smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1[nH]c2ccc(F)cc2c1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3624531 HROYKUUQJQTILM-UHFFFAOYSA-N 386.339 3.404 5 50 GGBA biogenic,in-vitro CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 1168750 IUYBHPNUCMTLDS-QGZVFWFLSA-N 385.376 3.354 5 50 GGBA O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(Cl)c1N1CCOCC1 1065248 JQLFYXGZIXZKCU-UHFFFAOYSA-N 391.811 3.102 5 50 GGBA O=C(Nc1ncc(Cc2cccc([N+](=O)[O-])c2)s1)[C@H]1COc2ccccc2O1 5016772 IVMZINMYKORYAH-QGZVFWFLSA-N 397.412 3.421 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(c1ccccc1O)C2=O 1085686 XQEVRCTVSAQGOR-UHFFFAOYSA-N 388.335 3.332 5 50 GGBA Cc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 4457588 CMSVKCRWWWJZHR-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA O=C(Nc1nc2ccccc2s1)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 2459154 ATCQUQYYNMDXLG-LLVKDONJSA-N 382.401 3.196 5 50 GGBA CCCC(=O)N1CCN(c2cc(N3CCCCC3)c(F)cc2[N+](=O)[O-])CC1 5015262 JGJOYBLUYUYVKF-UHFFFAOYSA-N 378.448 3.173 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(c3nc4ccc([N+](=O)[O-])cc4s3)CC2)cc1 4181789 MBMDBNBBDYCOIS-UHFFFAOYSA-N 385.405 3.439 5 50 GGBA COc1ccc(C2=NN(C(=O)CCC(=O)O)[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 1218236 CGENIAMKIYHNNQ-SFHVURJKSA-N 397.387 3.146 5 50 GGBA COc1ccc(NC(=O)CSc2nccc(C(F)(F)F)n2)c([N+](=O)[O-])c1 6642276 RJCGOOLGJZROCA-UHFFFAOYSA-N 388.327 3.143 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)Nc2nccs2)c1 1148425 VLNDPNIFJYOGTH-UHFFFAOYSA-N 382.401 3.485 5 50 GGBA CC(C)(C)c1csc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)n1 4140069 KEJRIJSRLSSKLT-UHFFFAOYSA-N 390.465 3.438 5 50 GGBA Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cc2c(ccc3ccccc32)oc1=O 4625646 NWPRHKMIODEBIK-UHFFFAOYSA-N 393.355 3.216 5 50 GGBA COC(=O)c1cc(C(=O)Nc2ccc(Br)cc2)cc([N+](=O)[O-])c1 1097979 SLUJCHGTPDRPLF-UHFFFAOYSA-N 379.166 3.396 5 50 GGBA Cc1oc(=O)c(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1C(=O)c1ccccc1 1387878 WMHWDFXFCZHORD-UHFFFAOYSA-N 378.340 3.340 5 50 GGBA COc1cc(N2CCC(N(C)C)CC2)c([N+](=O)[O-])cc1NC(=O)OC(C)(C)C 725538370 LHYBUNYNSGODFU-UHFFFAOYSA-N 394.472 3.481 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccco2)cc1 1206796 ZROJFYPGEHRLBV-UHFFFAOYSA-N 381.344 3.458 5 50 GGBA Cc1cccc(NC(=O)CCC(=O)OCC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 2986808 WXGMYVMXXRWXMG-UHFFFAOYSA-N 384.388 3.356 5 50 GGBA COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2C)c1 4607986 PIYVFQINKGUIPP-UHFFFAOYSA-N 375.406 3.047 5 50 GGBA CS(=O)(=O)c1cnc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(Cl)c1 2325829880 VCXRVSGVVMIMOV-UHFFFAOYSA-N 381.841 3.216 5 50 GGBA CCOc1ccc2c(c1)S[C@@H](CC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N2 5013469 XFFAQIDOTSXFIM-INIZCTEOSA-N 387.417 3.435 5 50 GGBA CS(=O)(=O)N(CC(=O)Nc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1 1135248 GXPILYQBQIOURR-UHFFFAOYSA-N 399.428 3.153 5 50 GGBA CC(=O)Nc1ccc(C(=O)OCC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 1172198 CMZXPLHWUIKVDF-UHFFFAOYSA-N 376.752 3.246 5 50 GGBA CCCCOc1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(N)=O)cc1 2910393 PSOWRFGURHQRHS-QGOAFFKASA-N 383.404 3.030 5 50 GGBA CCN1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2Cl)CC1 809769 GGQOVVCYIKFWMM-UHFFFAOYSA-N 378.816 3.235 5 50 GGBA O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 4543716 BJKGGBZXBVVATO-UHFFFAOYSA-N 380.379 3.245 5 50 GGBA COc1cccc(-n2ccc3nc4ccn(-c5ccccn5)c(=O)c4cc3c2=O)c1 38829460 BWCSPIRMCYGUGJ-UHFFFAOYSA-N 396.406 3.093 5 50 GGBA Cc1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)c([N+](=O)[O-])c1 19788597 FPTHAWWRKWQGQR-HNNXBMFYSA-N 386.385 3.026 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 847279 UKAQQSAQPFVDPS-SFHVURJKSA-N 381.388 3.009 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(S(=O)(=O)N2CCCCC2)cs1 1162763 HNQVFPBCLBJZNO-UHFFFAOYSA-N 395.462 3.083 5 50 GGBA Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(=O)n(-c2ccccc2)n1C 2472801 CJEOISTZLVDNHH-UHFFFAOYSA-N 386.795 3.298 5 50 GGBA O=C(CSc1nc2ccccc2c(=O)n1C1CC1)Nc1cccc([N+](=O)[O-])c1 2800541 HQGSDWHPMSXSRC-UHFFFAOYSA-N 396.428 3.370 5 50 GGBA CCc1ccccc1NC(=O)CCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 3004043 GCOVSCIYROYXBR-UHFFFAOYSA-N 384.388 3.302 5 50 GGBA O=c1oc2ccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2s1 4148287 JKAGCGGNHPBFQY-UHFFFAOYSA-N 386.794 3.217 5 50 GGBA Cc1ccc(N2CC3=C(C2=O)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)cc1C 4753695 APJWNKOACKAGMG-IBGZPJMESA-N 392.415 3.209 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N2CCCCC2)c1 3995574 GCLMTPSHESIMBF-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA CN1C(=O)N[C@@H](c2cccc([N+](=O)[O-])c2)C2=C1CN(c1cccc(Cl)c1)C2=O 4753689 QQZSSVUZAZBIQY-KRWDZBQOSA-N 398.806 3.245 5 50 GGBA O=[N+]([O-])c1cc2c(O)ncnc2cc1NC1CCN(Cc2ccc(F)cc2)CC1 301086266 LQOYTWCIAGEOPK-UHFFFAOYSA-N 397.410 3.459 5 50 GGBA O=C(N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCCC1)c1ccco1 4958075 QSAAPRWQBSKPJO-SAPNQHFASA-N 383.404 3.361 5 50 GGBA O=C(O)C1CCN(C(=O)c2cc(F)cc3c(O)c4cc(F)ccc4nc23)CC1 263267133 NZNSPYAVAAMZDS-UHFFFAOYSA-N 386.354 3.309 5 50 GGBA CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc(O)cc1[N+](=O)[O-] 170595801 UCWQMZPNDOEVOK-QGZVFWFLSA-N 383.448 3.285 5 50 GGBA Cc1ccc(C)c(N2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c1 4190016 UYYVYNOJSXIBML-UHFFFAOYSA-N 389.477 3.031 5 50 GGBA O=[N+]([O-])c1ccccc1SN[C@H](N1CCOCC1)C(Cl)(Cl)Cl 25665953 DPQLJOILMUPKCS-LLVKDONJSA-N 386.688 3.220 5 50 GGBA Cc1ccc2c(c1)CCCN2C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 913125598 UCQIVCPZMPTZRO-OAHLLOKOSA-N 397.406 3.375 5 50 GGBA COc1ccc(NC(=O)CSc2nc(Cc3ccccc3)n[nH]2)c([N+](=O)[O-])c1 4831934 FXPKVWIPBQHTNL-UHFFFAOYSA-N 399.432 3.043 5 50 GGBA CCCN(C[C@H]1CCCCO1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 170622607 BFFHTSXKGZPBJU-QGZVFWFLSA-N 386.452 3.417 5 50 GGBA COc1cc(CN2CCN(Cc3ccccc3C)CC2)c([N+](=O)[O-])cc1OC 865173 HNAVHBKLRFKKAN-UHFFFAOYSA-N 385.464 3.238 5 50 GGBA O=c1c2cc3c(=O)n(-c4ccccn4)ccc3nc2ccn1Cc1ccccc1 30907831 YMUQFKWDDSJCPZ-UHFFFAOYSA-N 380.407 3.144 5 50 GGBA O=[N+]([O-])c1ccc(OC[C@H](O)Cn2c(C(F)(F)F)nc3ccccc32)cc1 4819255 QFAKQPYVTQVNFM-GFCCVEGCSA-N 381.310 3.403 5 50 GGBA O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1CCC(C(=O)O)CC1 6719239 JFMKUABNQSWPOK-UHFFFAOYSA-N 392.455 3.162 5 50 GGBA CCOCCOC(=O)c1cccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1 1774111 AIHCZARYTLRYQY-MDZDMXLPSA-N 384.388 3.440 5 50 GGBA Cn1c2ccccc2c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])nc21 5588879 MOIVSCDWZVNCQA-UHFFFAOYSA-N 394.416 3.156 5 50 GGBA O=c1oc(-c2ccc([N+](=O)[O-])cc2)nc2ccc(I)cc12 1206481 JZFFBPRCTHTNGU-UHFFFAOYSA-N 394.124 3.368 5 50 GGBA COC(=O)c1sc(NC(=O)c2cccc([N+](=O)[O-])c2C)c(C(=O)OC)c1C 2086303 FTDLOZUIJSYYOI-UHFFFAOYSA-N 392.389 3.099 5 50 GGBA CC1=C(C(=O)OCCOc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4913157 NOFPUFQEFGLMFW-QGZVFWFLSA-N 396.399 3.095 5 50 GGBA O=C1[C@H]2CS[C@@H](c3cccc([N+](=O)[O-])c3)N2C(=S)N1c1ccc(F)cc1 4686628 KUXIOXFQKPWCFU-ZBFHGGJFSA-N 389.433 3.482 5 50 GGBA Cc1cc(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)ccc1[N+](=O)[O-] 1152707 PDVFBLRDXKOYAR-UHFFFAOYSA-N 391.449 3.232 5 50 GGBA Cc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1C 4949487 ZUIZBIRSJFUWCW-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA Cc1nn2c(C(=O)O)cc(-c3cccc([N+](=O)[O-])c3)nc2c1Br 20605850 SFQCBUQKUMBDJH-UHFFFAOYSA-N 377.154 3.074 5 50 GGBA Cc1cc(C)c(NC(=S)NC(=O)c2c(Cl)c(C)nn2C)c([N+](=O)[O-])c1 5587392 WAIPNFSAGUOWGE-UHFFFAOYSA-N 381.845 3.034 5 50 GGBA COc1cc(/C=C2/SC(=N)NC2=O)ccc1OCc1ccccc1[N+](=O)[O-] 16667787 IHXGTIFWYCEZCH-CXUHLZMHSA-N 385.401 3.321 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 1164419 ZTIDPVHATSMZAC-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])N2C(=O)[C@H](C)SC2=N1 2463260 OHZSFLMMWBVWGO-XHDPSFHLSA-N 389.433 3.195 5 50 GGBA COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 4457580 