc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cc(OC)c1OC 37116 ZQRRQKWXQTWPHB-UHFFFAOYSA-N 336.304 1.606 5 50 EDBA O=C(NCCCn1ccnc1)c1cc2cc([N+](=O)[O-])ccc2oc1=O 2710662 GSKFDVGQBQALSD-UHFFFAOYSA-N 342.311 1.718 5 50 EDBA CCCC(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4706760 FVKYDVOXMWMSIC-UHFFFAOYSA-N 336.417 1.918 5 50 EDBA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(CO)O2)cc1[N+](=O)[O-] 222238505 QLPXEIOCBJDFQX-IXKJSCDLSA-N 344.323 1.099 5 50 EDBA C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C(=O)OC(C)(C)C 408521360 QPMSDDYWOUUOMX-ZYHUDNBSSA-N 338.364 1.228 5 50 EDBA CC[C@H](NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)O 225483280 IPLVXDXEPSLYOU-NSHDSACASA-N 337.332 1.024 5 50 EDBA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 4278844 LCIZKAKLWFRKTH-NSHDSACASA-N 342.373 1.559 5 50 EDBA O=[N+]([O-])c1cc2c(cc1CN1CCN(c3ncccn3)CC1)OCO2 22591352 MSVAWEDXLALARA-UHFFFAOYSA-N 343.343 1.436 5 50 EDBA Cc1nn(CC(=O)NCc2ccc(C(=O)O)cc2)c(C)c1[N+](=O)[O-] 3889224 NWRUYIGOZOMNJE-UHFFFAOYSA-N 332.316 1.423 5 50 EDBA CO[C@@H]1C[C@@H](CC(=O)O)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 262890420 CICHINUZFPNOKL-UONOGXRCSA-N 336.344 1.618 5 50 EDBA NC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2)cc(C(N)=O)c1 4989758 PGMXNOZRHDDRJC-UHFFFAOYSA-N 328.284 1.045 5 50 EDBA NC(=O)c1cc([N+](=O)[O-])cnc1NCc1noc(-c2cccs2)n1 225647551 FBDNTSGQDAJSLT-UHFFFAOYSA-N 346.328 1.812 5 50 EDBA CC1=NN(C(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)[C@](O)(C(F)(F)F)C1 6394324 CJKJTRNYEAJKFC-GMSGAONNSA-N 335.242 1.211 5 50 EDBA CCCn1c(=N)c(C(=O)NCC)cc2c(=O)n3ccccc3nc21 100662595 BRJGOGRDSYGNOY-UHFFFAOYSA-N 325.372 1.288 5 50 EDBA C[C@@H](NC(=O)COc1ccsc1[N+](=O)[O-])C(=O)N1CCCCC1 408525095 KOHDYWDQWOZBTR-SNVBAGLBSA-N 341.389 1.552 5 50 EDBA C[C@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC(C)(C)C 408520025 MJHMBYMVYFZXTA-SNVBAGLBSA-N 326.353 1.228 5 50 EDBA CC(=O)OC(OC(C)=O)(c1ncccn1)c1cc([N+](=O)[O-])ccc1O 12364487 XKFKWMVOMGVWSD-UHFFFAOYSA-N 347.283 1.418 5 50 EDBA CNc1cc(N2CCC[C@H]2CNc2c([N+](=O)[O-])c(C)nn2C)ncn1 114709473 INNUDKBEXYYCRQ-NSHDSACASA-N 346.395 1.549 5 50 EDBA NS(=O)(=O)c1ccc(CCNC(=O)c2ccccc2[N+](=O)[O-])cc1 182451 LEIOSGBFXZKGIR-UHFFFAOYSA-N 349.368 1.215 5 50 EDBA C[C@@H]1CN([C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)C[C@@H](C)O1 138604177 GETWLWUJAFSOBZ-GYSYKLTISA-N 333.344 1.336 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1N[C@@H]1CCN(c2cnn(C)c2)C1=O 280972921 HXDWUIWOIJRAJI-CYBMUJFWSA-N 345.359 1.944 5 50 EDBA O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@@H](O)c1cccc(O)c1 2325875252 LFHLYGDMICJLNZ-OAHLLOKOSA-N 334.303 1.832 5 50 EDBA CN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(c2ccn(C)n2)C1=O 173200069 RSSBTBCZUWREIB-OAHLLOKOSA-N 343.387 1.956 5 50 EDBA CCO[C@@H]1CCC[C@H]1Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-] 408519745 YJLBGCBKUHZWKL-TZMCWYRMSA-N 343.405 1.872 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2CCCO2)c1)[C@@H]1CCCO1 4902005 LNSSGSMRMLZMLW-UONOGXRCSA-N 349.343 1.830 5 50 EDBA O=C(NCCc1ccccc1)c1nc(Cn2cc([N+](=O)[O-])cn2)no1 4721621 RJPRMTCKCQFKID-UHFFFAOYSA-N 342.315 1.195 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1ccns1 1194155827 LKFIIASAUOFHSK-UHFFFAOYSA-N 327.387 1.881 5 50 EDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)[C@H](O)c1ccccc1 408517543 KFXIJBCFJSVRMG-LRDDRELGSA-N 332.360 1.762 5 50 EDBA NS(=O)(=O)c1ccc(CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 182442 SOUHPRBMMNUGQE-UHFFFAOYSA-N 349.368 1.215 5 50 EDBA O=[N+]([O-])c1cc(OS(=O)(=O)c2ccccc2)cc([N+](=O)[O-])c1O 3123095 ZVNDMFZPASSEPP-UHFFFAOYSA-N 340.269 1.976 5 50 EDBA O=c1[nH]c2cccc3nnn(c4cc([N+](=O)[O-])cc([N+](=O)[O-])c14)c32 12375238 WBZQLAHXNMGNGC-UHFFFAOYSA-N 326.228 1.540 5 50 EDBA COc1ccc(-n2ccc(CNC(=O)c3n[nH]cc3[N+](=O)[O-])n2)cc1 138388262 STWSOXGSUCRDKH-UHFFFAOYSA-N 342.315 1.442 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)NCc1ccc(-n2cccc2)cc1 1428882 WJBXPAWAJRRKFI-UHFFFAOYSA-N 325.328 1.898 5 50 EDBA COC(=O)[C@@H]1C[C@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@H]12 34929109 INMSNIOAXIMXNT-ZXIHIIQKSA-N 331.328 1.400 5 50 EDBA O=[N+]([O-])c1ccc(N2CCOCC2)c(Cl)c1N1CCOCC1 3880687 AIBIDURHZOQQET-UHFFFAOYSA-N 327.768 1.921 5 50 EDBA COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](OC)C(=O)O)cc1SC 263052116 GIPWWVMQFIXCNX-SNVBAGLBSA-N 344.345 1.155 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC1(C)CCNCC1 181225554 AQKHGFNPWHAMRD-UHFFFAOYSA-N 327.406 1.571 5 50 EDBA COc1cc[nH]c(=O)c1C(=O)NCCNc1ccccc1[N+](=O)[O-] 170610212 HIYXWAQEVKZTBT-UHFFFAOYSA-N 332.316 1.134 5 50 EDBA CCOc1ccc([N+](=O)[O-])cc1N[C@H]1CCN(c2cnn(C)c2)C1=O 280972924 HXDWUIWOIJRAJI-ZDUSSCGKSA-N 345.359 1.944 5 50 EDBA Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCCN(S(C)(=O)=O)C2)n1 408172301 VCKDIDWIYDSVGF-NSHDSACASA-N 328.394 1.443 5 50 EDBA NC(=O)c1ccccc1NC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1 2895361 GLEPFIZSCNGMHM-UHFFFAOYSA-N 344.352 1.821 5 50 EDBA CC(=O)c1ccc(N2CCC[C@@H]2c2nc(=N)n(C)[nH]2)c([N+](=O)[O-])c1 408523041 GDVDUSAHAOPXOM-GFCCVEGCSA-N 330.348 1.680 5 50 EDBA COc1ccc(Cl)cc1S(=O)(=O)n1c([N+](=O)[O-])cnc1C 53220 MYIYCOHOOHWYGR-UHFFFAOYSA-N 331.737 1.999 5 50 EDBA CNC(=O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 379786 QIXAYTISOBMCOR-UHFFFAOYSA-N 349.368 1.536 5 50 EDBA NC(=O)c1cccc([N+](=O)[O-])c1N1CCCN(c2cccnn2)CC1 420596517 HHEDERWTZZNXST-UHFFFAOYSA-N 342.359 1.200 5 50 EDBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(CN3CCOCC3)c2)n1 20528450 NSLNGUYIQNAXBK-UHFFFAOYSA-N 345.359 1.413 5 50 EDBA CS[C@@H]1CCN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 296123575 FRYUHZYLBSPXRT-GFCCVEGCSA-N 330.431 1.806 5 50 EDBA CCOC(=O)[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N[C@]1(C)O 245238395 MZJXZKVHHNSFHZ-MISXGVKJSA-N 339.373 1.001 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](c2ncccn2)C1 1309904589 WMNAYDWPAAHYPN-GFCCVEGCSA-N 348.384 1.871 5 50 EDBA O=C([C@@H]1CCCCN1c1ncc([N+](=O)[O-])s1)N1CCOCC1 192475440 IEXMYIYIWLOAAW-JTQLQIEISA-N 326.378 1.269 5 50 EDBA CCn1cc([N+](=O)[O-])c(C(=O)N2CCC([C@@H]3NCC3(C)C)CC2)n1 424036346 DSJWUORMPCRQSC-AWEZNQCLSA-N 335.408 1.661 5 50 EDBA CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CCCN(c2ccn(C)n2)C1=O 173200057 RSSBTBCZUWREIB-HNNXBMFYSA-N 343.387 1.956 5 50 EDBA C[S@](=O)c1nncn1-c1ccc([N+](=O)[O-])cc1Br 253426336 ZRAXWSTYPBYMEG-SFHVURJKSA-N 331.151 1.675 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)Nc1cc([N+](=O)[O-])ccc1O 35939876 XGWHOGVNPRJVBR-UHFFFAOYSA-N 341.279 1.535 5 50 EDBA CCN1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C(F)(F)C1 1875276394 YIQGEDDPMMHDGX-NSHDSACASA-N 331.323 1.027 5 50 EDBA COc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@](C)(O4)[C@@H]3C2=O)c([N+](=O)[O-])c1 101359969 JZWIDVBSRXHVQQ-LMOYCYGVSA-N 330.296 1.436 5 50 EDBA Cc1nn([C@@H](C)c2nc3c4cnn(C)c4ncn3n2)c(C)c1[N+](=O)[O-] 2800216 GXWLPNRLVIGVBQ-VIFPVBQESA-N 341.335 1.342 5 50 EDBA O=C(CCc1cccc([N+](=O)[O-])c1)N1CC(=O)N(CC(F)(F)F)C1 362785146 IUEAWDMBOGMCAI-UHFFFAOYSA-N 345.277 1.718 5 50 EDBA Cc1noc([C@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CCN2C)n1 285038353 WAKUTOYIBFBPRX-OAHLLOKOSA-N 331.376 1.817 5 50 EDBA C[C@H]1CN(C(=O)CN(C)CCc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 240551531 GUKMMGVTGKWVOI-OKILXGFUSA-N 335.404 1.705 5 50 EDBA Cc1nn(C(=O)Cn2cc([N+](=O)[O-])cn2)c(C)c1Br 1069025 XTNZQBFOYUAIBH-UHFFFAOYSA-N 328.126 1.708 5 50 EDBA CCN1C(=O)[C@@](O)(CC(=O)c2ccccn2)c2cc([N+](=O)[O-])ccc21 4906413 VDLMXEGBKHJLDV-QGZVFWFLSA-N 341.323 1.817 5 50 EDBA Cc1cc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)cc([N+](=O)[O-])c1 122425935 CXEKAMKPTHEOGS-UHFFFAOYSA-N 349.368 1.944 5 50 EDBA O=C1CN(c2ccc(Nc3c(F)cc([N+](=O)[O-])cc3F)cn2)CCN1 301758467 ALOJRTMJLWALOP-UHFFFAOYSA-N 349.297 1.948 5 50 EDBA O=C(NC1CCCCCC1)c1nc(Cn2cc([N+](=O)[O-])cn2)no1 12428315 RZXTWPIUESADPA-UHFFFAOYSA-N 334.336 1.675 5 50 EDBA O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCC[C@@H](c2nnc3ccccn23)C1 253420797 JYNHIZUVOPCYHM-SNVBAGLBSA-N 341.331 1.380 5 50 EDBA Cc1nccn1C[C@H]1CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] 192740157 PGXQVMGZUUETCG-CYBMUJFWSA-N 329.360 1.868 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] 245806175 MDCNOGQQMWETDP-IJLUTSLNSA-N 337.424 1.977 5 50 EDBA Cc1cnc([N+](=O)[O-])n1CCOC(=O)NC(=O)c1cccc(F)c1 1422269 BQCOLNACZKFBNI-UHFFFAOYSA-N 336.279 1.805 5 50 EDBA O=C(CN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)Nc1ccc([N+](=O)[O-])cc1 100830741 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COC(=O)c1cc(C)nc(NC[C@H](C)c2nncn2C)c1[N+](=O)[O-] 253415483 IMZARDQYWWXQJX-QMMMGPOBSA-N 334.336 1.429 5 50 EDBA CCOC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@H]12 36044334 NHOQVTSGODSKOH-JDSLSITLSA-N 345.355 1.790 5 50 EDBA COc1ccc(S(=O)(=O)N2CC(OC(C)C)C2)c([N+](=O)[O-])c1 874435494 VLCRYQISYBLNCU-UHFFFAOYSA-N 330.362 1.401 5 50 EDBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(C)C=C[C@@]2(C)O1 226627914 RSBMKAMSDZTRBY-DLTLXFJOSA-N 344.323 1.826 5 50 EDBA Cc1nn(CC(=O)N=[S@@](C)(=O)N(C)C)c2ccc([N+](=O)[O-])cc12 864091107 LHBXBTQCZKFIBL-HSZRJFAPSA-N 339.377 1.354 5 50 EDBA Cc1cc(O)nc(N2CC[C@@H](Nc3nccc(C)c3[N+](=O)[O-])C2)n1 952881071 DVQCELXTTHQVKN-LLVKDONJSA-N 330.348 1.793 5 50 EDBA COc1cc(CN(C)C)ccc1NC(=O)Cn1cc([N+](=O)[O-])cn1 408524086 XLNOPIGHTHDFFS-UHFFFAOYSA-N 333.348 1.500 5 50 EDBA CC(C)(CO)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1Cl 5632647 DKGCVWDRBBGINU-UHFFFAOYSA-N 344.799 1.137 5 50 EDBA NS(=O)(=O)c1ccc(NCC2CCSCC2)c([N+](=O)[O-])c1 117639331 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O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1 101328860 WBUODGPYXKUAHZ-CHPZLBCBSA-N 341.323 1.340 5 50 EDBA CCO[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1OC 239782536 COZDGCSAMOYCOM-GIPNMCIBSA-N 348.352 1.205 5 50 EDBA Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)n1 240412622 FNKJDLUFWXWIPK-ZDUSSCGKSA-N 341.371 1.953 5 50 EDBA Cc1nc([C@@H]2CCCN2C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)n[nH]1 1775999045 NAIMJXIMKOHIBT-LBPRGKRZSA-N 341.331 1.875 5 50 EDBA C[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)C[C@@H](C)O1 12417934 PNQYUGPZNTWRKO-AOOOYVTPSA-N 332.312 1.951 5 50 EDBA O=C(O)CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1 4851577 LWAFTNVIURUPIL-UHFFFAOYSA-N 336.325 1.875 5 50 EDBA CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)Nc2cccnc2)c1 225778008 DXAGBYLBJGTPDI-UHFFFAOYSA-N 344.327 1.757 5 50 EDBA Cc1ccc(C(N)=O)c(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 225498072 NLMWPGWOIMSQAE-UHFFFAOYSA-N 336.325 1.770 5 50 EDBA COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 169682286 JVUUTOUYNCREOP-DLTLXFJOSA-N 344.323 1.826 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)CN1CCN(C)CC1 163104360 QEXXBUYOJUTIFP-CYBMUJFWSA-N 335.408 1.661 5 50 EDBA O=C(NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H]1C1CC1 170594689 YJGJRTGXQGVIET-KGLIPLIRSA-N 338.385 1.531 5 50 EDBA COC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] 53699342 XIISMBQDWWAAHP-LLVKDONJSA-N 328.346 1.311 5 50 EDBA C[C@H]1CN(Cc2ccccc2NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 241588037 OZBWPWQMEWFCMD-FAXLKDOZSA-N 333.388 1.900 5 50 EDBA Cc1nc(C2CN(S(=O)(=O)c3cccc([N+](=O)[O-])c3C)C2)n[nH]1 952883982 QHPWXVFYSWLHMA-UHFFFAOYSA-N 337.361 1.118 5 50 EDBA Cc1cccnc1OC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 344283523 WMWJERCGUGEKPP-UHFFFAOYSA-N 345.359 1.565 5 50 EDBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)O 239173901 OWPVEEOWFPPUHS-KKOKHZNYSA-N 338.703 1.841 5 50 EDBA CN(C)c1nc(N)nc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)c2)n1 1442519 WHFOXISXKWPEJE-UHFFFAOYSA-N 340.347 1.340 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccnc2)CC1 285280 KIGMOAQNZQWVAQ-UHFFFAOYSA-N 340.339 1.588 5 50 EDBA CNS(=O)(=O)c1ccc(N2CC(OC(C)C)C2)c([N+](=O)[O-])c1 864092744 WERMAYOGBUFPQK-UHFFFAOYSA-N 329.378 1.117 5 50 EDBA Cc1cc(=O)c2cc(NC(=O)c3nn(C)cc3[N+](=O)[O-])ccc2[nH]1 408514682 CWMXRBPTIZXTES-UHFFFAOYSA-N 327.300 1.731 5 50 EDBA COC(=O)c1nc(N2CC[C@H](C)C2)nc(N2CC[C@H](C)C2)c1[N+](=O)[O-] 408524546 VMIWQWIIPHLQDT-QWRGUYRKSA-N 349.391 1.864 5 50 EDBA Nc1ccc(S(=O)(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 4255861 XJRXNRFOESSSRE-UHFFFAOYSA-N 338.301 1.500 5 50 EDBA Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N[C@H]2CCN[C@@H](C)C2)c1 262746065 DYRIYMJVKUKTIL-UWVGGRQHSA-N 347.824 1.975 5 50 EDBA COc1nn(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 13960120 VGSDUKOYHPUFRH-UHFFFAOYSA-N 335.276 1.737 5 50 EDBA COC(=O)c1cc([N+](=O)[O-])cn(CCN(C)Cc2ccccc2)c1=O 408521674 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COC(=O)C(Br)(C(=O)OC)c1ccc([N+](=O)[O-])cc1 4072872 GMLXDVKFZGQTNV-UHFFFAOYSA-N 332.106 1.531 5 50 EDBA COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(C)C=C[C@@]2(C)O1 226627829 NFVKJDYLTZDKAU-WRFANHODSA-N 344.323 1.826 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2ncccn2)CC1 5041773 KQDZTLVRUKVWCX-UHFFFAOYSA-N 328.332 1.739 5 50 EDBA NC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2900014 QRVJGAKAPKRYER-UHFFFAOYSA-N 330.256 1.854 5 50 EDBA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c([N+](=O)[O-])c1 175434 OVGBZCYMWGVRKQ-ZDUSSCGKSA-N 335.316 1.794 5 50 EDBA Cn1cc(N2CCC[C@@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)cn1 154056325 GLFFNKMVPZBSEL-CQSZACIVSA-N 343.387 1.656 5 50 EDBA O=C(NCCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccncc1 196447 YDQPCQAZLBDBBS-UHFFFAOYSA-N 340.295 1.016 5 50 EDBA Cc1cccc(-n2nc([N+](=O)[O-])c(NCc3cccnc3)[n+]2[O-])c1 4759029 BHASPCOIVGGJKA-UHFFFAOYSA-N 326.316 1.729 5 50 EDBA CC(=O)Nc1c(O)nc(SCc2ccc([N+](=O)[O-])cc2)[nH]c1=O 9057518 RUEHCBWEQYNQLY-UHFFFAOYSA-N 336.329 1.634 5 50 EDBA Cc1nccn1C[C@H]1CCCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 178750448 FVAVZQTZWHXICM-OAHLLOKOSA-N 343.387 1.863 5 50 EDBA Cc1nn([C@@H](C)C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Cl 2782532 KMHYRGSIRJFEAL-VIFPVBQESA-N 326.744 1.327 5 50 EDBA O=C1CCc2cc([N+](=O)[O-])c(N3CCOC4(CCOCC4)C3)cc2N1 133589418 PUODDOSFKCGBJQ-UHFFFAOYSA-N 347.371 1.865 5 50 EDBA Cc1ccc(NCCc2nnc3n2CCN(C)C3=O)c([N+](=O)[O-])c1 