FTACWFFSYUBHFK-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C(c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 4499339 SWGLCSKVQGGDNQ-UHFFFAOYSA-N 380.379 3.245 5 50 GGBA CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Cc1cscn1 857570414 SYUJOFVYQZHFAW-UHFFFAOYSA-N 387.421 3.081 5 50 GGBA COc1ccc(-c2nc(NC(C)=O)c3c(=O)oc4ccccc4c3n2)cc1OC 827314 XQPQWSWMFAWHOX-UHFFFAOYSA-N 391.383 3.379 5 50 GGBA biogenic CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)c1ccc([N+](=O)[O-])cc1 1212867 FQUDPKNVCFNKBE-UHFFFAOYSA-N 380.360 3.210 5 50 GGBA Cc1ccc(S(=O)(=O)NCCCNc2ccc([N+](=O)[O-])cc2Cl)cc1 4680154 GFGZBYHAQKOLAI-UHFFFAOYSA-N 383.857 3.337 5 50 GGBA COc1ccc(C(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 5107144 VOXCRKYULNEGSY-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2cccc([N+](=O)[O-])c2)cc1 845592 UWKQUUKBOFTXQN-SFHVURJKSA-N 396.403 3.260 5 50 GGBA O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 19683129 QJOVZAWUFCCJJZ-UHFFFAOYSA-N 375.812 3.333 5 50 GGBA COc1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)c([N+](=O)[O-])c1 4368358 MCTVXFNJAKZKDZ-UHFFFAOYSA-N 384.344 3.036 5 50 GGBA COc1ccc(COC(=O)C2=C(C)NC(=O)C[C@H]2c2cccc([N+](=O)[O-])c2)cc1 4916737 UAQFXJSGDUCXKU-SFHVURJKSA-N 396.399 3.224 5 50 GGBA CCC[C@@H]1[C@@H]2C(=O)N(c3ccccc3[N+](=O)[O-])C(=O)[C@@H]2ON1c1ccccc1 137721102 SRVKUUHUJMQTIZ-FGTMMUONSA-N 381.388 3.073 5 50 GGBA COc1ccc(CCNc2c([N+](=O)[O-])c(=O)n(C)c3ccccc23)cc1OC 4501582 WJKFVFLWRNYSBC-UHFFFAOYSA-N 383.404 3.119 5 50 GGBA O=C1[C@H]2[C@H](C(=O)N1c1ccc(Br)cc1[N+](=O)[O-])[C@H]1C=C[C@H]2C12CC2 101197838 YIYRSRIZYGXCCZ-DMTCVQMQSA-N 389.205 3.059 5 50 GGBA COc1ccccc1-n1ccc2nc3ccn(-c4ccccn4)c(=O)c3cc2c1=O 38829458 RTXJPJWUZPOJNJ-UHFFFAOYSA-N 396.406 3.093 5 50 GGBA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccccc2[N+](=O)[O-])ccc1C 4833088 ZFEDSLFHTXUCKD-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccnn1Cc1ccc(F)cc1 170609209 SBPLHVPQPXDCFG-UHFFFAOYSA-N 390.396 3.088 5 50 GGBA Cc1nn(C)c(C(=O)NC(=S)Nc2ccc(Cl)cc2[N+](=O)[O-])c1Cl 4651753 MZRFMRFDXODGMB-UHFFFAOYSA-N 388.236 3.070 5 50 GGBA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 1136180 UHWIUFPDIVBHKB-UHFFFAOYSA-N 394.767 3.304 5 50 GGBA O=C(CSCc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccccc2F)CC1 980315 GHFIAFIQXNCCDC-UHFFFAOYSA-N 389.452 3.316 5 50 GGBA Cn1cc(C(=N)O)c([C@@H]2CCCN(c3cc4c(cc3[N+](=O)[O-])CCC(O)=N4)C2)n1 328607390 WBJRZVWLRVWQDY-GFCCVEGCSA-N 398.423 3.130 5 50 GGBA O=C(NCc1cccnc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 13282172 IUJPOPNAMUSXDU-UHFFFAOYSA-N 376.372 3.172 5 50 GGBA CCOC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(OCC)cc1 4653348 PUSMRUYBNPCMKX-GOSISDBHSA-N 386.404 3.418 5 50 GGBA O=C(Nc1ccco1)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 6270536 VSQPMTARSUBLKK-UHFFFAOYSA-N 387.373 3.241 5 50 GGBA CO[C@@H]1C[C@@H]2[C@@H](C[C@@]1(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2(C)C 100392682 LKISZDGHIQPGMP-ATNYBXOESA-N 378.381 3.500 5 50 GGBA biogenic,in-vitro Cc1nc([N+](=O)[O-])c(N2CCN(Cc3ccccc3)CC2)n1Cc1ccccc1 55523271 SLGLZGLQGHNCRZ-UHFFFAOYSA-N 391.475 3.470 5 50 GGBA COC(=O)c1cccc([N+](=O)[O-])c1CN1CCN(c2c(C)cccc2C)CC1 59846822 GECZCJFICUIMSI-UHFFFAOYSA-N 383.448 3.320 5 50 GGBA O=C1[C@@H]2[C@H](C(=O)N1c1ccc(Br)cc1[N+](=O)[O-])[C@H]1C=C[C@H]2C12CC2 101197833 YIYRSRIZYGXCCZ-MHWZDGSBSA-N 389.205 3.059 5 50 GGBA CN(C(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1)C12CC3CC(CC(C3)C1)C2 4180060 CWWANCWAHGHPAH-UHFFFAOYSA-N 384.436 3.473 5 50 GGBA O=c1c2cc3c(=O)n(-c4ccncc4)ccc3nc2ccn1CCc1ccccc1 36367076 CFTFHGAXPQTVBJ-UHFFFAOYSA-N 394.434 3.338 5 50 GGBA O=C(O)C[C@H]1CCCN1C(=O)c1cc(F)cc2c(O)c3cc(F)ccc3nc12 262998423 QXWMLDNNAOYJPU-GFCCVEGCSA-N 386.354 3.451 5 50 GGBA CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2O)nnc1-c1ccccc1 4870023 MCTDWPRVWSPEED-UHFFFAOYSA-N 399.432 3.310 5 50 GGBA O=C(CSc1nc(-c2cccc([N+](=O)[O-])c2)cs1)NC[C@H]1CCCO1 2890895 OTLQOSXXZJCAGN-CYBMUJFWSA-N 379.463 3.106 5 50 GGBA CC(C)OC(=O)c1c(NC(=O)c2nn(C)cc2[N+](=O)[O-])sc2c1CCCC2 892519 ZXVWKGNNDQQQAP-UHFFFAOYSA-N 392.437 3.086 5 50 GGBA COCCN(CCOC)c1nc(-c2ccc([N+](=O)[O-])cc2)nc2ccccc12 1774819 VTCYCBRQXGEKRM-UHFFFAOYSA-N 382.420 3.304 5 50 GGBA COc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4858295 CSXQPRMBUDIHNO-UHFFFAOYSA-N 391.811 3.346 5 50 GGBA COc1cc2c(cc1OC)[C@@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])CC(=O)N2 4913739 VOTZSQVAULQOSR-JTQLQIEISA-N 388.376 3.103 5 50 GGBA Cc1ccc(OCCNc2cc(N3CCN(C)CC3)ccc2[N+](=O)[O-])cc1C 4663571 TZVFCNLEGRUCCQ-UHFFFAOYSA-N 384.480 3.454 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2[N+](=O)[O-])N2C(=O)[C@@H](C)SC2=N1 2463258 OHZSFLMMWBVWGO-ABAIWWIYSA-N 389.433 3.195 5 50 GGBA CCOc1ccc(NC(=O)C[C@@H]2Nc3cc(C)c(C)cc3NC2=O)c([N+](=O)[O-])c1 4143472 HUCRAAIIVOHMPA-KRWDZBQOSA-N 398.419 3.372 5 50 GGBA Cc1ccccc1N1CCN(c2c([N+](=O)[O-])c(=O)n(C)c3ccccc23)CC1 4819449 LBPVOYROERGAQH-UHFFFAOYSA-N 378.432 3.082 5 50 GGBA CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 74937747 WUXKCMOKDQYLPF-UHFFFAOYSA-N 386.246 3.414 5 50 GGBA in-vitro O=[N+]([O-])c1cc(Br)ccc1-n1ccnc1I 170595681 BNBDIIVUJWMFJI-UHFFFAOYSA-N 393.966 3.148 5 50 GGBA CC(C)C(=O)Nc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 4675736 CIMFDERWQGYJPD-UHFFFAOYSA-N 396.447 3.152 5 50 GGBA Cc1ccc([N+](=O)[O-])c(OCCOCCN2CCN(Cc3ccccc3)CC2)c1 4832269 SEGCPSUMMSJLGJ-UHFFFAOYSA-N 399.491 3.116 5 50 GGBA COC(=O)c1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc(C(=O)OC)c1 1200689 ORHCKKBAYSNNFG-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA COc1ccc([C@@H]2SCCN2S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 4309969 MLTONEKAVWQAAP-KRWDZBQOSA-N 394.474 3.348 5 50 GGBA O=[N+]([O-])c1c(Oc2ccc(I)nc2)nc2ccccn12 225472479 MFOPWLPZZNMSAO-UHFFFAOYSA-N 382.117 3.034 5 50 GGBA COc1ccc(S(=O)(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 855069 YWWUASIVCOONIQ-MRXNPFEDSA-N 380.447 3.040 5 50 GGBA CC1=C[C@H](c2ccccc2)n2nc(NC(=O)c3cccc([N+](=O)[O-])c3)nc2N1 100904743 LRQOQSXJANTRQF-MRXNPFEDSA-N 376.376 3.357 5 50 GGBA COc1cc(CN(C)C(=O)c2cc(C)nc(O)c2[N+](=O)[O-])ccc1SC 328590156 XCTRPWZNXVYSJS-UHFFFAOYSA-N 377.422 3.007 5 50 GGBA COc1ccc(C)cc1NC(=S)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 5063020 ZAKSEQAXOLETET-UHFFFAOYSA-N 386.477 3.431 5 50 GGBA CCc1ccc(N2CC3=C(C2=O)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)cc1 4753686 OWEVNPOJMUBFFV-IBGZPJMESA-N 392.415 3.154 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(Cc1cccnc1)C2=O 1208229 ORUCLYMLWZDCQC-UHFFFAOYSA-N 387.351 3.017 5 50 GGBA CCCNC(=S)N1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 4051137 UBWYBMUTVLDYAP-UHFFFAOYSA-N 390.431 3.410 5 50 GGBA Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 253417008 FYRNVIMIGBTMGF-UHFFFAOYSA-N 379.376 3.380 5 50 GGBA O=[N+]([O-])c1cnc(Sc2nnc(-c3ccncc3)[nH]2)c(Br)c1 301567898 WBSSZZMCLOKWCI-UHFFFAOYSA-N 379.199 3.084 5 50 GGBA COC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C(=O)OC)c1C 2084694 ZAAMDPOPVBLVMM-UHFFFAOYSA-N 392.389 3.099 5 50 GGBA Cc1cc(=NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]n1CC(F)(F)F 417605513 YJYDVDGNCBCKQY-UHFFFAOYSA-N 397.357 3.280 5 50 GGBA CC(=O)Oc1ccc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c34)C2=O)cc1 822795 VBSBLNFVVXXVQZ-UHFFFAOYSA-N 376.324 3.474 5 50 GGBA COCc1cc(C)nc2sc(C(=O)Nc3cc([N+](=O)[O-])ccc3O)c(N)c12 36008367 ZRKWUBZDYVOZMY-UHFFFAOYSA-N 388.405 3.199 5 50 GGBA O=C(O)c1ccc(Cl)c(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c1 2828852 LLUGKYFXGKDQNS-UHFFFAOYSA-N 379.781 3.073 5 50 GGBA COc1cccc(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 5090835 LNXBOFGGCWVGNA-UHFFFAOYSA-N 383.326 3.464 5 50 GGBA COc1ccc(C(=O)Oc2ccccc2[N+](=O)[O-])cc1I 674832 NKEBCTLGTZPLJX-UHFFFAOYSA-N 399.140 3.427 5 50 GGBA CC(C)(C)NC(=O)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC1CCCCC1 3966374 LBAPYVMLNHDSLS-UHFFFAOYSA-N 398.485 3.126 5 50 GGBA O=C(NCc1ccccc1)/C(=C\c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1 4844188 HYPORYNNWVFEHU-QGOAFFKASA-N 391.383 3.275 5 50 GGBA CCOC(=O)c1c(NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)sc2c1CCCC2 2758208 