1331743486 MRGLAXCIVUNLDY-UHFFFAOYSA-N 330.348 1.235 5 50 EDBA COC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@H]1c1cccc([N+](=O)[O-])c1 83321 HLUJFRZXFQDWKC-ZDUSSCGKSA-N 333.300 1.655 5 50 EDBA COc1ccc(S(=O)(=O)N2CCC(=O)[C@@H](C)C2)c([N+](=O)[O-])c1 170599973 INDFXTRWVNRWMA-VIFPVBQESA-N 328.346 1.203 5 50 EDBA COc1ccc(OCCNC(=O)c2c([N+](=O)[O-])c(C)nn2C)cc1 193883573 HBWXMQOOBKAKJL-UHFFFAOYSA-N 334.332 1.454 5 50 EDBA O=C(O)CCCn1cc(NC(=O)COc2ccccc2[N+](=O)[O-])cn1 1427405 ULSCAJHKYPGUKP-UHFFFAOYSA-N 348.315 1.674 5 50 EDBA O=[N+]([O-])c1cnc(N2CCC[C@@H](N3CCCS3(=O)=O)C2)s1 239722381 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EDBA CCCNc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC(=O)[C@H](C)OC 864088119 YYPFDSIVYQGDNS-VIFPVBQESA-N 345.377 1.257 5 50 EDBA O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CN2CCN1CC2 170591234 JYEDYMVRMQNKAW-SECBINFHSA-N 342.197 1.164 5 50 EDBA CS(=O)(=O)N1CCC(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 467480 LQVXSMIWTPFQAD-UHFFFAOYSA-N 327.362 1.205 5 50 EDBA C[C@@H]1CCCC[C@]1(CN)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 170683118 LMARCVWKEFMMAB-BXUZGUMPSA-N 327.406 1.781 5 50 EDBA O=C(NCCc1cccc([N+](=O)[O-])c1)c1cncc(-n2ccnn2)c1 253392980 LYTXQMCHUXHSRU-UHFFFAOYSA-N 338.327 1.543 5 50 EDBA CCn1ncc(-n2c(S)nnc2Cn2nc([N+](=O)[O-])cc2C)c1C 2802807 DDELEPRUNCSMMB-UHFFFAOYSA-N 348.392 1.542 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCc2ccccc2)c([N+](=O)[O-])c1 82150113 XKHQYTSLQZPZOF-UHFFFAOYSA-N 337.313 1.982 5 50 EDBA C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1O 189655334 IFWDOHONBGLFSX-HZMBPMFUSA-N 325.340 1.765 5 50 EDBA Cc1ccc2c(n1)OCCN2S(=O)(=O)c1cccc([N+](=O)[O-])c1 195445031 PXYOZQMLAQKTRC-UHFFFAOYSA-N 335.341 1.886 5 50 EDBA O=C(CN1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)Nc1ccc([N+](=O)[O-])cc1 101677585 OXCOLCMOOINXIJ-NBLIUIFLSA-N 343.339 1.564 5 50 EDBA Cc1c([N+](=O)[O-])cnn1CCC(=O)N(C)Cc1c(Cl)cnn1C 2802829 KZYZUOSXIBVDAJ-UHFFFAOYSA-N 340.771 1.535 5 50 EDBA CS(=O)(=O)NCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F 4575568 GMWNPIBXKSDYMB-UHFFFAOYSA-N 327.284 1.575 5 50 EDBA COC(=O)Oc1c([N+](=O)[O-])cc(N2CCCC2=O)cc1[N+](=O)[O-] 3149814 TXWVMGHUWFMMOL-UHFFFAOYSA-N 325.233 1.775 5 50 EDBA C[C@@]1(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCO[C@@H]1C1CC1 282443907 GWBOSLDCWDGPKC-ZIAGYGMSSA-N 326.374 1.831 5 50 EDBA CC[C@@H](O)Cn1cnc2c(cnn2-c2ccc([N+](=O)[O-])cc2)c1=O 156413148 XZKZVVCZKBRBKS-GFCCVEGCSA-N 329.316 1.261 5 50 EDBA CCc1cc(N2CC(O)(CO)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 408524343 SNFQFUXRXKNSCD-UHFFFAOYSA-N 330.344 1.158 5 50 EDBA COCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1 2059130 NFVFZWCRIORGTI-AWEZNQCLSA-N 349.343 1.755 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)Nc1ncc([N+](=O)[O-])s1 4715758 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COC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-] 53699337 XIISMBQDWWAAHP-NSHDSACASA-N 328.346 1.311 5 50 EDBA O=C(Nc1ccc([N+](=O)[O-])c(NC(=O)[C@H]2CCCO2)c1)[C@H]1CCCO1 4902006 LNSSGSMRMLZMLW-ZIAGYGMSSA-N 349.343 1.830 5 50 EDBA Cc1ccnc(NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)n1 301256220 DEQSHBYNNVNOTK-UHFFFAOYSA-N 337.361 1.084 5 50 EDBA O=c1nc2n(CCOc3ccccc3)c3ccccc3nc-2c(=O)[nH]1 8783555 XDVNNSQCKORYLI-UHFFFAOYSA-N 334.335 1.664 5 50 EDBA COc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(C)C=C[C@H]3O2)c([N+](=O)[O-])c1 100186090 JZWIDVBSRXHVQQ-BRXULGCHSA-N 330.296 1.436 5 50 EDBA O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CN2CCN1CC2 170591235 JYEDYMVRMQNKAW-VIFPVBQESA-N 342.197 1.164 5 50 EDBA O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNc1cccc(F)c1[N+](=O)[O-] 152719109 KCTWLEIAEDRRRJ-TXFQPVFDSA-N 345.330 1.953 5 50 EDBA CC(C)n1cc(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)c(O)nc1=O 952882517 GAHVWLJIYSUSQX-UHFFFAOYSA-N 348.315 1.074 5 50 EDBA O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1ccccc1 67934 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170595523 LIVOHFSBTQOARK-UHFFFAOYSA-N 341.371 1.964 5 50 EDBA C[C@H]1CCCC[C@]1(CN)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 170683121 LMARCVWKEFMMAB-SMDDNHRTSA-N 327.406 1.781 5 50 EDBA COC[C@@]1(O)CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)CC1 1875278957 HPCBLQPFPWWJNU-MRXNPFEDSA-N 348.359 1.475 5 50 EDBA O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCN(c2ccccc2)CC1 151654818 QHCQRBJXAFNUOA-UHFFFAOYSA-N 344.375 1.323 5 50 EDBA CC1(NS(=O)(=O)c2ccc([N+](=O)[O-])nc2)Cc2ccccc2C1 195442381 ZSEIJBFKWGLOFL-UHFFFAOYSA-N 333.369 1.826 5 50 EDBA CC1=NN(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)[C@@](O)(C(F)(F)F)C1 374421 ZUQKAOGNIPFNHC-NSHDSACASA-N 349.269 1.267 5 50 EDBA O=C(Cn1nc(C(F)F)cc1C(F)F)Nn1cc([N+](=O)[O-])cn1 6828564 MARXYRCROAVSGH-UHFFFAOYSA-N 336.205 1.633 5 50 EDBA C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC2(CC1)OCCO2 20606259 OCRVDHUHKFAYKC-GFCCVEGCSA-N 336.344 1.728 5 50 EDBA Cn1c(=O)[nH]c(=O)c2nc3cc(-c4cccc([N+](=O)[O-])c4)oc3nc21 225403522 OSGLJDFQRZMLCS-UHFFFAOYSA-N 339.267 1.338 5 50 EDBA 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EDBA CN(C)C(=O)COc1cccc(CNc2cc(N)c([N+](=O)[O-])cn2)c1 1120869966 HGIXZUGEEBRCQI-UHFFFAOYSA-N 345.359 1.651 5 50 EDBA CNC(=O)c1ccc(N2CCC(c3cc(N)[nH]n3)CC2)c([N+](=O)[O-])c1 253429171 CBWKQYJXYRUOQD-UHFFFAOYSA-N 344.375 1.644 5 50 EDBA O=[N+]([O-])c1cnc2ccc(N3CC[C@@H](OCc4ccncc4)C3)nn12 192905194 UUROHEICKLWJBV-CYBMUJFWSA-N 340.343 1.828 5 50 EDBA CCCc1[nH]nc(C(=O)NC[C@@H](CO)c2cccnc2)c1[N+](=O)[O-] 360446143 OUFIYRXGOSFPSO-NSHDSACASA-N 333.348 1.171 5 50 EDBA NS(=O)(=O)c1cccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1 5094710 SVIJMXQRJKRBHM-BQYQJAHWSA-N 347.352 1.894 5 50 EDBA CN1CCN(C(=O)CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 4819061 IZDRIHHIVOELII-UHFFFAOYSA-N 346.309 1.800 5 50 EDBA Cc1cc(NC(=O)/C(=C/c2cnn(C)c2)n2cc([N+](=O)[O-])cn2)no1 17071635 NQDZBCAHIZFFOF-QCDXTXTGSA-N 343.303 1.458 5 50 EDBA COc1ccc([N+](=O)[O-])cc1NC(=O)CCCN1C(=O)CCC1=O 2866832 ZNZRNRDMNWVNPG-UHFFFAOYSA-N 335.316 1.471 5 50 EDBA O=C([C@@H]1CCCc2[nH]ncc21)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 253433249 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O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1ccc([N+](=O)[O-])o1 112260792 AYYXXTXXWXUNQW-JTQLQIEISA-N 333.275 1.862 5 50 EDBA O=C(Nc1ccccc1)N[C@@H](CO)[C@@H](O)c1cccc([N+](=O)[O-])c1 25668047 NQHNSKIUPNZUCN-GJZGRUSLSA-N 331.328 1.811 5 50 EDBA CS(=O)(=O)c1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cn1 120764050 YOAIOGFXSKCZGA-UHFFFAOYSA-N 349.368 1.965 5 50 EDBA CC(C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)N1CCOCC1 178156324 KHFLRRVFOLIQFR-CQSZACIVSA-N 336.392 1.264 5 50 EDBA Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H](c2cnccn2)C1 1475733838 FVEWMBSBCSOTOX-LBPRGKRZSA-N 348.384 1.871 5 50 EDBA CN1CCN(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1(C)C 408516256 MPDOFISJOXHQKT-UHFFFAOYSA-N 341.433 1.395 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2nc3ccccc3[nH]2)cc1 48463 BULYKWSBEODFTA-UHFFFAOYSA-N 346.368 1.992 5 50 EDBA COC(=O)C1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](O)(C(C)(C)C)C1 432146 GMQKJJCAYGQILY-INIZCTEOSA-N 349.343 1.704 5 50 EDBA CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1[N+](=O)[O-] 101418178 IEDAQDFPNMCNHG-NBLIUIFLSA-N 342.307 1.832 5 50 EDBA Cc1nnc(CCNc2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])s1 291170834 QXUJLVSUEXWJLN-UHFFFAOYSA-N 343.390 1.057 5 50 EDBA O=C(NC1(c2ccc(F)cc2)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 192662120 YVJSXQPSIIITKP-UHFFFAOYSA-N 334.307 1.893 5 50 EDBA O=[N+]([O-])c1ccc(-c2nnc(NCCCO)s2)c([N+](=O)[O-])c1 2546656 JPGNLXPWFLXIHW-UHFFFAOYSA-N 325.306 1.816 5 50 EDBA Cc1cc(N2CCC(NC(=O)c3n[nH]cc3[N+](=O)[O-])CC2)nc(C)n1 133157977 SBCKOHSSDVKZHW-UHFFFAOYSA-N 345.363 1.124 5 50 EDBA Cc1nc2ccc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])cn2n1 408515478 LFLGXBQOCFVVEZ-UHFFFAOYSA-N 333.329 1.747 5 50 EDBA COc1cc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])cc(Br)c1O 85988 YXUKMPOZDZNNOS-LDYMZIIASA-N 345.149 1.760 5 50 EDBA COC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 252508996 YAKGSHPDKMOZLF-UHFFFAOYSA-N 337.288 1.528 5 50 EDBA COc1ccc(CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1O 170620795 UEXRTNRZYSVLTD-UHFFFAOYSA-N 348.359 1.829 5 50 EDBA O=C(CNC(=O)c1ccccc1)OCC(=O)c1ccc([N+](=O)[O-])cc1 2749862 MNYNOPAGKBARGZ-UHFFFAOYSA-N 342.307 1.751 5 50 EDBA CC(=O)N1CCC(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 55291982 BBQDPBCKJJYJFU-UHFFFAOYSA-N 332.404 1.728 5 50 EDBA COC(=O)c1ccc(NC(=O)CCCn2cc([N+](=O)[O-])cn2)cc1 1423409 XTXRIXXBXBCNRQ-UHFFFAOYSA-N 332.316 1.997 5 50 EDBA CC(=O)N/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccco1 315154 BZGMOWPCHHXSQN-OQLLNIDSSA-N 329.312 1.981 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc([N+](=O)[O-])cc1 5077378 HQHBHXINYBQNMY-UHFFFAOYSA-N 325.280 1.830 5 50 EDBA CCOC(=O)Cc1nnc(NC(=O)c2ccccc2[N+](=O)[O-])s1 9349715 TVINXWFKFKJZFD-UHFFFAOYSA-N 336.329 1.804 5 50 EDBA O=[N+]([O-])c1cnc(N2CC[C@@H](c3nc[nH]n3)C2)c(Br)c1 425290802 YDOUBGKZWJNDSX-SSDOTTSWSA-N 339.153 1.864 5 50 EDBA O=C(O)CSc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-] 78126 ODAADCQRHYFLLI-UHFFFAOYSA-N 326.330 1.244 5 50 EDBA O=C(Nc1ccccc1)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 3122276 OTHJFTRLOFIPPI-LSDHHAIUSA-N 331.328 1.811 5 50 EDBA O=C(Nc1cc(SC[C@H](O)CO)cc([N+](=O)[O-])c1)c1ccco1 2749462 VIZBEWZEDKSNRX-LLVKDONJSA-N 338.341 1.885 5 50 EDBA C[C@H]1CN([C@H]2CC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)C[C@@H](C)O1 138604307 GETWLWUJAFSOBZ-WDMOLILDSA-N 333.344 1.336 5 50 EDBA CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1O 183732715 OWARTLYJRIGKNW-JTQLQIEISA-N 349.265 1.942 5 50 EDBA COc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1[N+](=O)[O-] 15684534 JJKAQDGUKFNOME-DUXPYHPUSA-N 334.244 1.471 5 50 EDBA Cc1cc([N+](=O)[O-])nn1CC(=O)NCCc1c[nH]c2ccccc12 1432178 GSIXJCSFUIIHFD-UHFFFAOYSA-N 327.344 1.940 5 50 EDBA Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(N3CCC4(CC3)OCCO4)cc21 225816977 JGYDYLXAZKFULW-UHFFFAOYSA-N 348.359 1.129 5 50 EDBA O=C(Nc1ccccc1)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1 3122278 OTHJFTRLOFIPPI-GJZGRUSLSA-N 331.328 1.811 5 50 EDBA CC[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)NC(=O)OC(C)(C)C 295359273 BIYAHJHDNTXMFA-SNVBAGLBSA-N 341.368 1.211 5 50 EDBA C[C@H](O)CN(C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] 952881468 HNFBKONFNARHKE-ZETCQYMHSA-N 339.320 1.231 5 50 EDBA Cn1c(=O)[nH]c(=O)c2c1nc1oc(-c3ccc([N+](=O)[O-])cc3)cn12 207116 MATDEYLPEMWHEN-UHFFFAOYSA-N 327.256 1.043 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)NCc2cnn(C)c2C)c1[N+](=O)[O-] 170611292 WMPZXUWQEUYYCB-UHFFFAOYSA-N 338.389 1.732 5 50 EDBA Cc1cn2c(CNC(=O)Cn3cc([N+](=O)[O-])cn3)c(C)nc2s1 408518565 NYLSMJWVWGMVSW-UHFFFAOYSA-N 334.361 1.434 5 50 EDBA NC(=O)C1(N2CCCCC2)CCN(c2ccc([N+](=O)[O-])cc2)CC1 4624249 BSHIPHUVEMJKOW-UHFFFAOYSA-N 332.404 1.905 5 50 EDBA O=C(O)c1cc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)ccc1O 3149151 VDRYXYGLISRSAY-UHFFFAOYSA-N 338.297 1.799 5 50 EDBA COc1c(C)cnc(CN(C)c2ncc([N+](=O)[O-])cc2C(N)=O)c1C 194657481 SERDDSIBIJMRRJ-UHFFFAOYSA-N 345.359 1.746 5 50 EDBA O=C(O)CN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-] 4995478 ZMUWEJOPTWSFKR-UHFFFAOYSA-N 336.325 1.875 5 50 EDBA O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)N2CCC[C@H]2CO)c1 170619833 LJODKGLVLVTYEK-ZETCQYMHSA-N 338.744 1.533 5 50 EDBA O=C(NCC1CCCCC1)c1nc(Cn2ccc([N+](=O)[O-])n2)no1 4727765 VXGJZVIDQGAEHB-UHFFFAOYSA-N 334.336 1.533 5 50 EDBA COC(=O)c1cccc2c1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2 408520664 RBYUFZDXSARLIN-UHFFFAOYSA-N 344.327 1.163 5 50 EDBA Cc1cc(Cl)c([N+](=O)[O-])cc1S(=O)(=O)NCc1ccncn1 318384023 GEBHPGRWTIIZBV-UHFFFAOYSA-N 342.764 1.825 5 50 EDBA Cn1c(=O)c(=O)n(C)c2cc([N+](=O)[O-])c(NCc3ccccc3)cc21 4708488 GGKPUDFAHFGYIQ-UHFFFAOYSA-N 340.339 1.758 5 50 EDBA O=C(NCCOC(=O)c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 16476735 XUKSXTHNDFCRRJ-UHFFFAOYSA-N 330.296 1.887 5 50 EDBA O=C(C[C@@H]1N[C@H]2CCCC[C@H]2NC1=O)Nc1ccc([N+](=O)[O-])cc1 4702816 PDUFJMZIZWSOSY-MJBXVCDLSA-N 332.360 1.323 5 50 EDBA COC(=O)CCC(=O)NC(=S)Nc1cc([N+](=O)[O-])cc(C)c1O 1848442514 MFJWVXCTVGVILS-UHFFFAOYSA-N 341.345 1.375 5 50 EDBA O=C(NC(=S)N[C@@H]1CCSC1=O)c1ccc([N+](=O)[O-])cc1 2910614 YVJGENXTVNFROS-SECBINFHSA-N 325.371 1.231 5 50 EDBA COc1cc(CN(C)S(=O)(=O)c2ccccc2[N+](=O)[O-])sn1 952995348 JEFTXHHMBRCUND-UHFFFAOYSA-N 343.386 1.881 5 50 EDBA O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(c2ncccn2)CC1 376530 NCIGQXMQVBJLOA-QPJJXVBHSA-N 339.355 1.747 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)NS(=O)(=O)c2ccccc2)cc1 2511149 KGIPQJUPLSDVPS-UHFFFAOYSA-N 342.354 1.262 5 50 EDBA COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C 2779481 XYXYDSXHWSNXON-NSHDSACASA-N 325.277 1.430 5 50 EDBA Cc1cc(N2CCC[C@@H](Nc3ncc([N+](=O)[O-])c(N)n3)C2)nc(C)n1 377576985 INNLAJIQCAEADE-LLVKDONJSA-N 344.379 1.455 5 50 EDBA Nc1c(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] 176313195 LWFXPKDQHMDNGP-HNNXBMFYSA-N 340.339 1.490 5 50 EDBA COc1ccc(OC[C@H](O)CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 464717 LKXYWRNCZVTZKF-CQSZACIVSA-N 346.339 1.773 5 50 EDBA O=[N+]([O-])c1cc(Br)cnc1N1CC[C@@H](c2nc[nH]n2)C1 425282254 KEMARFPGSYOLLE-SSDOTTSWSA-N 339.153 1.864 5 50 EDBA COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(C)C=C[C@@]2(C)O1 226627909 RSBMKAMSDZTRBY-WRFANHODSA-N 344.323 1.826 5 50 EDBA CC(C)(CO)[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1 239672678 BURGHTVEUSMEFD-HZPDHXFCSA-N 348.403 1.502 5 50 EDBA COC(=O)c1cc(C(=O)Nc2ccccc2C(N)=O)cc([N+](=O)[O-])c1 184079 JVXMBSAHECDVMA-UHFFFAOYSA-N 343.295 1.733 5 50 EDBA C[C@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]1CO 248892958 GBBUQUOYFLJBFN-KWQFWETISA-N 334.781 1.640 5 50 EDBA CC1=NN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@](O)(C(F)(F)F)C1 1019125 JNJHOOJRSSNKRW-SNVBAGLBSA-N 335.242 1.109 5 50 EDBA Cc1c2c(=O)cc(C(=O)O)[nH]c2c(Cl)c2[nH]c(C(=O)O)cc(=O)c12 39221292 VVHMEKWEUMPVHG-UHFFFAOYSA-N 348.698 1.728 5 50 EDBA