XDGZAVGPLZKKNT-JTQLQIEISA-N 392.437 3.108 5 50 GGBA CC(C)c1ccc(NC(=O)CCN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 1125115 IPKKZJHSVURPNT-UHFFFAOYSA-N 381.388 3.343 5 50 GGBA CCOc1ccc(-c2cn(CC(=O)c3cccc([N+](=O)[O-])c3)c(=N)n2C)cc1 334157658 ZERKKMUDKFXBEG-UHFFFAOYSA-N 380.404 3.163 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 1213606 MPCMLDQPUXMPSZ-SFHVURJKSA-N 380.400 3.258 5 50 GGBA Cc1c(Cl)cccc1NC(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 850481 LXDAFLRNEKQETE-UHFFFAOYSA-N 387.779 3.181 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc2c(c1)C(=O)N(CC(C)C)C2=O 4865379 BWDDCXLJJHDIFW-UHFFFAOYSA-N 397.387 3.108 5 50 GGBA CC(C)c1ccc(Nc2c([N+](=O)[O-])nn(-c3ccc4c(c3)OCCO4)[n+]2[O-])cc1 4757970 BXURUAFJPWTSCU-UHFFFAOYSA-N 397.391 3.052 5 50 GGBA CC[C@@H](C)NC(=O)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1ccccc12 11692073 MPXOXOGFYWITGD-GFCCVEGCSA-N 385.427 3.406 5 50 GGBA CCC(=O)NC(=S)Nc1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 1135701 XTCUFGCLKNMWGI-UHFFFAOYSA-N 386.433 3.379 5 50 GGBA O=C1C[C@H](c2ccc3c(c2)OCO3)c2c(-c3cccc([N+](=O)[O-])c3)n[nH]c2O1 4626526 FVBNDBKJJGHDGU-CYBMUJFWSA-N 379.328 3.155 5 50 GGBA COc1ccc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] 2830530 BNUPBCXRWVQOER-UHFFFAOYSA-N 375.406 3.467 5 50 GGBA CCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 2830834 PWAXZOCOEOPBNE-UHFFFAOYSA-N 391.449 3.234 5 50 GGBA COc1ccc([C@@H](CC(=O)O)NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 4594611 GLKFQWBYYXTKCN-CQSZACIVSA-N 378.768 3.203 5 50 GGBA O=C(Cn1cnc2c(Cl)cc(Cl)cc2c1=O)c1cccc([N+](=O)[O-])c1 3121738 PIIKBEOGNUABIZ-UHFFFAOYSA-N 378.171 3.494 5 50 GGBA Cc1sc2ncn3nc(-c4ccc(Cn5cc([N+](=O)[O-])cn5)o4)nc3c2c1C 2790101 BCAMOMNMNVBHFY-UHFFFAOYSA-N 395.404 3.369 5 50 GGBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CNc1ccc(Br)cc1 855982 VTLVGIIHUQLNKI-UHFFFAOYSA-N 376.166 3.023 5 50 GGBA O=C1C[C@@H](c2ccc3c(c2)OCO3)c2c(-c3cccc([N+](=O)[O-])c3)n[nH]c2O1 4626527 FVBNDBKJJGHDGU-ZDUSSCGKSA-N 379.328 3.155 5 50 GGBA CCOc1ccc(N2C[C@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 1875252996 FSDYPLDPHABFIU-CQSZACIVSA-N 383.404 3.009 5 50 GGBA O=C(O[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)c1ccc2c(c1)C(=O)NCC2 2325862077 ILVTXBVRVOSTIM-HNNXBMFYSA-N 394.305 3.341 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 844373 RRUGAFGQPVOUFN-IBGZPJMESA-N 395.415 3.351 5 50 GGBA CS(=O)(=O)N(CC(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc2ccccc12 1133625 UVKXKMHCJQREJE-UHFFFAOYSA-N 399.428 3.153 5 50 GGBA Cc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)NCC(C)C)cc1 5012106 SVEFGWNCVYRJHX-UNOMPAQXSA-N 381.432 3.446 5 50 GGBA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 5511376 VZOKVBCQIYNYPX-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA Cc1c(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C 1140331 UFERAGBWKZBQBN-UHFFFAOYSA-N 386.795 3.298 5 50 GGBA Cc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4575218 GSYFMJKQCWJXKP-UHFFFAOYSA-N 380.448 3.440 5 50 GGBA O=C(N/C(=C/c1ccccc1)C(=O)N1CCCCC1)c1ccc([N+](=O)[O-])cc1 825095 DEPZODZJENEUMX-XDJHFCHBSA-N 379.416 3.378 5 50 GGBA COC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc12 4134588 KGJRQSSXMTYFQR-UHFFFAOYSA-N 390.373 3.237 5 50 GGBA Cc1ccc2nsnc2c1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 334163082 LAQFVTVXHMCFTP-UHFFFAOYSA-N 384.826 3.362 5 50 GGBA C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 170601131 UPBYJZHXRKQFTD-SFSKKFTQSA-N 389.452 3.370 5 50 GGBA CCO[C@H]1C[C@@H](O)C12CCN(c1cc(C)c([N+](=O)[O-])cc1Br)CC2 302677005 NGXYXASBROJORK-CVEARBPZSA-N 399.285 3.422 5 50 GGBA Cc1ncc([N+](=O)[O-])n1Cc1nnc(SCc2cccc(Cl)c2)n1C 4386111 QRWFWVGCNZWIMD-UHFFFAOYSA-N 378.845 3.222 5 50 GGBA CN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@H](c3ccc([N+](=O)[O-])cc3)N2C1=S 754507 PGHRYKVFGYHOTR-AEFFLSMTSA-N 392.440 3.149 5 50 GGBA Cc1ccccc1CSCCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4865759 LSLFPSQWWUOORU-UHFFFAOYSA-N 380.491 3.423 5 50 GGBA COc1ccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br 1137940 CDNUQUFUAYWEKN-UHFFFAOYSA-N 394.177 3.406 5 50 GGBA COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2Cl)c1 4754486 OKIDCPBWUVXXOY-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA O=C(C[S@@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1ccccc1 952014 WTIRMCRXYLOCRF-SANMLTNESA-N 387.335 3.465 5 50 GGBA O=C(Oc1ccccc1N1C(=O)[C@@H]2CC=CC[C@H]2C1=O)c1ccc([N+](=O)[O-])cc1 101325005 DZWQNUHPXYZDBG-HZPDHXFCSA-N 392.367 3.270 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2[N+](=O)[O-])N2C(=O)[C@H](C)SC2=N1 2463255 OHZSFLMMWBVWGO-NHYWBVRUSA-N 389.433 3.195 5 50 GGBA COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1Cl 5090881 SOXIJWDWRHCAJC-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA CN(C)c1ccc(NC(=O)CSc2nc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)cc1 5050943 SBJOPGUKONDVOI-UHFFFAOYSA-N 398.448 3.177 5 50 GGBA Cc1ccc(Cl)c(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 4750307 QLYUHIIWDXDDSJ-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA CCCCN(CCCC)S(=O)(=O)c1ccc(N2CCCC2=O)c([N+](=O)[O-])c1 4015978 CXDFDUMRWRURSV-UHFFFAOYSA-N 397.497 3.313 5 50 GGBA COc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)n2C)cc1 4699671 DQQCILXDMKKSIO-UHFFFAOYSA-N 399.432 3.130 5 50 GGBA CC(C)C(=O)Nc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 1121321 WPAKJFBUDFBUKV-UHFFFAOYSA-N 386.433 3.316 5 50 GGBA O=[N+]([O-])c1cc(Cl)ccc1NCCNS(=O)(=O)c1ccc(Cl)cc1 4672190 GVOYPQGMAGFKAM-UHFFFAOYSA-N 390.248 3.292 5 50 GGBA CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2cccc([N+](=O)[O-])c2)cc1 845593 UWKQUUKBOFTXQN-GOSISDBHSA-N 396.403 3.260 5 50 GGBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1c(F)cccc1F 6369803 XJDRWRQSOVODQV-NSHDSACASA-N 379.338 3.363 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(Br)cc1 834059 XLRUWWWLDOWMCL-UHFFFAOYSA-N 387.211 3.167 5 50 GGBA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1C 1234544 PBMUNBMUSXIQIA-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA CCOC(=O)[C@@H](CSCc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C 4013907 CYCMJAXGJGLQCZ-CQSZACIVSA-N 384.454 3.284 5 50 GGBA CCn1ccc([C@@H](C)NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 2805367 VDASOTICZWDUGD-CYBMUJFWSA-N 396.451 3.164 5 50 GGBA COc1cccc(-n2ccc3nc4ccn(Cc5ccco5)c(=O)c4cc3c2=O)c1 38829092 IVKZIEAULWLPJT-UHFFFAOYSA-N 399.406 3.351 5 50 GGBA CCOc1ccc(N2C[C@@H](C(=O)N(C)c3cccc([N+](=O)[O-])c3)CC2=O)cc1 1875252995 FSDYPLDPHABFIU-AWEZNQCLSA-N 383.404 3.009 5 50 GGBA Cc1ccc(N([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 1061735 JACWLMBWVUWFIR-CQSZACIVSA-N 391.449 3.005 5 50 GGBA O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1C[C@@]12CCc1ccccc12 439191395 UTCQYVWUPLWQBO-OXQOHEQNSA-N 375.388 3.223 5 50 GGBA Cc1cccc(C(=O)N2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)c1[N+](=O)[O-] 328603292 FKIWZUDZHVKTBM-QVKFZJNVSA-N 396.447 3.433 5 50 GGBA O=C(/C=C/c1ccccc1)NC(=S)Nc1cc([N+](=O)[O-])cc(Cl)c1O 4935653 XNMQERHLVLRIPI-VOTSOKGWSA-N 377.809 3.480 5 50 GGBA COc1cccc([C@@H](C)NC(=O)c2ccccc2Cn2cc([N+](=O)[O-])cn2)c1 2796404 DJWCYGRMYXFDAV-CQSZACIVSA-N 380.404 3.339 5 50 GGBA O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1cc(OCC(F)(F)F)cc([N+](=O)[O-])c1 2763729 IHKSVVIOCCZBMR-CHWSQXEVSA-N 390.314 3.365 5 50 GGBA COc1ccc(C2=NN(C(=O)CCC(=O)O)[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 1218235 CGENIAMKIYHNNQ-GOSISDBHSA-N 397.387 3.146 5 50 GGBA COc1ccc(NC(=O)CSc2nc3ccc(OC)cc3[nH]2)c([N+](=O)[O-])c1 4274629 BXPADFBPAJQPKJ-UHFFFAOYSA-N 388.405 3.219 5 50 GGBA COc1ccc(Cc2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2C)cc1 1061136 QTSHBPBDALBSLB-UHFFFAOYSA-N 398.444 3.298 5 50 GGBA CCOC(=O)C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OCC)cc1 4653324 XWFHWHMTGMGJDV-GOSISDBHSA-N 386.404 3.418 5 50 GGBA COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1Cl 4820978 JPWZVPHLDAENHD-UHFFFAOYSA-N 391.811 3.346 5 50 GGBA CCCCC(=O)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1 4983900 ZLVXJTGAQUJXNA-UHFFFAOYSA-N 378.448 