CNS(=O)(=O)c1ccc(N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]32)c([N+](=O)[O-])c1 242302081 YPJBENXHYGUTHQ-LFIJZLDSSA-N 337.401 1.738 5 50 EDBA CC(=O)c1ccc(N2CCC[C@H]2c2nc(=N)n(C)[nH]2)c([N+](=O)[O-])c1 408523045 GDVDUSAHAOPXOM-LBPRGKRZSA-N 330.348 1.680 5 50 EDBA CN(C)c1ncnc(Cl)c1CSc1ncc([N+](=O)[O-])c(N)n1 408523130 PDKIWJRENBFKKN-UHFFFAOYSA-N 341.784 1.769 5 50 EDBA CCOC(=O)N1CCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 471889 MFKUZUVQIAKGFF-GFCCVEGCSA-N 335.360 1.999 5 50 EDBA O=[N+]([O-])[C@H]([C@H]1NCCc2ccccc21)S(=O)(=O)c1ccccc1 5279587 DKQXXLNKHXUAAR-HOTGVXAUSA-N 332.381 1.950 5 50 EDBA CC[N@+]1(C)[C@H]2C[C@@H](OC(=O)[C@H](CO)c3ccccc3)C[C@H]1C[C@H]2O 245253984 XCNYCAGTMKJDDN-FMWJIXOUSA-N 334.436 1.436 5 50 EDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H](CCN(C)C)C1 952880243 CDPUHSYKDCQKJU-ZDUSSCGKSA-N 341.433 1.866 5 50 EDBA CCN(CC)CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1OC 3877840 FGTQEICFEHSKTB-UHFFFAOYSA-N 338.408 1.741 5 50 EDBA O=C1C[C@@H](c2cccc([N+](=O)[O-])c2)c2c(O)nc3ncnn3c2N1 4625361 KMBPBQOKEPOJIN-VIFPVBQESA-N 326.272 1.212 5 50 EDBA Cc1nn(CC(=O)N=[S@](C)(=O)N(C)C)c2ccc([N+](=O)[O-])cc12 864091110 LHBXBTQCZKFIBL-QHCPKHFHSA-N 339.377 1.354 5 50 EDBA Cc1cc([N+](=O)[O-])cnc1NCCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 301586810 WRWLVQJNHGLPRD-CDGCEXEKSA-N 342.355 1.517 5 50 EDBA CCOc1cc(/C=C\[N+](=O)[O-])ccc1OCC(=O)N1CCOCC1 4475936 LTTFPUGEFQUOCA-WAYWQWQTSA-N 336.344 1.570 5 50 EDBA O=C(NCCNC(=O)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 2851060 DVFBXLSDDVYRLH-UHFFFAOYSA-N 331.303 1.894 5 50 EDBA Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCS(=O)(=O)[C@@H](C)[C@H]1C 121364455 SPSSEVDWYHYTSW-MNOVXSKESA-N 326.374 1.551 5 50 EDBA O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)Nc1cccc(O)c1 188995 WYKDFCMWUUVJHG-UHFFFAOYSA-N 341.279 1.535 5 50 EDBA CC(CNc1c([N+](=O)[O-])cc(Cl)cc1[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-] 33354440 HPCSAHLQELCDCV-UHFFFAOYSA-N 349.643 1.838 5 50 EDBA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1O 179444097 IIFPELOACQLVKN-SECBINFHSA-N 347.293 1.914 5 50 EDBA Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](CN)C3(CCOCC3)C2)c1 449689183 JCGGBBNKRIGPDJ-CYBMUJFWSA-N 333.388 1.731 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H](c3cn[nH]c3)C2)n1 952988889 MXQZKKRVJYFHDU-JTQLQIEISA-N 331.332 1.884 5 50 EDBA O=C1[C@@H]2[C@@H](C(=O)N1CCNc1cccc(F)c1[N+](=O)[O-])[C@H]1C=C[C@H]2C1 152719179 KCTWLEIAEDRRRJ-NUZBWSBOSA-N 345.330 1.953 5 50 EDBA COC(=O)C(C(=O)OC)c1ncc(Br)cc1[N+](=O)[O-] 65337533 HIDYAPIMWAPXGK-UHFFFAOYSA-N 333.094 1.182 5 50 EDBA in-vitro O=C(c1ccncc1)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19774052 LZFHWTWLCUWONA-UHFFFAOYSA-N 326.356 1.948 5 50 EDBA C[C@H]1CN(C(=O)CN(C)CCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 240551530 GUKMMGVTGKWVOI-KBPBESRZSA-N 335.404 1.705 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)c1[N+](=O)[O-] 192670342 QXSJPFNWACUSQR-RYUDHWBXSA-N 332.364 1.991 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)cn1 195427431 APUVQRJYKYLPDE-CWRNSKLLSA-N 345.380 1.997 5 50 EDBA COC1(C)CN(c2nc(C)c([N+](=O)[O-])c(N3CC(C)(OC)C3)n2)C1 428155041 LHOLWSUMYLVFMS-UHFFFAOYSA-N 337.380 1.143 5 50 EDBA O=C(Cc1ccccc1)NCC(=O)OCc1cccc([N+](=O)[O-])c1 467023 TXUXYDLFRZWPKR-UHFFFAOYSA-N 328.324 1.997 5 50 EDBA O=[N+]([O-])c1sc(N2CCCOCC2)nc1N1CCCOCC1 169988854 PRQZGDMTIRACIV-UHFFFAOYSA-N 328.394 1.505 5 50 EDBA O=C(NCc1nnc(C2CC2)o1)c1cc2c(c([N+](=O)[O-])c1)OCO2 281598805 NUCPXQIRBNVEHS-UHFFFAOYSA-N 332.272 1.514 5 50 EDBA CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1N(C)CC[C@H](C)O 408518749 XSBNJUSMAHIPQY-NSHDSACASA-N 345.421 1.490 5 50 EDBA CC1=NN(C(=O)[C@H](C)Oc2ccccc2[N+](=O)[O-])[C@@](O)(C(F)F)C1 6849526 GIXXWTOCRKPIFE-XPTSAGLGSA-N 343.286 1.924 5 50 EDBA CO[C@@H]1C[C@H](CC(=O)O)N(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 262890421 CICHINUZFPNOKL-ZIAGYGMSSA-N 336.344 1.618 5 50 EDBA CCC[C@@]1(C(=O)OCC)CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 278146210 AYUDECSXAMJYGA-HNNXBMFYSA-N 338.364 1.516 5 50 EDBA O=C(NCC(=O)N1CCc2c1cccc2[N+](=O)[O-])c1cccs1 172360881 YAYDILBRVFFQIC-UHFFFAOYSA-N 331.353 1.975 5 50 EDBA CCc1[nH]nc(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)c1[N+](=O)[O-] 192670369 QXSJPFNWACUSQR-NWDGAFQWSA-N 332.364 1.991 5 50 EDBA CC(=O)c1ccc(N2CCC(n3cnnc3O)CC2)c([N+](=O)[O-])c1 408515574 JYRIVCRNRJIPHS-UHFFFAOYSA-N 331.332 1.936 5 50 EDBA COC(=O)[C@@H]1C[C@]2(C(=O)Nc3ccc([N+](=O)[O-])cc32)N2CCC[C@@H]12 14944570 INMSNIOAXIMXNT-HICWGWBUSA-N 331.328 1.400 5 50 EDBA CC(C)(C(N)=O)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1N 1875275511 GONFACKOHXVXPR-UHFFFAOYSA-N 345.153 1.390 5 50 EDBA C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1S(C)(=O)=O 4117401 OQGHLSPKDQJJAF-SECBINFHSA-N 333.797 1.718 5 50 EDBA CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c([N+](=O)[O-])c1 100004047 KPUREKXXPHOJQT-UHFFFAOYSA-N 339.325 1.119 5 50 EDBA in-vitro CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)[C@H]1c1ccccc1 348426795 XNGYXRZGHXJYFC-INIZCTEOSA-N 341.323 1.913 5 50 EDBA CN(C)c1ccnc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c1 188560858 RCSWFIFPFQOFLI-UHFFFAOYSA-N 342.355 1.959 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCNC[C@@H]2C)c1[N+](=O)[O-] 262745881 DQUOASRIPFJTKC-NWDGAFQWSA-N 327.406 1.488 5 50 EDBA CC(C)c1nc2n(n1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)CC2 188325592 BNGQNIXWHWVIHF-JTQLQIEISA-N 344.375 1.637 5 50 EDBA COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1 169682285 JVUUTOUYNCREOP-WRFANHODSA-N 344.323 1.826 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1[C@H]2CCc3ccccc3[C@H]21 155122759 BLIWGFUZVWTVFD-CKEIUWERSA-N 326.356 1.884 5 50 EDBA O=C1CC[C@H]([N+](=O)[O-])[C@@H](c2cc3c(cc2Br)OCO3)N1 112061 PRJGMUUNRHWKBF-QPUJVOFHSA-N 343.133 1.774 5 50 EDBA O=[N+]([O-])c1ccc(NC(=S)N2CCN(c3ncccn3)CC2)cc1 4999105 SASQJIBDPHREBA-UHFFFAOYSA-N 344.400 1.904 5 50 EDBA O=[N+]([O-])c1cnn(Cc2nc3c4c5c(sc4ncn3n2)CCC5)c1 2785897 LZUUOXAYGDNSGY-UHFFFAOYSA-N 341.356 1.981 5 50 EDBA CCn1cc(Cl)c(CNC(=O)CCn2ncc([N+](=O)[O-])c2C)n1 2808460 BYGJEVAAWFDRKX-UHFFFAOYSA-N 340.771 1.676 5 50 EDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)[C@H](O)c1ccccc1 408517545 KFXIJBCFJSVRMG-WBMJQRKESA-N 332.360 1.762 5 50 EDBA O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccccc2)c(-n2cnnn2)c1 755278154 ALCZKYXLXMYIIN-UHFFFAOYSA-N 347.312 1.338 5 50 EDBA Cc1cnc([N+](=O)[O-])n1CCOC(=O)NC(=O)c1ccc(F)cc1 1422270 XCXGYUOWDFHGQS-UHFFFAOYSA-N 336.279 1.805 5 50 EDBA COC(=O)[C@H](C)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 328598125 KCJWVCCMGVEDTF-SNVBAGLBSA-N 332.316 1.707 5 50 EDBA O=[N+]([O-])c1cnn(CCN2CCO[C@]3(CCc4ccccc43)C2)c1 170052760 ZTKUEMWQNGIWBW-QGZVFWFLSA-N 328.372 1.965 5 50 EDBA O=c1c2c([nH]c3nc(NCc4cccc([N+](=O)[O-])c4)nn13)CCC2 100271239 IDYYMJQSMDGUMK-UHFFFAOYSA-N 326.316 1.427 5 50 EDBA CC1(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCNCC1 181225920 NKUMKTOXRLXOFV-UHFFFAOYSA-N 327.406 1.404 5 50 EDBA NC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 4977002 