3.173 5 50 GGBA O=C(Nc1ncn(Cc2ccc(F)cc2Cl)n1)c1cccc([N+](=O)[O-])c1 2795283 USPWKDOPTHETLE-UHFFFAOYSA-N 375.747 3.279 5 50 GGBA Cc1ccc(C(=O)NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C 4549891 MGIDLIGCJZZQSV-UHFFFAOYSA-N 398.488 3.049 5 50 GGBA Cc1nc(N2CCOCC2)nc(Nc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] 4812375 XUMMUOHWFNFEOT-UHFFFAOYSA-N 383.330 3.292 5 50 GGBA O=C(N[C@H](NCc1ccco1)C(Cl)(Cl)Cl)c1cccc([N+](=O)[O-])c1 19913073 RXVHTGVQZIGDDV-ZDUSSCGKSA-N 392.626 3.404 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1)c1cccc([N+](=O)[O-])c1 18182629 FOKCWSHBXXVJLD-HDICACEKSA-N 394.383 3.494 5 50 GGBA O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 1891993 YHVLTGFJCDGCAC-UHFFFAOYSA-N 389.414 3.136 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1154479 CJUKVMWTGNAFAN-SFHVURJKSA-N 380.404 3.478 5 50 GGBA CCOc1ccccc1N1CCN(Cc2cc(OC)c(O)c([N+](=O)[O-])c2)CC1 1227783 GYRSWOFYLWBJHW-UHFFFAOYSA-N 387.436 3.030 5 50 GGBA CCOC(=O)c1cc(N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)ccc1[N+](=O)[O-] 242338940 ZDSHFQGGQPPOLA-ACJLOTCBSA-N 392.358 3.362 5 50 GGBA Cc1ccc(N2CCOCC2)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 225490442 ZYKMJDFGKJJOLJ-UHFFFAOYSA-N 380.404 3.473 5 50 GGBA CC1=C(C(=O)OC2CCC(C)CC2)[C@H](c2ccc(O)c([N+](=O)[O-])c2)NC(=O)N1 36075042 VRTDRDILIDKTKG-HKWVAONXSA-N 389.408 3.050 5 50 GGBA C[C@H](Oc1ccccc1)C(=O)N[C@@H](CC(=O)O)c1cc([N+](=O)[O-])ccc1Cl 4689767 WRLVSFAKBTZMRE-ZBEGNZNMSA-N 392.795 3.348 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@@H]2c2ccccc2[N+](=O)[O-])cc1OC 647179 BKQWZTUDYJJDNF-LJQANCHMSA-N 388.445 3.429 5 50 GGBA CCCC[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2ON1c1ccccc1 226986499 RKROBLKADFNWMV-CEXWTWQISA-N 395.415 3.463 5 50 GGBA Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 1115064 IPRYNLJVSNMKTL-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA CCC[C@@H](C)c1nnc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)s1 2865428 LDYITONRRFMQLP-SECBINFHSA-N 378.410 3.389 5 50 GGBA COC(=O)c1c(NC(=O)[C@H](C)n2cc([N+](=O)[O-])cn2)sc2c1CCCCC2 4686784 KXGSESNOXIYZOS-JTQLQIEISA-N 392.437 3.108 5 50 GGBA COc1cc(NC(=O)Cn2nc([N+](=O)[O-])c(Cl)c2C)c(OC)cc1Cl 826486 UORKZYGOERNREP-UHFFFAOYSA-N 389.195 3.062 5 50 GGBA O=C(Cn1cnc2c(Cl)cc(Cl)cc2c1=O)c1ccccc1[N+](=O)[O-] 3121739 SWWLVPMKFMGRPD-UHFFFAOYSA-N 378.171 3.494 5 50 GGBA CCOc1ccc(NC(=S)NC(=O)c2ccc(OC)cc2)c([N+](=O)[O-])c1 4982389 JEVATOZWWWQUMB-UHFFFAOYSA-N 375.406 3.129 5 50 GGBA CCCC(=O)N1CCN(c2cc(N3CCC(C)CC3)c(F)cc2[N+](=O)[O-])CC1 4543783 LFWCFYAXDQEVDT-UHFFFAOYSA-N 392.475 3.419 5 50 GGBA Cc1cc(C)c(C)c(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 4749619 QLSJZOVYRXLHDP-UHFFFAOYSA-N 383.448 3.248 5 50 GGBA CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1 1213965 GPXRCZCCZSPWFM-MRXNPFEDSA-N 387.417 3.211 5 50 GGBA CC(=O)Nc1ccc(Nc2cc(N3CCCC3)c3nonc3c2[N+](=O)[O-])cc1 4406285 FUELFUPLCQCGRH-UHFFFAOYSA-N 382.380 3.433 5 50 GGBA CCOC(=O)N1CCN(c2cc(N3CCCCC3)c(F)cc2[N+](=O)[O-])CC1 5060807 KQDHRPJHKREUEB-UHFFFAOYSA-N 380.420 3.003 5 50 GGBA CCCCNC(=O)/C(=C/c1ccc(OC)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1 1793507 POPQISHLFSOOIX-RGEXLXHISA-N 397.431 3.291 5 50 GGBA O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1C[C@]12CCc1ccccc12 439191396 UTCQYVWUPLWQBO-UZLBHIALSA-N 375.388 3.223 5 50 GGBA CC[C@H]1CN(CC(C)(C)O)[C@H](CC)CN1C(=O)Nc1cccc([N+](=O)[O-])c1 170613512 NBHREHWMXWYGLG-CVEARBPZSA-N 378.473 3.072 5 50 GGBA CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)c1cccc([N+](=O)[O-])c1 712607 IIHBUHHNQHOVDH-UHFFFAOYSA-N 380.360 3.210 5 50 GGBA C[C@@H](NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 1126608 MMJVDTHWMBMUTG-OAHLLOKOSA-N 381.432 3.324 5 50 GGBA COc1ccc([C@H]2SCCN2S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 4309968 MLTONEKAVWQAAP-QGZVFWFLSA-N 394.474 3.348 5 50 GGBA O=C(NC(=S)Nc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 4561119 MSBHMVCNWQDDRG-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA COc1ccc(N2C3=[N+](CCCCC3)C[C@@]2(O)c2cccc([N+](=O)[O-])c2)cc1 17159645 BWKFRWKJOGXHGF-OAQYLSRUSA-N 382.440 3.254 5 50 GGBA O=C(CCn1nc(C(F)(F)F)cc1C1CC1)Nc1ccc([N+](=O)[O-])cc1O 6925861 YWPFYEKISCJZEY-UHFFFAOYSA-N 384.314 3.422 5 50 GGBA C[C@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)c1ccccc1[N+](=O)[O-] 463248818 BYNAUKROVBYOOK-NSHDSACASA-N 387.421 3.175 5 50 GGBA O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCN(Cc2cccc3ccccc23)CC1 436637552 ZGSMZBYVIPIWPH-UHFFFAOYSA-N 391.427 3.412 5 50 GGBA O=C(Nc1cccc2ncccc12)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 5027974 OQWKQJMJUQRLIX-UHFFFAOYSA-N 378.388 3.232 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)Nc2cccnc2)c1 4755766 BAFFBXJQGOHXTP-UHFFFAOYSA-N 398.400 3.043 5 50 GGBA COc1ccc(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c(OC)c1 1180658 PMBMEGINNAMKIR-RMKNXTFCSA-N 387.417 3.138 5 50 GGBA COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c(NC4CC4)c3)CC2)cc1 4543705 HKESPPIOODLRPY-UHFFFAOYSA-N 396.447 3.140 5 50 GGBA CC1=C(C(=O)Nc2ccccc2F)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1 4990872 AXKQHTVOGQKGDU-MRXNPFEDSA-N 386.408 3.165 5 50 GGBA CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 1129097 XNKIVXVPVCTRSW-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA CCOC(=O)[C@@]1(C)C=C(Nc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 100702025 SCKFSIDKSXWKPI-HXUWFJFHSA-N 381.388 3.259 5 50 GGBA Cc1ccc2c(c1)N(C(=O)[C@@H]1CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C1)CCC2 732008521 BINWVQJODACOHU-OAHLLOKOSA-N 397.406 3.375 5 50 GGBA CN(C)c1nccc([C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CCO2)n1 281503631 OUJFFUOBDKJVDE-OAHLLOKOSA-N 397.357 3.048 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1I 834211 NYYIFXCVTQDQIM-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA Cc1nn(Cc2ccc([N+](=O)[O-])cc2)c(=O)n1-c1cccc(C(F)(F)F)c1 4089267 CDRGKQSOQFPUBX-UHFFFAOYSA-N 378.310 3.318 5 50 GGBA CC(C)(C)c1ccc(NC(=O)N2CCO[C@@]3(CCCOC3)C2)cc1[N+](=O)[O-] 408142049 OMIDBWGBQKSBAA-IBGZPJMESA-N 377.441 3.306 5 50 GGBA COc1ccccc1NC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc([N+](=O)[O-])cc1 862506 WLUBFPVTOTYMBD-KRWDZBQOSA-N 398.444 3.035 5 50 GGBA O=C(Nc1nnc(CC2CCCC2)s1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2110502 CHVHMADAUBHLKI-UHFFFAOYSA-N 377.382 3.340 5 50 GGBA O=[N+]([O-])c1ccccc1N1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 4663754 HAAXOKRDBOYXBO-UHFFFAOYSA-N 379.376 3.378 5 50 GGBA O=[N+]([O-])c1cc(Cl)ccc1NCCCNS(=O)(=O)Cc1ccccc1 4670373 HZLGFCNVBZHXJG-UHFFFAOYSA-N 383.857 3.170 5 50 GGBA COc1ccc(C(=O)COC(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-] 1173436 FYILKIVPMOQAQX-UHFFFAOYSA-N 394.177 3.406 5 50 GGBA biogenic COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2c(Br)c(C)nn12 20605840 KNJLDEPHNGPSIJ-UHFFFAOYSA-N 391.181 3.162 5 50 GGBA CC(=O)N(c1ccc(N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1)C1CC1 842146776 ACKOKJUMXOTORK-HXUWFJFHSA-N 394.431 3.328 5 50 GGBA CC(C)(O)CN1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 252540530 PKIXIKRIPXPWKE-UHFFFAOYSA-N 375.494 3.212 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCSCc2cccc(Cl)c2)cc1 2872417 MCUNXFPFIXDMHN-UHFFFAOYSA-N 386.882 3.460 5 50 GGBA O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)c1ccc([N+](=O)[O-])cc1 130118702 VADVHLMHOXFXSP-UHFFFAOYSA-N 389.717 3.471 5 50 GGBA Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CCOC2(CCCCC2)C1 134664118 DLPRDGHFNCYQOO-HNNXBMFYSA-N 382.482 3.372 5 50 GGBA Cc1noc([C@@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C(C)C)n1 129046700 KYIBGKYWJXQZSK-LBPRGKRZSA-N 390.368 3.092 5 50 GGBA Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 126383426 YTICXATZALUELW-QZTJIDSGSA-N 390.484 3.101 5 50 GGBA CC(=O)COC(=O)c1cccc(-n2c(=O)c3ccccc3c3ccccc3c2=O)c1 1163358 YXDSAMPMRXXKQZ-UHFFFAOYSA-N 399.402 3.250 5 50 GGBA O=C(NC(=S)Nc1cccc([N+](=O)[O-])c1)c1cccc(Br)c1 2978942 XUWDHXJSWHNGBE-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA CCOc1ccc(Nc2cc(N3CCOCC3)c3nonc3c2[N+](=O)[O-])cc1 4917458 CAGSFIIDGXOFTO-UHFFFAOYSA-N 