LETYOJPMYHMQOW-UHFFFAOYSA-N 335.341 1.275 5 50 EDBA C[C@@H]1CCN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H]1CO 248892954 GBBUQUOYFLJBFN-KCJUWKMLSA-N 334.781 1.640 5 50 EDBA Cc1ccnc(NCCN2c3ccccc3NS2(=O)=O)c1[N+](=O)[O-] 170086209 HEOOTOUKBYLOFI-UHFFFAOYSA-N 349.372 1.887 5 50 EDBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCn2nnc(CO)c2C1 408518728 XBBVSEDPWXJCDW-UHFFFAOYSA-N 343.265 1.718 5 50 EDBA COC(=O)c1ccccc1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 1069768 MDYCZNXDULWNGC-UHFFFAOYSA-N 332.316 1.833 5 50 EDBA COc1ccc(NC(=O)CCC(=O)N2CCOCC2)c([N+](=O)[O-])c1 6690944 CVXNNTHEFOPMRB-UHFFFAOYSA-N 337.332 1.181 5 50 EDBA CN(C)S(=O)(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2)nc1 195189406 WPCXCSKURXRPAG-UHFFFAOYSA-N 336.373 1.852 5 50 EDBA CCO[C@@H]1C[C@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1OC 239782539 COZDGCSAMOYCOM-OPQQBVKSSA-N 348.352 1.205 5 50 EDBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N1CCCCC1 1069195 QNLHUYDHPPOSFY-UHFFFAOYSA-N 331.170 1.875 5 50 EDBA COC(=O)c1cc(NC(=O)c2ccc3nn[nH]c3c2)cc([N+](=O)[O-])c1 346274868 INSNTPKWSWCFKD-UHFFFAOYSA-N 341.283 1.905 5 50 EDBA O=C(NCc1ccccc1F)c1nc(Cn2ccc([N+](=O)[O-])n2)no1 4727769 ZIFOTZGSIQCYTF-UHFFFAOYSA-N 346.278 1.292 5 50 EDBA CC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@H](C(C)=O)C(=O)C[C@]1(C)O 36080446 PFWYAXMEENKSMR-QZWWFDLISA-N 333.340 1.813 5 50 EDBA CCOC(=O)C1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 621205 PORJBFVHJANYHC-UHFFFAOYSA-N 336.344 1.775 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 35622979 ZHOCVAORAMJCLR-UHFFFAOYSA-N 348.384 1.501 5 50 EDBA N[C@@H](CCCCNC(=O)OCc1ccc([N+](=O)[O-])cc1)C(=O)O 2560755 XMTCOKGMBIHVBJ-LBPRGKRZSA-N 325.321 1.403 5 50 EDBA in-vitro Cn1c(=O)c2c(nc(Cl)n2Cc2ccc([N+](=O)[O-])cc2)n(C)c1=O 170617 XKRHRNHJGNHEPT-UHFFFAOYSA-N 349.734 1.044 5 50 EDBA Cc1c(CC(=O)N2CCC(n3ccnn3)CC2)cccc1[N+](=O)[O-] 163387904 CWPKTXYZSPSAJO-UHFFFAOYSA-N 329.360 1.901 5 50 EDBA O=[N+]([O-])c1ccc2nc(NCCCN=c3nccc[nH]3)cnc2c1 1875303289 LDMHJVHDYXZNLV-UHFFFAOYSA-N 325.332 1.664 5 50 EDBA C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCS1(=O)=O 170613682 CTFGJJIEUHYYAW-VIFPVBQESA-N 346.792 1.897 5 50 EDBA COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc2nn[nH]c2c1 408513094 XFWCRQKXYBXDET-UHFFFAOYSA-N 349.328 1.676 5 50 EDBA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 195257 AZBCCXGNYMFLNL-ZDUSSCGKSA-N 349.299 1.467 5 50 EDBA O=C(NC(=S)N[C@H]1CCSC1=O)c1cccc([N+](=O)[O-])c1 2905841 HEPSVFJQQOUWQL-VIFPVBQESA-N 325.371 1.231 5 50 EDBA O=C(Nc1ccccc1)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1 3122279 OTHJFTRLOFIPPI-CABCVRRESA-N 331.328 1.811 5 50 EDBA O=[N+]([O-])[C@H]([C@@H]1NCCc2ccccc21)S(=O)(=O)c1ccccc1 4408828 DKQXXLNKHXUAAR-CVEARBPZSA-N 332.381 1.950 5 50 EDBA C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)CC(=O)O 262162283 CTTIWZOHIJJLJL-JTQLQIEISA-N 332.316 1.621 5 50 EDBA NC1C[C@@H]2CCC[C@H](C1)C2NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 170091475 SHUFDVAIHZCMOU-QOARYFPJSA-N 339.417 1.779 5 50 EDBA Cc1cc([C@@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)ccc1F 135264875 ZWZMYCVHCJTSBR-ZDUSSCGKSA-N 334.307 1.979 5 50 EDBA COC(=O)[C@H]1C(=O)[C@H](C(=O)c2ccc([N+](=O)[O-])cc2)C(=O)CC1(C)C 100319433 OZFPJTMBFYINOL-QWHCGFSZSA-N 347.323 1.751 5 50 EDBA O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCN2CCC[C@H]2C1 241884836 SYFSJSMSWFYJMO-LBPRGKRZSA-N 344.375 1.461 5 50 EDBA CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(CC)c1=N 100627702 UHRPDAQXTSJHDS-UHFFFAOYSA-N 326.356 1.634 5 50 EDBA O=[N+]([O-])c1c[nH]nc1-c1nc2c3cnn(-c4ccccc4)c3ncn2n1 17072214 PFZIOVJWVFQVCH-UHFFFAOYSA-N 347.298 1.762 5 50 EDBA O=C(NCc1ccco1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4821433 OOQJJDYDPICUOX-UHFFFAOYSA-N 331.328 1.954 5 50 EDBA C[C@@H]1c2cc(F)ccc2CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 229349815 OZDZGEKIDAEYTI-IAQYHMDHSA-N 334.351 1.911 5 50 EDBA O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccn(Cc2ccccc2)n1 2735529 YHNHZCRDUURLES-UHFFFAOYSA-N 326.316 1.675 5 50 EDBA O=[N+]([O-])c1cccc(S(=O)(=O)n2cc(Br)cn2)c1 2776090 PCGCKIKTSYMADE-UHFFFAOYSA-N 332.135 1.791 5 50 EDBA Cn1nc(-c2ccc(NCCO)c([N+](=O)[O-])c2)c2ccccc2c1=O 4164300 NZICPCXMVLOVQR-UHFFFAOYSA-N 340.339 1.913 5 50 EDBA COc1cccc(CN2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)c1 20028668 IWTYRXZLFJEIGR-UHFFFAOYSA-N 345.359 1.285 5 50 EDBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](n2ccnn2)C1 874433836 SIMFJDFMZABNKW-LBPRGKRZSA-N 337.361 1.130 5 50 EDBA CC(C)[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ncc[nH]1 225837949 GUAUOHJMAIWGJY-GFCCVEGCSA-N 331.332 1.770 5 50 EDBA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1OC 42032 ZCGLGAOBEHCNKZ-ZDUSSCGKSA-N 335.316 1.794 5 50 EDBA Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](CN)C3(CCOCC3)C2)c1 449689184 JCGGBBNKRIGPDJ-ZDUSSCGKSA-N 333.388 1.731 5 50 EDBA O=[N+]([O-])c1ccc(NCCc2cn([C@@H]3CCOC3)nn2)c([N+](=O)[O-])c1 1775992315 SDPNVLWZGLKRKS-GFCCVEGCSA-N 348.319 1.711 5 50 EDBA C[C@H](C(=O)N(C)C)S(=O)(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 170617718 XXJLUMVUUUXWFX-SSDOTTSWSA-N 335.769 1.467 5 50 EDBA COC(=O)[C@]1(C)CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C 281899567 AEJACDGKFNDFAM-QLJPJBMISA-N 335.360 1.325 5 50 EDBA Cc1cc(C)nc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)n1 5537302 ZVFFCKIGXXQCHT-UHFFFAOYSA-N 341.371 1.964 5 50 EDBA CCOc1c(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cccc1OC 4954829 JNHCXUDUMVKARB-BQYQJAHWSA-N 333.300 1.961 5 50 EDBA CC[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)O 236960552 XWTBCZITTAEHSL-MRVPVSSYSA-N 331.122 1.950 5 50 EDBA CCN(C)C[C@H]1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 174024634 YWXHJKBHHLNTGU-CQSZACIVSA-N 341.433 1.698 5 50 EDBA CN1Cc2nncn2C[C@H]1c1nc(-c2cccc([N+](=O)[O-])c2)no1 952892525 ACYXOJXTXQVWFL-NSHDSACASA-N 327.304 1.423 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CCNCC3)CC2)cc1 391891272 BGDMJXJAKXXPMK-UHFFFAOYSA-N 339.417 1.749 5 50 EDBA CN1CCC2(CC1)CN(S(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)C2 1775994070 RSSIGHZILAEXCG-UHFFFAOYSA-N 341.389 1.017 5 50 EDBA CC(C)CN(C)C(=O)[C@@H]1CO[C@H](CNc2ncccc2[N+](=O)[O-])C1 2332237935 RHZGIVLLTNZUSF-STQMWFEESA-N 336.392 1.921 5 50 EDBA C[C@@H]1C(=O)NCCN1Cc1ccc(Br)c([N+](=O)[O-])c1 123015126 BEFPSMPBBSVPSH-MRVPVSSYSA-N 328.166 1.678 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cnc3c(c2)COCC3)cc1 239762532 CLXKKOHQMDFFFI-UHFFFAOYSA-N 335.341 1.863 5 50 EDBA C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC2(CC1)OCCO2 20606261 OCRVDHUHKFAYKC-LBPRGKRZSA-N 336.344 1.728 5 50 EDBA CC[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)NC(=O)OC(C)(C)C 295359269 BIYAHJHDNTXMFA-JTQLQIEISA-N 341.368 1.211 5 50 EDBA COCc1noc(CN2CCN(c3ccc(C)cc3[N+](=O)[O-])CC2)n1 275841019 PXTRAYKOHPCQJB-UHFFFAOYSA-N 347.375 1.755 5 50 EDBA O=C(Nc1ncccc1O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 408513967 USSHTGDMIDXWCY-ZDUSSCGKSA-N 328.284 1.827 5 50 EDBA CC(C)=CC(=O)NCCCNc1ncnc2ccc([N+](=O)[O-])cc12 408515649 