385.380 3.110 5 50 GGBA O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N1CCCC2(C1)OCCO2 170591011 YZXAQOQEYLUNQD-UHFFFAOYSA-N 392.795 3.487 5 50 GGBA CC1=C(C(=O)Nc2ccc(F)c(F)c2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1105504 JQYWPOLOFSMKST-INIZCTEOSA-N 388.330 3.140 5 50 GGBA CCn1ccc([C@H](C)NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 2805368 VDASOTICZWDUGD-ZDUSSCGKSA-N 396.451 3.164 5 50 GGBA O=C([C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1)N1CCc2ccccc2C1 4745118 QKTXRIQXPHODJP-HXUWFJFHSA-N 379.460 3.392 5 50 GGBA C[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)[C@H](C)Cc1ccccc1[N+](=O)[O-] 225514448 JRYVQVSWNRULKX-VNHYZAJKSA-N 387.402 3.305 5 50 GGBA COCCn1ccnc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 2325855823 QFJYYKFPWLKVQB-UHFFFAOYSA-N 382.376 3.482 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)N2C(=O)CCSC2=N1 1135099 HCRGERBQVMFAQG-MRXNPFEDSA-N 389.433 3.197 5 50 GGBA COc1cc(CN2CCN(c3ccccc3F)CC2)c([N+](=O)[O-])cc1OC 55543424 GMDYEIVTBWEDSQ-UHFFFAOYSA-N 375.400 3.073 5 50 GGBA Cc1nn(Cc2ccc(C(=O)NOCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 2795546 XRZDIMSALJBBIP-UHFFFAOYSA-N 380.404 3.318 5 50 GGBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1S(=O)(=O)c1ccc(Cl)cc1 4131931 VMIJGRRSWDHVNC-CYBMUJFWSA-N 395.868 3.148 5 50 GGBA O=C(O)CCCC(=O)Nc1sccc1C(=O)Nc1cccc([N+](=O)[O-])c1 17077158 OVPFNXQTJUTMMH-UHFFFAOYSA-N 377.378 3.102 5 50 GGBA COc1ccc(C(=O)Nc2ccc(I)cc2)cc1[N+](=O)[O-] 834218 KENWXJWOAVJCDQ-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA CCn1c(SCC(=O)NC2CCCCC2)nnc1-c1ccc([N+](=O)[O-])cc1 2843309 CBDRWVIWASTDTH-UHFFFAOYSA-N 389.481 3.414 5 50 GGBA CCOC(=O)[C@H](CSCc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C 4013909 CYCMJAXGJGLQCZ-AWEZNQCLSA-N 384.454 3.284 5 50 GGBA C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(O)cc1N)c1ccccc1Br 170597744 MOFZSGGGVLSHAP-MRVPVSSYSA-N 380.198 3.136 5 50 GGBA COC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)[C@@H]1c1ccccc1[N+](=O)[O-] 19632706 VKQFCGNPDRICFG-GOSISDBHSA-N 388.420 3.202 5 50 GGBA biogenic,fda CC(C)CCC1CCN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 152630458 IPNCDZSMCQUOIW-UHFFFAOYSA-N 393.509 3.461 5 50 GGBA COc1ccc(-c2n[nH]c(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2)cc1 18067584 OBRXZIOBVKQKTE-UHFFFAOYSA-N 385.405 3.119 5 50 GGBA O=[N+]([O-])c1cccc(Cl)c1NCCNS(=O)(=O)c1ccc(Cl)cc1 4565504 WOSHEVQMDVEYBE-UHFFFAOYSA-N 390.248 3.292 5 50 GGBA CCCCCC[C@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@H]1C 2325871990 CXJFCXGSWHWFHN-HZSPNIEDSA-N 383.420 3.073 5 50 GGBA CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 956235 FFLJABZTZUSHNS-KRWDZBQOSA-N 376.376 3.114 5 50 GGBA CN(C)C(=O)c1cccc(NC(=O)c2ccc(Br)cc2[N+](=O)[O-])c1 429926702 QRMKXSKQVTUPON-UHFFFAOYSA-N 392.209 3.311 5 50 GGBA N=C(NCCc1ccccc1)c1cc(I)cc([N+](=O)[O-])c1 2858237 AQIAFLAVQXXFKD-UHFFFAOYSA-N 395.200 3.357 5 50 GGBA COc1cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)cc([N+](=O)[O-])c1O 13546718 YFMCXTFENJJDFK-LFYBBSHMSA-N 389.751 3.060 5 50 GGBA O=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccc([N+](=O)[O-])c1 672194 VHCGKEDAIWZXDG-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA O=C(NC(NC(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1)c1ccccc1 1218780 MEQFPOZTFFMNOY-UHFFFAOYSA-N 375.384 3.453 5 50 GGBA aggregator Cc1cc2oc3nc(N)c(S(=O)(=O)c4cccs4)cc3c(=O)c2cc1C 170626163 QGEUVZXPWGJLTI-UHFFFAOYSA-N 386.454 3.435 5 50 GGBA O=C(NC(=S)Nc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 5094625 QLGNGEOSBGXLCU-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA C[C@@]1(C(=O)O)CCN(C(=O)c2cc(F)cc3c(O)c4cc(F)ccc4nc23)C1 262830961 XQYRZUBXWCGUNS-HXUWFJFHSA-N 386.354 3.309 5 50 GGBA CCOC(=O)C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(OCC)cc1 4653341 GADUUSDBELZTJN-KRWDZBQOSA-N 386.404 3.418 5 50 GGBA Cn1cc([N+](=O)[O-])c(C(=O)N2CCCc3cc(Cl)cc(Br)c32)n1 411107764 HEQHJAQLUYZURQ-UHFFFAOYSA-N 399.632 3.337 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(C(=S)Nc3ccc(F)cc3F)CC2)cc1 13519517 GUVDQOJQJFBGOG-UHFFFAOYSA-N 378.404 3.392 5 50 GGBA CCOC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@@H]1c1ccccc1[N+](=O)[O-] 2327179 IXEZYFFCJKWBRT-GOSISDBHSA-N 391.387 3.176 5 50 GGBA Cc1ccc(-c2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2C)cc1 4820395 SYIDZTHZKRNUNN-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA Cc1cc(Cl)ccc1OCCNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C 4845228 HBGYMXFFLFLQTK-UHFFFAOYSA-N 384.841 3.222 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)N1CCN(c2ccccc2F)CC1 5042010 CWASBQANZNSNAH-UHFFFAOYSA-N 390.440 3.262 5 50 GGBA Cc1ccc(N([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)S(C)(=O)=O)cc1 1061732 JACWLMBWVUWFIR-AWEZNQCLSA-N 391.449 3.005 5 50 GGBA CCC(=O)N1CCN(c2cc(N3CCC(C)CC3)c(F)cc2[N+](=O)[O-])CC1 3998684 AMJZWDOOGCYVHS-UHFFFAOYSA-N 378.448 3.029 5 50 GGBA O=c1[nH]c2c(c(=O)[nH]1)[C@@H](c1cccc([N+](=O)[O-])c1)c1c(ccc3ccccc13)N2 4624101 OBGZEFXOPUQWRN-INIZCTEOSA-N 386.367 3.362 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 817961 LCWPLSIEHXWGNW-SFHVURJKSA-N 381.388 3.308 5 50 GGBA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1 1140777 AQTSRWYAMQUSHJ-NSHDSACASA-N 388.376 3.141 5 50 GGBA O=[N+]([O-])c1ccccc1SN[C@@H](N1CCOCC1)C(Cl)(Cl)Cl 25665947 DPQLJOILMUPKCS-NSHDSACASA-N 386.688 3.220 5 50 GGBA O=C(CCn1ccc([N+](=O)[O-])n1)Nc1scc2c1c(=O)oc1ccccc12 2781870 BXNWLTZVDCSZEK-UHFFFAOYSA-N 384.373 3.141 5 50 GGBA Cc1nn(C(=O)c2c([N+](=O)[O-])cnn2C)c(C)c1C12CC3CC(CC(C3)C1)C2 6399415 QRQCFQOTGGTHPK-UHFFFAOYSA-N 383.452 3.298 5 50 GGBA CC(=O)O[C@@H](c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](OC(C)=O)c1ccccc1 2519750 MESSPIUNPLYNSV-MSOLQXFVSA-N 388.332 3.412 5 50 GGBA CCc1nnc(NC(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)s1 22135487 PIPLJYHOHIQLLG-UHFFFAOYSA-N 381.464 3.349 5 50 GGBA CC1=C(C(=O)Nc2cc(C)cc(C)c2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 5059383 UUQRBPUWUGISPX-SFHVURJKSA-N 380.404 3.478 5 50 GGBA CCOC(=O)c1c(C)n(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccc(O)cc12 896356 PKODFZMPDADMEA-GOSISDBHSA-N 384.388 3.474 5 50 GGBA O=C(N/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC1)c1cccs1 1831660 XGFUAHZSESDYKW-SSZFMOIBSA-N 385.445 3.440 5 50 GGBA CN(C(=O)CSc1nnc(-c2ccc([N+](=O)[O-])cc2)n1C)c1ccccc1 1124639 SJIYQHGNRLMFTN-UHFFFAOYSA-N 383.433 3.145 5 50 GGBA CCOC(=O)Cc1csc(NC(=O)CSc2ccc([N+](=O)[O-])cc2F)n1 170597151 NOEHHTGQCBIYMN-UHFFFAOYSA-N 399.425 3.027 5 50 GGBA Cc1ccc(OS(=O)(=O)[C@@H](c2ccccc2F)C(F)(F)[N+](=O)[O-])cc1 2181555 MERGSBANKBIQNR-AWEZNQCLSA-N 375.324 3.454 5 50 GGBA Cc1ccc(C(=O)NC(=S)Nc2ccc(Br)cn2)cc1[N+](=O)[O-] 1171906 UMTGMUFSADRQFV-UHFFFAOYSA-N 395.238 3.188 5 50 GGBA COc1ccc(CCNC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1OC 1174701 GCLMKUCZULEDFF-UHFFFAOYSA-N 390.461 3.204 5 50 GGBA CCC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCCc3ccccc3)c2)CC1 4187987 CNZZUFCAGFAYDW-UHFFFAOYSA-N 382.464 3.308 5 50 GGBA COc1cc(Br)ccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 1137016 VOXBFLGUHUSUJU-UHFFFAOYSA-N 377.150 3.167 5 50 GGBA O=C1[C@@H]2CS[C@H](c3cccc([N+](=O)[O-])c3)N2C(=S)N1c1ccc(F)cc1 4686625 KUXIOXFQKPWCFU-GOEBONIOSA-N 389.433 3.482 5 50 GGBA CCOC(=O)c1c(NC(=O)[C@H](C)n2nc(C)c([N+](=O)[O-])c2C)sc(C)c1C 1067329 OHXADGHIGNHBTE-NSHDSACASA-N 394.453 3.463 5 50 GGBA COC(=O)c1cc(C(=O)Nc2cccc(Br)c2)cc([N+](=O)[O-])c1 1097981 MPUGKCJSCXUGDH-UHFFFAOYSA-N 379.166 3.396 5 50 GGBA COc1cc([N+](=O)[O-])cc2cc(C(=O)N3c4ccccc4C[C@H]3C)c(=O)oc12 4726958 VXXXAGYPIKLXKK-LLVKDONJSA-N 380.356 3.301 5 50 GGBA O=C(NCc1cc(-c2ccccc2F)on1)c1cc2nc[nH]c2cc1[N+](=O)[O-] 2325869346 KCEIVFXBEXMFAF-UHFFFAOYSA-N 381.323 3.195 5 50 GGBA COc1ccc(COC(=O)C2=C(C)NC(=O)C[C@@H]2c2ccccc2[N+](=O)[O-])cc1 4913234 WRRZENSBGBXBTF-QGZVFWFLSA-N 396.399 3.224 5 50 GGBA O=[N+]([O-])c1cccc(CN2CCC(N3CCN(c4ccccc4)CC3)CC2)c1 4712108 JXGLSZUBMHKZIA-UHFFFAOYSA-N 380.492 3.381 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1)c1ccc([N+](=O)[O-])cc1 17976113 MZTCVDDYQVINPU-QZTJIDSGSA-N 394.383 3.494 5 50 GGBA CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1cc([N+](=O)[O-])ccc1Br)OC2=O 1157497 VFENXSBMYVPBTO-CVEARBPZSA-N 397.225 3.418 5 50 GGBA O=C(NCCC1=CCCCC1)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 1132281 DCXXRDCFOLWRLL-UHFFFAOYSA-N 385.464 3.454 5 50 GGBA C[N+]1(CCOCc2ccccc2)CC[N+](C)(CCOCc2ccccc2)CC1 5377571 FRSCYGHMYBNQFF-UHFFFAOYSA-N 384.564 3.327 5 50 GGBA O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 5028000 RNNMRXNVIFJISA-UHFFFAOYSA-N 381.392 3.007 5 50 GGBA CCC(=O)Nc1nc(-c2ccc3c(c2)OCO3)nc2c1c(=O)oc1ccccc12 2452560 ZNKUSCBMSLLEIR-UHFFFAOYSA-N 389.367 3.480 5 50 GGBA O=C(CCS(=O)(=O)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 4740537 AJUTYFJYHDMXAD-UHFFFAOYSA-N 382.825 3.192 5 50 GGBA COc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)NCC(C)C)cc1 2677849 XKDAOPCVXOXRJE-UNOMPAQXSA-N 397.431 3.147 5 50 GGBA COc1ccccc1NC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc([N+](=O)[O-])c1 862518 CSUAVSIEPXPULF-KRWDZBQOSA-N 398.444 3.035 5 50 GGBA CN(C[C@H]1CCCN2CCCC[C@H]12)C(=O)Cn1ccc2c([N+](=O)[O-])cccc21 409414772 ODSBWDUDWOIGJG-SJLPKXTDSA-N 384.480 3.272 5 50 GGBA COc1ccc(C(=O)Nc2ccc(Br)cc2C(=O)O)cc1[N+](=O)[O-] 4822751 QRADYEHFHWOXNZ-UHFFFAOYSA-N 395.165 3.316 5 50 GGBA CCC[C@H](C)c1nnc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)s1 2865429 LDYITONRRFMQLP-VIFPVBQESA-N 378.410 3.389 5 50 GGBA CNC(=O)/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)NC(=O)c1ccccc1 5005408 CXHKKUBCUGHTJL-QGOAFFKASA-N 391.383 3.372 5 50 GGBA CCOc1ccc(C(=O)CCC(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cc1 2989096 XRZJUSLEPHZGER-UHFFFAOYSA-N 385.372 3.383 5 50 GGBA C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4459733 KYMRJMSQJYMUHH-CQSZACIVSA-N 389.839 3.364 5 50 GGBA O=C(Nc1ccccc1N1CCCC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4839659 XPIVLTQPNONNRK-UHFFFAOYSA-N 396.447 3.284 5 50 GGBA COC(=O)N1CCC([C@@H](C)NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 170600788 VARUQINDBFTCOM-OLZOCXBDSA-N 395.481 3.059 5 50 GGBA CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2ccccc2c1 5077663 CIASMTMOEAZEGF-UHFFFAOYSA-N 399.428 3.007 5 50 GGBA C[C@]1(C(=O)O)CCN(C(=O)c2cc(F)cc3c(O)c4cc(F)ccc4nc23)C1 262830957 XQYRZUBXWCGUNS-FQEVSTJZSA-N 386.354 3.309 5 50 GGBA COc1ccc([C@@H]2SCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 5016938 PEYYWPOZIVEQBO-INIZCTEOSA-N 380.447 3.040 5 50 GGBA Cc1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(C)c1OCC(=O)O 262202924 OSXDHDVBPZBYRZ-UHFFFAOYSA-N 398.415 3.480 5 50 GGBA O=C(C[S@](=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1ccccc1 8462980 WTIRMCRXYLOCRF-AREMUKBSSA-N 387.335 3.465 5 50 GGBA CN(C)c1noc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)n1 170619633 QQBHUESGYKFBHV-HNNXBMFYSA-N 380.408 3.447 5 50 GGBA C[C@H]1CN(c2ccc(C(=O)c3ccccc3C(=O)O)cc2[N+](=O)[O-])C[C@@H](C)O1 4978726 OGMBAKGZBAWXRQ-BETUJISGSA-N 384.388 3.138 5 50 GGBA COc1ccc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)cc1OC 2796574 DJXASOQLKSVURJ-UHFFFAOYSA-N 396.403 3.418 5 50 GGBA CCC(=O)c1ccc(N(CCNC(C)=O)C2CCSCC2)c([N+](=O)[O-])c1 225778779 KRIGRZXZCOJJLT-UHFFFAOYSA-N 379.482 3.026 5 50 GGBA O=C(c1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4688062 QJFXRBLQVILLGP-UHFFFAOYSA-N 398.438 3.297 5 50 GGBA O=C(CCCn1cnc([N+](=O)[O-])n1)Nc1cc(C(F)(F)F)ccc1Cl 4810929 NFCYIGIABDYLMB-UHFFFAOYSA-N 377.710 3.277 5 50 GGBA C[C@@H]1C[C@@H](C)CN(c2nc(O)c3c(n2)NC(=O)C[C@@H]3c2ccccc2[N+](=O)[O-])C1 822355265 XGIVOGNBSOECIA-YRGRVCCFSA-N 397.435 3.047 5 50 GGBA Cc1cccn2c(=O)c3cc(C(=O)NC4CCCCC4)c(=N)n(C(C)C)c3nc12 100642509 WJCQPWRDMIXGAC-UHFFFAOYSA-N 393.491 3.080 5 50 GGBA O=C(NC(=S)Nc1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] 1171234 UAPLSMLWTPKEKB-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 754834 HHJFRZUBCHSOTI-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA CCc1ccc(C(=O)COC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 1860965 GYUIPHPABZIACG-UHFFFAOYSA-N 384.388 3.302 5 50 GGBA CCNc1cc(N2CCN(C(=O)c3ccc(OCC)cc3)CC2)ccc1[N+](=O)[O-] 4740903 JYRXAKHOPWDZJZ-UHFFFAOYSA-N 398.463 3.388 5 50 GGBA Cc1ccc(Cl)cc1NC(=O)Cn1nc([N+](=O)[O-])c(Br)c1C 4594315 CUAZZLNTKYBJGN-UHFFFAOYSA-N 387.621 3.463 5 50 GGBA Cc1cc(C)n(-c2ccc(N3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)nn2)n1 172787026 CWMFFETZBSCQFC-UHFFFAOYSA-N 394.435 3.235 5 50 GGBA CCOC(=O)c1cc(OC(=O)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1 1069864 BTQALLCLPNATBM-UHFFFAOYSA-N 381.344 3.176 5 50 GGBA O=C(NCc1ccoc1)Nc1ccc([N+](=O)[O-])c(I)c1 225851128 QWBNZEZRODIYLB-UHFFFAOYSA-N 387.133 3.114 5 50 GGBA COC(=O)c1cc(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc(C(=O)OC)c1 1738497 URHZJQKNWLJUSW-UHFFFAOYSA-N 387.348 3.120 5 50 GGBA Cc1nn(CCc2nnc(S)n2-c2cccc(Cl)c2)c(C)c1[N+](=O)[O-] 5424995 AYXPYKKKQZYSCD-UHFFFAOYSA-N 378.845 3.174 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 844343 AUHPIPVKWRRTAY-IBGZPJMESA-N 395.415 3.351 5 50 GGBA C[C@](O)(/C=C1/Oc2ccc([N+](=O)[O-])cc2[C@@H]1N1CCOCC1)[C@H]1C[C@H]2C=C[C@H]1C2 245256369 PSHLMLNENHNYFX-IMZIYERFSA-N 398.459 3.208 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(Cc2ccccc2)n1C 976223 KQPNNSYSJTXPFR-UHFFFAOYSA-N 397.460 3.353 5 50 GGBA CCC(=O)Nc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 1182753 DUTIGLVOTYVWLK-UHFFFAOYSA-N 386.433 3.379 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc(I)cc1 5092138 PIBIVZVTSZNGNC-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA Cc1nn(C[C@H](C)c2nc3c4c(C)c(C)sc4ncn3n2)c(C)c1[N+](=O)[O-] 2808282 HRTOBLYTDCKJRV-QMMMGPOBSA-N 385.453 3.481 5 50 GGBA CCOC(=O)C1=CN(C(C)C)C=C(C(=O)OCC)C1c1ccc([N+](=O)[O-])cc1 1123366 SABSGCDVPGFSJF-UHFFFAOYSA-N 388.420 3.296 5 50 GGBA CCOc1ccccc1NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 1129983 XSMUPHXTSFLJBW-UHFFFAOYSA-N 397.431 3.484 5 50 GGBA CC(C)c1ccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4819029 JXWFZQWSJBFVAX-UHFFFAOYSA-N 383.448 3.446 5 50 GGBA O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 229512915 IYKIKJKJAKNLOC-PKOBYXMFSA-N 392.839 3.061 5 50 GGBA C[C@@H]1CCSCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 170611254 QAZSPOJACWEEFP-SECBINFHSA-N 384.401 3.220 5 50 GGBA COc1ccc(C[C@H](C)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC 23283097 ZGZWGNADAYDZDC-INIZCTEOSA-N 385.464 3.365 5 50 GGBA O=c1oc2ccc([N+](=O)[O-])cc2n1CCCSc1ncn(-c2ccccc2)n1 117109279 CORYJNSFNUBXOF-UHFFFAOYSA-N 397.416 3.266 5 50 GGBA CCCCc1ccc(NC(=O)Cc2noc(-c3n[nH]c(CC)c3[N+](=O)[O-])n2)cc1 420492575 LBOVMAUNVGXGII-UHFFFAOYSA-N 398.423 3.454 5 50 GGBA COc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)c(OC)c1 1181572 OEQSVMHSZMUIRG-UHFFFAOYSA-N 375.406 3.047 5 50 GGBA COc1cc([N+](=O)[O-])ccc1OCCCOc1ccc([N+](=O)[O-])cc1OC 4769750 NJPQYHHYRKFBSE-UHFFFAOYSA-N 378.337 3.368 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)N(c1nccs1)C2=O 4065135 WLRGUDHIWFPIRA-UHFFFAOYSA-N 394.368 3.104 5 50 GGBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)n1cc([N+](=O)[O-])c(-c2nccs2)n1 225653871 MQEQRKIUFNKDKU-SECBINFHSA-N 388.365 3.023 5 50 GGBA CCOC(=O)C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OCC)cc1 4653325 XWFHWHMTGMGJDV-SFHVURJKSA-N 386.404 3.418 5 50 GGBA Cc1ccc2c(c1)N(C(=O)[C@H]1CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C1)CCC2 732008520 BINWVQJODACOHU-HNNXBMFYSA-N 397.406 3.375 5 50 GGBA COC(=O)Cc1c(C)c2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2oc1=O 5063021 QVHSHWFFASTYDI-UHFFFAOYSA-N 383.356 3.304 5 50 GGBA CC1=C[C@@H](c2ccccc2)n2nc(NC(=O)c3cccc([N+](=O)[O-])c3)nc2N1 100904746 LRQOQSXJANTRQF-INIZCTEOSA-N 376.376 3.357 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C(C)C 375410097 DCRUETUVVCUAAX-RDTXWAMCSA-N 388.424 3.487 5 50 GGBA O=c1[nH]c(O)nc(/C=C/c2cccc(OCc3ccccc3F)c2)c1[N+](=O)[O-] 15009180 OSZQGWJFXHHKJN-CMDGGOBGSA-N 383.335 3.272 5 50 GGBA Cc1ccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 4457582 OCNCSWGJETZWJE-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA COC(=O)c1cc(C)nc(NCCc2nc(C(F)(F)F)cs2)c1[N+](=O)[O-] 225821616 CZHIUNMGVBQXJS-UHFFFAOYSA-N 390.343 3.215 5 50 GGBA CNS(=O)(=O)c1ccc(N2C[C@H](C)CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 