NKUASPFZOBGFQJ-UHFFFAOYSA-N 329.360 2.422 5 50 EDBA O=C(NCCCN1CCOCC1)c1cc(Cl)ccc1[N+](=O)[O-] 19850968 AAZQIRSLSBHXGV-UHFFFAOYSA-N 327.768 1.700 5 50 EDBA CCN=c1[nH]c(C)c(C(=O)NCc2ccc(O)c([N+](=O)[O-])c2)s1 2325862750 GWYGSBVPBCILPZ-UHFFFAOYSA-N 336.373 1.849 5 50 EDBA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1OC 365684 PAMXUOFLAITYAW-ZDUSSCGKSA-N 335.316 1.747 5 50 EDBA Cc1ccnc(N[C@@H]2CC(=O)N(C3CCN(C)CC3)C2)c1[N+](=O)[O-] 1776005243 DWSRTONTEPIKJS-GFCCVEGCSA-N 333.392 1.405 5 50 EDBA Cc1c(F)cc(S(=O)(=O)N(C)[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] 170598918 LHPAIMILFCLDHF-NSHDSACASA-N 345.396 1.757 5 50 EDBA Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC(CN2CCOCC2)CC1 180663656 CVAJPWQWTPVZBI-UHFFFAOYSA-N 348.403 1.361 5 50 EDBA Cc1nn2c(CN3CCOCC3)nnc2c2cc([N+](=O)[O-])ccc12 20386023 XNRXQOSCECYNSQ-UHFFFAOYSA-N 328.332 1.326 5 50 EDBA CC[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(=O)O 237048874 XWTBCZITTAEHSL-QMMMGPOBSA-N 331.122 1.950 5 50 EDBA COC(=O)c1ccc(CNC(=O)Cn2nc([N+](=O)[O-])cc2C)cc1 4745701 SPDTYELATNFFTF-UHFFFAOYSA-N 332.316 1.203 5 50 EDBA Cc1cc(S(=O)(=O)NCCN2CC=CCC2)ccc1[N+](=O)[O-] 253419533 OOFDYPKYVUGDDQ-UHFFFAOYSA-N 325.390 1.443 5 50 EDBA CCc1cc(N2CCN[C@H](CO)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 952993309 WUIOGQBSKIUKLA-AWEZNQCLSA-N 343.387 1.385 5 50 EDBA CNS(=O)(=O)c1ccc(N[C@@H](C)c2cc[nH]n2)c([N+](=O)[O-])c1 408515578 NWZMBJXQSQBPNE-QMMMGPOBSA-N 325.350 1.399 5 50 EDBA CC(C)c1nc2n(n1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)CC2 188325574 BNGQNIXWHWVIHF-SNVBAGLBSA-N 344.375 1.637 5 50 EDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(=O)[C@@]1(C)CCOC1 789476835 YOSJRHWDCUOANQ-ZDUSSCGKSA-N 328.346 1.135 5 50 EDBA C[C@@H]1CCCN(c2nc(N)c([N+](=O)[O-])c(NC[C@H]3CCCO3)n2)C1 238900833 KJDPUVLSGPVBIR-GHMZBOCLSA-N 336.396 1.794 5 50 EDBA O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(CCO)CC2)o1 4985576 HGIFHLLNXIQDKU-UHFFFAOYSA-N 331.372 1.965 5 50 EDBA CC(C)(C)[C@H](CCO)NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 183671171 XZCIMUFKMKNSID-HNNXBMFYSA-N 335.404 1.871 5 50 EDBA Cn1ncnc1CCNC(=O)c1c[nH]c2c(ccc3ccccc32)c1=O 221219791 AJZRTWDKLLDTSL-UHFFFAOYSA-N 347.378 1.782 5 50 EDBA Cc1c(=O)n(OCc2ccc([N+](=O)[O-])cc2)c2ccccc2[n+]1[O-] 2845955 QXXPNEGHVSTQPI-UHFFFAOYSA-N 327.296 1.480 5 50 EDBA CCOC(=O)c1n[nH]c2c1C(=O)N(c1cccc([N+](=O)[O-])c1)C2=O 451420 XTQIHESRPUOTHM-UHFFFAOYSA-N 330.256 1.295 5 50 EDBA CC1(C)Cc2cccc(OC[C@H](O)Cn3cc([N+](=O)[O-])cn3)c2O1 152915865 IFAVHONZFNBGKF-CYBMUJFWSA-N 333.344 1.945 5 50 EDBA NC1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)c1ccc([N+](=O)[O-])cc1 170051075 RKFVQXGDIPUICG-VGPLMAKISA-N 325.390 1.628 5 50 EDBA O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1NCc1cc[nH]n1 170624660 YUXSDLKNARLYSW-UHFFFAOYSA-N 332.288 1.926 5 50 EDBA CC1=NN(C(=O)[C@@H](C)Oc2ccccc2[N+](=O)[O-])[C@](O)(C(F)F)C1 6849432 GIXXWTOCRKPIFE-YMTOWFKASA-N 343.286 1.924 5 50 EDBA COC(=O)c1cc(C)nc(NC[C@@H](C)c2nncn2C)c1[N+](=O)[O-] 253415482 IMZARDQYWWXQJX-MRVPVSSYSA-N 334.336 1.429 5 50 EDBA CN(C)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 109839983 FKVYPIIORLOZOD-LLVKDONJSA-N 347.824 1.963 5 50 EDBA CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCOCCOCCO2 3899071 HWGMJZKGTKFCKS-UHFFFAOYSA-N 326.305 1.358 5 50 EDBA O=[N+]([O-])c1ccc(Cn2nnnc2S(=O)(=O)c2ccccc2)cc1 4806613 FJHPDYNWCVFFRV-UHFFFAOYSA-N 345.340 1.462 5 50 EDBA O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cccc(-n2cn[nH]c2=O)c1 152684588 ZSUNCOXMULNRSR-UHFFFAOYSA-N 339.311 1.650 5 50 EDBA C[C@H](O)CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 225425666 VGKOUZLEGLJKDC-MNOVXSKESA-N 325.340 1.261 5 50 EDBA Cc1ccc(S(N)(=O)=O)cc1NC(=O)c1cccc([N+](=O)[O-])c1 4902762 SKNGOSODUXDPDV-UHFFFAOYSA-N 335.341 1.803 5 50 EDBA C[C@@H]1C[C@H](CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1 271268056 MVJIVEURCFPBLF-DGCLKSJQSA-N 328.390 1.829 5 50 EDBA CC(=O)c1cc(NC[C@@H]2CCN(S(C)(=O)=O)C2)ccc1[N+](=O)[O-] 225822769 BHVQJQAREHPEQM-NSHDSACASA-N 341.389 1.491 5 50 EDBA O=C(C[C@H](NCc1ccco1)C(=O)O)Nc1cccc([N+](=O)[O-])c1 4280070 AHXPNBIDKBOPNB-ZDUSSCGKSA-N 333.300 1.759 5 50 EDBA Cn1cccc1[C@@H]1COCCN1CCn1cc([N+](=O)[O-])ccc1=O 131659925 BVSHAMCQGWEPOJ-HNNXBMFYSA-N 332.360 1.169 5 50 EDBA Cc1cc(O)nc(N2CC[C@@H](Nc3cc(C)c([N+](=O)[O-])cn3)C2)n1 952994690 TZJVZWHYSKTMJE-LLVKDONJSA-N 330.348 1.793 5 50 EDBA O=C(N[C@H](CO)CC1OCCO1)c1ccc([N+](=O)[O-])c(Cl)c1 952993621 ICFIDAINDLQHRL-VIFPVBQESA-N 330.724 1.102 5 50 EDBA Nc1c(C(=O)N2CCNC(=O)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] 176313180 LWFXPKDQHMDNGP-OAHLLOKOSA-N 340.339 1.490 5 50 EDBA CN1CCc2ncnc(NCCNc3ccccc3[N+](=O)[O-])c2C1 299545169 AWJOVNXXAKKRCY-UHFFFAOYSA-N 328.376 1.897 5 50 EDBA COC(=O)c1ccc([N+](=O)[O-])c(NC2CN(c3ccccn3)C2)n1 1161326226 ZFIJWUHLIRTGGD-UHFFFAOYSA-N 329.316 1.472 5 50 EDBA CCCS(=O)(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 19842773 MUGVAGINEMPZRJ-UHFFFAOYSA-N 327.406 1.452 5 50 EDBA CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 34926367 NXOJDWWMFVLDHT-ZIAGYGMSSA-N 347.371 1.600 5 50 EDBA CCn1nc(C)c([N+](=O)[O-])c1N1CCC(C)(C)S(=O)(=O)CC1 192926889 ZOVSHHHTKGCTRX-UHFFFAOYSA-N 330.410 1.523 5 50 EDBA CS[C@H](CO)[C@@H](C)NS(=O)(=O)c1cc(C)c(C)c([N+](=O)[O-])c1 318722710 SGURYGWFQXLCMJ-ZWNOBZJWSA-N 348.446 1.602 5 50 EDBA CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)[C@@H]1c1ccccc1 348426796 XNGYXRZGHXJYFC-MRXNPFEDSA-N 341.323 1.913 5 50 EDBA O=C(O)[C@H]1[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]2C=C[C@H]1O2 239173900 OWPVEEOWFPPUHS-DDHJBXDOSA-N 338.703 1.841 5 50 EDBA CS[C@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1N(C)C 270674057 SDDHUOZBBZBYDN-KGLIPLIRSA-N 338.433 1.171 5 50 EDBA COc1cc([N+](=O)[O-])cnc1N1CCC[C@H](CN2CCOCC2)C1 863949093 GQWCCFSIIZJKMQ-CYBMUJFWSA-N 336.392 1.547 5 50 EDBA CN(C)c1noc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1 185244625 WWUHXYLCKNAGPV-UHFFFAOYSA-N 332.364 1.366 5 50 EDBA COC(=O)[C@H](CC(C)C)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2990920 COJXSYLDYLWOKY-JTQLQIEISA-N 330.362 1.461 5 50 EDBA CCC[C@H](O)[C@@H](CO)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 416991570 QPUSSJSLKMKSKO-PWSUYJOCSA-N 327.337 1.247 5 50 EDBA Cc1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 6413219 CLOHEBDBGUFXFV-UHFFFAOYSA-N 342.315 1.368 5 50 EDBA Cn1cnc([N+](=O)[O-])c1-c1nnc(Nc2ccc3c(c2)OCO3)o1 12428207 JPHXYUITPBXBFX-UHFFFAOYSA-N 330.260 1.851 5 50 EDBA O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccc(-n2cccn2)cc1 1009308 DPGVBDULXJAGPN-UHFFFAOYSA-N 326.316 1.293 5 50 EDBA O=[N+]([O-])c1cc(Cl)c(Cl)cc1NCCN(CCO)CCO 4760359 CNQWRZRBVOAZQM-UHFFFAOYSA-N 338.191 1.600 5 50 EDBA O=[N+]([O-])c1ccc(S(=O)(=O)N2CCNC[C@@H]2c2ccccc2)cc1 313378068 NANBTHLAZGIWKC-MRXNPFEDSA-N 347.396 1.930 5 50 EDBA Cc1cc(N(C)Cc2nnc3c(=O)n(C)ccn23)ccc1[N+](=O)[O-] 952992842 SIFIVCMCQXKUEM-UHFFFAOYSA-N 328.332 1.281 5 50 EDBA Cc1ccc(C)c(S(=O)(=O)NCCc2ccnn2C)c1[N+](=O)[O-] 170611305 IIGFTDQAWDOKPS-UHFFFAOYSA-N 338.389 1.466 5 50 EDBA NC[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCCCC1 237936153 GWZBGKIRFDDKHZ-LBPRGKRZSA-N 