253417642 DDRQXDDAECXLIS-RHSMWYFYSA-N 389.477 3.481 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 949450 FDWLQXQRNXLSPS-GOSISDBHSA-N 391.387 3.219 5 50 GGBA C[C@@H]1CN(c2ccc(C(=O)c3ccccc3C(=O)O)cc2[N+](=O)[O-])C[C@@H](C)O1 4978728 OGMBAKGZBAWXRQ-CHWSQXEVSA-N 384.388 3.138 5 50 GGBA CCC[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2ON1c1ccccc1 226985353 ZKKIRCDRNCNLIV-FGTMMUONSA-N 381.388 3.073 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2ccccc2OC)cc1[N+](=O)[O-] 1171253 WJYQSHRBZJRCGH-UHFFFAOYSA-N 375.406 3.129 5 50 GGBA COC(=O)c1c(C)nn(-c2ccccc2)c1NC(=O)c1cccc([N+](=O)[O-])c1 1439609 RRSIUAYMWUOJPR-UHFFFAOYSA-N 380.360 3.128 5 50 GGBA O=c1oc2cc(Cl)c(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2s1 2361838 MFRHPELOQVOJOC-UHFFFAOYSA-N 387.778 3.184 5 50 GGBA COC(=O)c1ccc(C)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)c1 1055988 GBBOGWAXXTZGPH-UHFFFAOYSA-N 382.328 3.049 5 50 GGBA Cc1cc(C)n(-c2cc(N3CCN(C(=O)C(C)(C)C)CC3)ccc2[N+](=O)[O-])n1 4687551 AQZNGDJITRWSNP-UHFFFAOYSA-N 385.468 3.092 5 50 GGBA COc1cc(CN2CCN(c3ccc(C(C)=O)cc3)CC2)c([N+](=O)[O-])cc1OC 55031559 YNZTUZUWDPNMMN-UHFFFAOYSA-N 399.447 3.137 5 50 GGBA CC(=O)Nc1ccc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)cc1 2796380 SMMXCBAMPKAYJL-UHFFFAOYSA-N 393.403 3.359 5 50 GGBA O=c1oc(-c2ccccc2[N+](=O)[O-])nc2ccc(I)cc12 1059937 NQYXUFPVEJXSCU-UHFFFAOYSA-N 394.124 3.368 5 50 GGBA O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 241316824 LVERXBWNLAZLEJ-UHFFFAOYSA-N 388.181 3.190 5 50 GGBA O=C(O[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)c1ccc2c(c1)C(=O)NCC2 2325862078 ILVTXBVRVOSTIM-OAHLLOKOSA-N 394.305 3.341 5 50 GGBA O=C(NC(=S)Nc1ccccc1C(=O)O)c1ccc([N+](=O)[O-])cc1Cl 2832654 OHVRZFNNEYBALM-UHFFFAOYSA-N 379.781 3.073 5 50 GGBA O=C(c1ccc(Br)cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4846141 VTLWJAZWIUIITC-UHFFFAOYSA-N 391.221 3.425 5 50 GGBA O=C(Nc1ccc(F)cc1F)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 1124953 ZMKWFZGNRHRWTG-UHFFFAOYSA-N 389.358 3.364 5 50 GGBA O=[N+]([O-])c1ccc(NCCCCNS(=O)(=O)c2ccc(Cl)cc2)cc1 4561716 HNFNWTYVKJLFEK-UHFFFAOYSA-N 383.857 3.419 5 50 GGBA CC(CCC(=O)O)(c1ccc(O)c([N+](=O)[O-])c1)c1ccc(O)c([N+](=O)[O-])c1 2164719 VGRYMKZWQBZCPX-UHFFFAOYSA-N 376.321 3.085 5 50 GGBA in-vitro O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)Nc2nccs2)c1 2293306 PLYUEONLRXWOSR-UHFFFAOYSA-N 398.400 3.321 5 50 GGBA CC(C)C(=O)N1CCN(c2cc(N3CCCCCC3)c(F)cc2[N+](=O)[O-])CC1 4624277 JFELPALBMVIYPE-UHFFFAOYSA-N 392.475 3.419 5 50 GGBA Cc1cc(C)nc(Sc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])n1 950632 ZCFJYEWCSVXNAQ-UHFFFAOYSA-N 393.368 3.446 5 50 GGBA COC(=O)CN1C(=O)S/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)C1=O 2813078 ROHPJEYUQQANID-ZSOIEALJSA-N 388.357 3.064 5 50 GGBA O=C(CCCC(=O)OCC(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 4833968 PPBKNJRTRIDIGD-UHFFFAOYSA-N 388.351 3.269 5 50 GGBA CCCC1=C(C(=O)OCC)[C@@H](c2cc([N+](=O)[O-])ccc2OCC)NC(=S)N1 1126957 FDBWQOACHVALRX-MRXNPFEDSA-N 393.465 3.130 5 50 GGBA O=c1c2c3c(sc2nc2c4ccccc4c(NCCCO)nn12)CCCC3 2679228 UJIFQSUZSURNNF-UHFFFAOYSA-N 380.473 3.131 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1)c1ccc([N+](=O)[O-])cc1 18141071 MZTCVDDYQVINPU-HDICACEKSA-N 394.383 3.494 5 50 GGBA Cc1ccc(OS(=O)(=O)[C@H](c2ccccc2F)C(F)(F)[N+](=O)[O-])cc1 2181556 MERGSBANKBIQNR-CQSZACIVSA-N 375.324 3.454 5 50 GGBA COc1cc(CCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc(OC)c1OC 6433813 WXDSBZXZEQVQTJ-UHFFFAOYSA-N 378.356 3.331 5 50 GGBA CNS(=O)(=O)c1ccc(N2C[C@@H](C)CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 253417646 DDRQXDDAECXLIS-WMLDXEAASA-N 389.477 3.481 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 844372 RRUGAFGQPVOUFN-LJQANCHMSA-N 395.415 3.351 5 50 GGBA O=C(C[S@@](=O)c1ccccc1[N+](=O)[O-])Oc1ccc(Br)cc1 2849263 UNRSKOJEWWAKMS-QFIPXVFZSA-N 384.207 3.071 5 50 GGBA O=c1[nH]c(/C=C\c2ccc(-c3cccc(C(F)(F)F)c3)o2)c([N+](=O)[O-])c(=O)[nH]1 30840457 NEMDOYZLNBBOSV-XQRVVYSFSA-N 393.277 3.421 5 50 GGBA C[C@@H]1C[C@@H](C)CN(c2nc(O)c3c(n2)NC(=O)C[C@H]3c2ccccc2[N+](=O)[O-])C1 822355262 XGIVOGNBSOECIA-BZPMIXESSA-N 397.435 3.047 5 50 GGBA Cc1ccc(NC(=O)c2ccc(NCCCN3CCOCC3)c([N+](=O)[O-])c2)cc1 22239166 KQFDYECPGQSXSF-UHFFFAOYSA-N 398.463 3.290 5 50 GGBA NC(=O)c1ccccc1NC(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1 17481493 UVVNXISLTAGVKT-UHFFFAOYSA-N 382.420 3.326 5 50 GGBA COc1ccc(Cl)cc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4608072 BAHVZDINMPNHHK-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2Cl)cc1OC 5102697 BFOXOEWFONSJEA-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA O=[N+]([O-])c1ccc(-c2nc(NCCCN3CCOCC3)c3ccccc3n2)cc1 19792021 YUDZVOROVVLHTO-UHFFFAOYSA-N 393.447 3.339 5 50 GGBA CCOc1ccccc1N1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 55542949 JSXXDTBWGPPGJY-UHFFFAOYSA-N 385.420 3.044 5 50 GGBA O=C(Nc1ccc(N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4821341 PIIPCHDUYONMSI-UHFFFAOYSA-N 396.447 3.284 5 50 GGBA Cc1cc(C)n(-c2ccccc2CNC(=O)c2cc([N+](=O)[O-])c(N)cc2F)n1 253405487 MZIGOSPNZYGZHB-UHFFFAOYSA-N 383.383 3.049 5 50 GGBA CCN(C(=O)c1ccccc1[N+](=O)[O-])c1c(C)n(C)n(-c2ccccc2)c1=O 2018945 ANFBORKAUZHAPV-UHFFFAOYSA-N 380.404 3.059 5 50 GGBA O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1cccs1 1891990 XKLYYDLIBKFZFJ-UHFFFAOYSA-N 395.443 3.198 5 50 GGBA CCC(=O)Nc1cccc(NC(=S)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 1172126 FNWMPTNHBMMKDP-UHFFFAOYSA-N 386.433 3.379 5 50 GGBA COc1ccc([N+](=O)[O-])cc1Nc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] 104230196 YEXXJEFWEIWKOX-UHFFFAOYSA-N 379.241 3.072 5 50 GGBA CC(C)(C)c1ccc(NC(=O)N2CCO[C@]3(CCCOC3)C2)cc1[N+](=O)[O-] 408142051 OMIDBWGBQKSBAA-LJQANCHMSA-N 377.441 3.306 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)C[C@@H](Sc2ccccc2C(=O)O)C1=O 19902808 CXAHMXIYRMPRFX-OAHLLOKOSA-N 386.385 3.026 5 50 GGBA Cc1cccc2c1CCCN2C(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 733946962 RLPMJNSAIYQUIQ-CQSZACIVSA-N 397.406 3.375 5 50 GGBA CCCCN(c1ccccc1C(=O)O)S(=O)(=O)c1cccc([N+](=O)[O-])c1 5027948 CNBGNXMULXRFPV-UHFFFAOYSA-N 378.406 3.288 5 50 GGBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2cc(Oc3ccccc3)cc([N+](=O)[O-])c2)n1 2766261 HVDDFEFAGZPZGS-UHFFFAOYSA-N 383.320 3.281 5 50 GGBA O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1 4543711 FHBSYDJDAZZZCC-UHFFFAOYSA-N 384.436 3.141 5 50 GGBA Cc1ccc(S(=O)(=O)N2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1 4543499 JXTXWWJTXDWRKA-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA Cn1c(Cc2ccccc2)nnc1SCC(=O)Nc1cccc([N+](=O)[O-])c1 1000187 OCNRYXYRPPBGCX-UHFFFAOYSA-N 383.433 3.045 5 50 GGBA COCCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@@H]1c1ccc([N+](=O)[O-])cc1 2704847 KAYXOMDKACZGJR-KRWDZBQOSA-N 398.346 3.032 5 50 GGBA CCCCOc1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NC)cc1 2891815 CHOWIYDCQORHMS-XMHGGMMESA-N 397.431 3.291 5 50 GGBA CCOc1cc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)ccc1OC 4746023 WPZGTBBBPLDQEC-UHFFFAOYSA-N 385.464 3.320 5 50 GGBA CC(=O)c1ccc(N2C[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c([N+](=O)[O-])c1 241173076 KFUBVNLPHGTSSK-RHSMWYFYSA-N 375.425 3.243 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc2ncc(Br)cn2n1 4809996 ONEOLMBHCGMJJI-UHFFFAOYSA-N 396.588 3.306 5 50 GGBA O=C1N/C(=C/c2ccc(Cl)c([N+](=O)[O-])c2)C(=O)N1Cc1ccc(F)cc1 4845738 FUHYWSKSAUZWHP-VGOFMYFVSA-N 375.743 3.480 5 50 GGBA O=[N+]([O-])c1cccc(COc2ccc(CO)cc2I)c1 1147916 ADBBSQWQZTUEKO-UHFFFAOYSA-N 385.157 3.271 5 50 GGBA CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)S(=O)(=O)c1cccs1 134616031 GXWGRKLPLRQYPZ-UHFFFAOYSA-N 379.419 3.132 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1 5042002 NSGXVJWDMMDVLL-UHFFFAOYSA-N 384.392 3.483 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 831858 BIJFKIAHWPDKMW-GOSISDBHSA-N 381.388 3.308 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)cc1C(=O)O 4690570 IDZKDRFBGNXBLB-UHFFFAOYSA-N 379.166 3.237 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cnn(Cc3cccc(Cl)c3)c2)c1 6373288 HQDCEMHUHWRZCZ-UHFFFAOYSA-N 392.824 3.294 5 50 