327.406 1.781 5 50 EDBA CNS(=O)(=O)c1ccc(N[C@H](C)c2cc[nH]n2)c([N+](=O)[O-])c1 408515577 NWZMBJXQSQBPNE-MRVPVSSYSA-N 325.350 1.399 5 50 EDBA O=C(c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccco2)CC1 477221 JXEKVQADIJGADP-UHFFFAOYSA-N 329.312 1.786 5 50 EDBA COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cc([N+](=O)[O-])ccc1OC 365681 PAMXUOFLAITYAW-CYBMUJFWSA-N 335.316 1.747 5 50 EDBA COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(C)nc1O 359639575 NSLTUNQUXFEUCR-UHFFFAOYSA-N 339.329 1.813 5 50 EDBA C[C@@]1(c2ccccc2)COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 408515227 KCUQOIMKILDCPA-INIZCTEOSA-N 330.344 1.566 5 50 EDBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccncc2)CC1 19782495 WIFDRYNKKZFEAH-UHFFFAOYSA-N 326.356 1.948 5 50 EDBA COC[C@@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 19300912 USCJKDUSKMNBTO-LBPRGKRZSA-N 329.784 1.378 5 50 EDBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OCCO)C1 229590186 IJTZXZUOUBDLOU-SWLSCSKDSA-N 337.376 1.395 5 50 EDBA COc1cc(C(=O)NCC2(n3cccn3)CC2)c([N+](=O)[O-])cc1OC 952879608 JZEJHJZXMLECPF-UHFFFAOYSA-N 346.343 1.728 5 50 EDBA CCCS(=O)(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 120151 QLGJOROLZMRFHO-UHFFFAOYSA-N 341.389 1.092 5 50 EDBA CCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(CC)c1=N 100627710 GVSAJCKRQIGBFQ-UHFFFAOYSA-N 325.372 1.207 5 50 EDBA O=C1CC[C@@H]([N+](=O)[O-])[C@@H](c2cc3c(cc2Br)OCO3)N1 112069 PRJGMUUNRHWKBF-PRHODGIISA-N 343.133 1.774 5 50 EDBA CN(C)S(=O)(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4499104 MNAJLIJXEGJATC-UHFFFAOYSA-N 348.812 1.177 5 50 EDBA CCn1cnnc1[C@@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])CCO1 370050360 PNNVLIYUMAGMAH-ZDUSSCGKSA-N 345.359 1.728 5 50 EDBA CC(C)c1[nH]nc(C(=O)NC[C@@]2(N(C)C)CCSC2)c1[N+](=O)[O-] 269524690 QXONTVLQCGRQBE-AWEZNQCLSA-N 341.437 1.608 5 50 EDBA COC(=O)c1nc(N2CC[C@@H](C)C2)nc(N2CC[C@@H](C)C2)c1[N+](=O)[O-] 408524544 VMIWQWIIPHLQDT-GHMZBOCLSA-N 349.391 1.864 5 50 EDBA C[C@@H]1CCSCCN1c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 170611258 AVVIUWQIKNXNCW-SECBINFHSA-N 331.419 1.574 5 50 EDBA Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC(=O)[C@]1(C)CCOC1 789476827 YOSJRHWDCUOANQ-CYBMUJFWSA-N 328.346 1.135 5 50 EDBA CC(=O)OC(OC(C)=O)(c1ccc([N+](=O)[O-])cc1)c1ncccn1 12364489 LZUJWJSJVNJGJS-UHFFFAOYSA-N 331.284 1.712 5 50 EDBA Cc1cn2ccnc(C(=O)OCCn3c([N+](=O)[O-])cnc3C)c2n1 170614531 NJNGAQZAJLZMON-UHFFFAOYSA-N 330.304 1.308 5 50 EDBA COC(=O)c1ccc(C(=O)OC)c(Nc2ncnc(N)c2[N+](=O)[O-])c1 3912602 CVDGFHMKDPLKLO-UHFFFAOYSA-N 347.287 1.284 5 50 EDBA COc1cc([N+](=O)[O-])ccc1NC(=O)NCCCN1CCCC1=O 15952125 AJAZJXWTAQUBRR-UHFFFAOYSA-N 336.348 1.737 5 50 EDBA C[C@@]1(NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CCO[C@H]1C1CC1 273085949 LYTMYJRGQBMQHJ-LSDHHAIUSA-N 340.401 1.972 5 50 EDBA CCc1[nH]nc(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)c1[N+](=O)[O-] 192670357 QXSJPFNWACUSQR-VXGBXAGGSA-N 332.364 1.991 5 50 EDBA COc1cc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc(OC)c1O 4614465 IKYRNCXEHOBFQO-ONEGZZNKSA-N 335.272 1.277 5 50 EDBA COC(=O)c1nn(Cc2ccc([N+](=O)[O-])c(F)c2)c(C)c1[N+](=O)[O-] 2325704777 BYQHTEPDYCYOEV-UHFFFAOYSA-N 338.251 1.982 5 50 EDBA COc1ccc(CNC(=O)Cn2nc([N+](=O)[O-])cc2C)cc1OC 1432156 DYPDBDUKDTTXHJ-UHFFFAOYSA-N 334.332 1.433 5 50 EDBA CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NC[C@H]1CCCOC1 408519382 NVSFUFQQECIRTA-SNVBAGLBSA-N 339.323 1.849 5 50 EDBA CCS(=O)(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4123209 CHTSOWAARCPADO-UHFFFAOYSA-N 333.797 1.720 5 50 EDBA CCCN(C(C)=O)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-] 25667618 ANVVJEDCJAXKRJ-UHFFFAOYSA-N 345.333 1.669 5 50 EDBA CC[C@@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@@]45C[C@@H]([C@@H]2[C@@H]5O)[N@+]3(C)[C@@H]1O 1772493026 NCFABVDNFAPWSM-XICIDLFTSA-N 341.475 1.699 5 50 EDBA O=C1c2ccccc2C(=O)N1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 138792 ATIWCAHFERTOSJ-UHFFFAOYSA-N 337.247 1.402 5 50 EDBA C[C@]1(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCO[C@H]1C1CC1 282442146 GWBOSLDCWDGPKC-KBPBESRZSA-N 326.374 1.831 5 50 EDBA CS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4543485 RCVMSWWHWPRDBT-UHFFFAOYSA-N 340.405 1.251 5 50 EDBA O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccc([N+](=O)[O-])o1 112260793 AYYXXTXXWXUNQW-SNVBAGLBSA-N 333.275 1.862 5 50 EDBA O=C(CCN1C(=O)c2ccncc2C1=O)Nc1cccc([N+](=O)[O-])c1 13331105 IECRNSUIEKEPPB-UHFFFAOYSA-N 340.295 1.615 5 50 EDBA NC[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 725374856 RUEWYEDTSFAUGS-NSHDSACASA-N 333.369 1.846 5 50 EDBA CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)[C@@H](O)c1ccccc1 408517542 KFXIJBCFJSVRMG-BLLLJJGKSA-N 332.360 1.762 5 50 EDBA Cc1nc(C[C@@H]2CCCN(C(=O)c3cnc(O)c([N+](=O)[O-])c3)C2)no1 193546822 JCNIHHNALBHZDR-JTQLQIEISA-N 347.331 1.482 5 50 EDBA O=C(CCCn1ccc([N+](=O)[O-])n1)NCc1nc2ccccc2[nH]1 4625271 DRWNMWXISCCJSI-UHFFFAOYSA-N 328.332 1.764 5 50 EDBA CS(=O)(=O)c1ccc2c(c1)CCN(c1ncccc1[N+](=O)[O-])CC2 328586430 SJTMQGBRFQVNIZ-UHFFFAOYSA-N 347.396 1.999 5 50 EDBA Cn1ccc([C@@H]2C[C@H]2NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)n1 1775999404 QRYFHLUUFOWSIS-TVQRCGJNSA-N 326.316 1.491 5 50 EDBA O=C(CN1C(=O)c2ccccc2C1=O)Nc1cccc([N+](=O)[O-])c1 102084 IXLBXRJLVSNXEY-UHFFFAOYSA-N 325.280 1.830 5 50 EDBA CCOC(=O)C1=C(C)NC(=O)C[C@H]1c1cc2c(cc1[N+](=O)[O-])OCO2 248112 ONSVDTZWFKUWJX-JTQLQIEISA-N 348.311 1.764 5 50 EDBA O=C(c1cccc([N+](=O)[O-])c1)N1CCN(C(=O)N2CCCCC2)CC1 614541 IEMJFZSSRBZCER-UHFFFAOYSA-N 346.387 1.959 5 50 EDBA CN(C)C(C)(C)CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CCC[C@@H]1O 170613460 WFWWHVAXKYDTIF-KBPBESRZSA-N 338.408 1.619 5 50 EDBA C[C@H](CC1CC1)NC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 112751970 XODKOTKLDHCKSS-VCTAVGKDSA-N 337.376 1.477 5 50 EDBA CCS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC)c2)CC1 4688308 SFGKMNIXKHAKHE-UHFFFAOYSA-N 328.394 1.108 5 50 EDBA CNc1ccc(C(=O)N(C)[C@@]2(C)CCS(=O)(=O)C2)cc1[N+](=O)[O-] 4759679 FOSDADLFRZKLEQ-AWEZNQCLSA-N 341.389 1.286 5 50 EDBA Cc1cc(N2CCC[C@H](Nc3ncc([N+](=O)[O-])c(N)n3)C2)nc(C)n1 377576986 INNLAJIQCAEADE-NSHDSACASA-N 344.379 1.455 5 50 EDBA COCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-] 17068739 AZKDAZSUIQKBHM-GFCCVEGCSA-N 334.328 1.662 5 50 EDBA Cc1nn([C@H](C)C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1Cl 2782533 KMHYRGSIRJFEAL-SECBINFHSA-N 326.744 1.327 5 50 EDBA CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H](c1cncn1C)N(C)C 239619614 BFTYXMYXWXQUQB-OAHLLOKOSA-N 331.376 1.590 5 50 EDBA CN(Cc1ccccc1)C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 288357719 KMJLPDXOAIJJQH-UHFFFAOYSA-N 329.360 1.134 5 50 EDBA O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C2OCCO2)C1 169979948 LLFLOYFCQYRSLF-CYBMUJFWSA-N 335.360 1.889 5 50 EDBA CN(C)[C@H]1CCC[C@@H]1Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 170606496 NVOSLKJQXNMCBK-JQWIXIFHSA-N 328.394 1.137 5 50 EDBA Cc1nn(CCNC(=O)c2cccc([N+](=O)[O-])c2)c(C)c1[N+](=O)[O-] 2796416 KZVNJMRHZRDQRC-UHFFFAOYSA-N 333.304 1.746 5 50 EDBA