GGBA CC1=C(C(=O)OCc2ccc(C)cc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 1189068 QLEIRTMAPGNDKF-SFHVURJKSA-N 381.388 3.275 5 50 GGBA O=C(N[C@@H]1CCCC[C@@H]1C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc12 117235154 WLQCCVLDICUAER-GXTWGEPZSA-N 383.326 3.287 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])N2C(=O)CCSC2=N1 2840527 VKEFXCLXSSWRPC-MRXNPFEDSA-N 389.433 3.197 5 50 GGBA COc1cccc([C@H]2C=C(c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 101198596 CPCKRDFRJNDAIK-MRXNPFEDSA-N 379.376 3.260 5 50 GGBA O=C(Oc1ccccc1N1C(=O)[C@H]2CC=CC[C@@H]2C1=O)c1ccc([N+](=O)[O-])cc1 18141470 DZWQNUHPXYZDBG-HOTGVXAUSA-N 392.367 3.270 5 50 GGBA CCOC(=O)[C@@]1(C)C=C(Nc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1 100718510 BEHLJJYIXXDXLC-HXUWFJFHSA-N 381.388 3.259 5 50 GGBA CNS(=O)(=O)c1ccc(N2CC3(CCC3)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 432143232 LUZVVTJEYZEYKI-GOSISDBHSA-N 387.461 3.235 5 50 GGBA COc1ccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1[N+](=O)[O-] 55082800 VBBQQIYJRYHDKX-VMPITWQZSA-N 381.432 3.075 5 50 GGBA Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 4011997 ZAILWGBGUHETBX-MJGOQNOKSA-N 396.403 3.260 5 50 GGBA O=C(COC(=O)c1cccc(NC(=O)C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 990374 CJHLPQLNQOYXGZ-UHFFFAOYSA-N 396.277 3.135 5 50 GGBA CCOC(=O)c1c(NC(=O)c2c([N+](=O)[O-])cnn2CC)sc2c1CCCC2 672140 GHGUOAYYKVIOTA-UHFFFAOYSA-N 392.437 3.181 5 50 GGBA Cc1ccc(S(=O)(=O)c2c(N)c3nccn3c3nc4ccccc4nc23)cc1 6143679 HYXKTHDUWYMDRJ-UHFFFAOYSA-N 389.440 3.154 5 50 GGBA O=C(c1ccn(COc2ccc([N+](=O)[O-])cc2Cl)n1)N1CCCCCC1 2799703 JYZUKQXNJLPGAY-UHFFFAOYSA-N 378.816 3.497 5 50 GGBA CCOC(=O)c1cnc2c(ccc3ccccc32)c1NCCN1CCOCC1 19791737 LYJYVTHTCBHPRJ-UHFFFAOYSA-N 379.460 3.309 5 50 GGBA Cc1ccc(C(=O)COC(=O)CCCC(=O)NC2CCCCC2)cc1[N+](=O)[O-] 4845629 ZWADSOCEUCGYDD-UHFFFAOYSA-N 390.436 3.248 5 50 GGBA COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2c1c(=O)[nH]c(=S)n2C1CC1 20608040 XDAUAEOOSCHTSP-UHFFFAOYSA-N 398.400 3.151 5 50 GGBA Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 225437389 UEOKBEBUNBXUDK-UHFFFAOYSA-N 389.375 3.126 5 50 GGBA CC1=C(C(=O)Nc2cc(C)ccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1137260 IAEMKYMBDQHBFF-SFHVURJKSA-N 380.404 3.478 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 845680 OSDGOZWRPWSDKL-KRWDZBQOSA-N 382.445 3.335 5 50 GGBA CCOc1ccc(NC(=O)C[C@H]2Sc3ccccc3NC2=O)c([N+](=O)[O-])c1 4263628 IWNQKGVTDXPQBE-MRXNPFEDSA-N 387.417 3.435 5 50 GGBA Cc1ccc(OCc2ccc(C(=O)N(C)Cc3ccnn3C)o2)c([N+](=O)[O-])c1 2796348 ZOCBCCGNWWFLLX-UHFFFAOYSA-N 384.392 3.081 5 50 GGBA Cc1ccc(OCc2ccc(C(=O)NCc3cc(C)n(C)n3)o2)c([N+](=O)[O-])c1 2730038 RZMGLPWSHZTOCO-UHFFFAOYSA-N 384.392 3.047 5 50 GGBA COC(=O)c1ccccc1NC(=O)c1ccccc1Cn1nc([N+](=O)[O-])cc1C 2796350 UTPCFHCOKLHOKL-UHFFFAOYSA-N 394.387 3.187 5 50 GGBA O=C(Nc1ccn(C23CC4CC(CC(C4)C2)C3)n1)c1n[nH]c([N+](=O)[O-])c1Cl 17079802 AFJJQDBPFYNFJJ-UHFFFAOYSA-N 390.831 3.345 5 50 GGBA O=c1c2cc3c(=O)n(Cc4ccccn4)ccc3nc2ccn1Cc1ccccc1 40398773 JYKULDOVTCIZHQ-UHFFFAOYSA-N 394.434 3.203 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 4194869 DMNJUFKPVSYOML-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA O=c1[nH]c(O)nc(/C=C/c2ccc(OCc3ccc(F)cc3)cc2)c1[N+](=O)[O-] 5041190 WYQRQXUOXVXWDX-BJMVGYQFSA-N 383.335 3.272 5 50 GGBA O=C(c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])c3cccnc23)CC1 4083482 XWHCPTZFBOMGAT-UHFFFAOYSA-N 380.379 3.245 5 50 GGBA Cc1cccc(C)c1N1CCc2cnn(S(=O)(=O)c3ccccc3[N+](=O)[O-])c21 754411 ZIGPDTRQLCCHTF-UHFFFAOYSA-N 398.444 3.339 5 50 GGBA Cc1nn(C)c(C(=O)Nc2ccc3c(C(F)(F)F)cc(=O)oc3c2)c1[N+](=O)[O-] 2486614 IICDRWAXGPSNQF-UHFFFAOYSA-N 396.281 3.014 5 50 GGBA CCCOc1ccc(C(=O)OCCNc2ccc3nonc3c2[N+](=O)[O-])cc1 6636281 AXSGPAOYKYYARO-UHFFFAOYSA-N 386.364 3.189 5 50 GGBA CC(C)(C)c1ccc(C(=O)NCC(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1 1854612 ZUJGEBLRZXKJKW-UHFFFAOYSA-N 398.415 3.048 5 50 GGBA Cc1ccc(C(=O)NC(=S)Nc2ccc(Cl)c(C(=O)O)c2)cc1[N+](=O)[O-] 3001261 XYXKEAAOMMINGM-UHFFFAOYSA-N 393.808 3.382 5 50 GGBA O=c1c(Cl)c(NCCNc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1 4703730 YBUOYTSUPXRSAP-UHFFFAOYSA-N 385.811 3.318 5 50 GGBA O=C(O)c1ccc(N2CCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 4013670 KSDVAPCASJRMAD-UHFFFAOYSA-N 375.812 3.269 5 50 GGBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCO[C@@H](c2cccc(O)c2)C1 121601432 ZTNHUHXSJGJYGS-LJQANCHMSA-N 385.420 3.011 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)NCc1ccc(-n2cccn2)cc1 5041211 ILJCLWFWSKIIPV-UHFFFAOYSA-N 383.433 3.276 5 50 GGBA C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 225385042 DURNGRGZAUNRDK-LAUBAEHRSA-N 394.475 3.079 5 50 GGBA COc1cc(C(=O)NC[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC(F)F 225481367 KSWAPXXCWVXGNN-QMMMGPOBSA-N 380.294 3.370 5 50 GGBA COc1ccc(Cc2nnc(NC(=O)Cc3ccccc3[N+](=O)[O-])s2)cc1 1142657 YIPTUVJITWDBHA-UHFFFAOYSA-N 384.417 3.227 5 50 GGBA O=[N+]([O-])c1ccccc1CN1CCC(N2CCN(c3ccccc3)CC2)CC1 4712107 SPNIRPSKKACUPB-UHFFFAOYSA-N 380.492 3.381 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1cccc(I)c1 4546035 AETMNAKGODLWHT-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA Cc1ccn(CC2CCN(C(=O)OCc3ccccc3)CC2)c(=O)c1[N+](=O)[O-] 170601464 PCLVHYPSGMVVSM-UHFFFAOYSA-N 385.420 3.114 5 50 GGBA COc1ccc(CCN(C)Cc2cc(OC)c(O)c([N+](=O)[O-])c2)cc1OC 4948449 CEOFMFCLPKGODH-UHFFFAOYSA-N 376.409 3.001 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)NCCSCc2ccccc2Cl)cc1 2864302 QGMBWVAOCPPKJT-UHFFFAOYSA-N 386.882 3.460 5 50 GGBA O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1C(F)(F)F 2325874313 IAIVOOPEKHDWIF-UHFFFAOYSA-N 378.270 3.046 5 50 GGBA CC1=C(C(=O)Nc2ccc(F)c(F)c2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 6782655 UTTYSEQVGDIPIS-INIZCTEOSA-N 388.330 3.140 5 50 GGBA CCN(CC)CCNc1ccc([N+](=O)[O-])c2[nH]c3ccc(OC)cc3c(=O)c12 34142905 HGCUZKFNPOOGSK-UHFFFAOYSA-N 384.436 3.352 5 50 GGBA O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)C1CCC(C(F)(F)F)CC1)CC2 408462191 YDQRCSDBPKSTGS-UHFFFAOYSA-N 392.399 3.404 5 50 GGBA O=C(Cc1ccccc1)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@@]1(O)C(F)(F)F 1214642 PMVWPIZSMPHRPE-QGZVFWFLSA-N 393.321 3.025 5 50 GGBA COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1I 4591428 QDGZSCPMNOOCNK-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1ccc(Cl)c([N+](=O)[O-])c1 2797061 SADOPKDBANLCGG-UHFFFAOYSA-N 394.811 3.171 5 50 GGBA CN(C)c1cc(F)c(C(=O)N2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-] 253426040 FMUDLYGTAFPXBM-UHFFFAOYSA-N 379.775 3.493 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1 1147542 QTNTWKSZEZLNMP-VMPITWQZSA-N 388.376 3.281 5 50 GGBA COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 5102368 MYAYTARWZGJOEQ-MRXNPFEDSA-N 387.417 3.129 5 50 GGBA O=[N+]([O-])c1ccc(N2CCC([C@@H](O)c3ncc[nH]3)CC2)nc1-c1ccccc1 170088706 SHCZPZBIBUUHIL-LJQANCHMSA-N 379.420 3.330 5 50 GGBA CCC(=O)Nc1ccc(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 1180952 GPTZUFQNYCYCDB-IZZDOVSWSA-N 398.444 3.470 5 50 GGBA O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1C[C@@]12CCc1ccccc12 439191394 UTCQYVWUPLWQBO-OXJNMPFZSA-N 375.388 3.223 5 50 GGBA O=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1[N+](=O)[O-] 672193 RZZTZTRPVLYQLA-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA CC(C)(C)NC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccc([N+](=O)[O-])cc1 4742896 USYCMSAZWZYTRR-SFQUDFHCSA-N 385.395 3.420 5 50 GGBA COc1ccc(-n2nc([N+](=O)[O-])c(Nc3ccc(C)cc3Cl)[n+]2[O-])cc1 4828003 ANSKOKHNLXCNQJ-UHFFFAOYSA-N 375.772 3.128 5 50 GGBA O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1ccccc1[N+](=O)[O-] 958046 GVVCGXGGLSOZFR-UHFFFAOYSA-N 398.400 3.043 5 50 GGBA O=C(c1c2ccccc2cc2ccccc12)N1CCC2(CC1)OCC[C@H](O)[C@@H]2O 2356145801 ITRNUASLUAMEOE-UNMCSNQZSA-N 391.467 3.110 5 50 GGBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1S(=O)(=O)c1ccccc1 4687392 JYFHWOHMCMFXAO-ZDUSSCGKSA-N 395.868 3.148 5 50 GGBA COC(=O)c1cc(C(=O)Nc2ccccc2Br)cc([N+](=O)[O-])c1 1182959 GKMXTEKYVXMELT-UHFFFAOYSA-N 379.166 3.396 5 50 GGBA O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](C(=O)O)c1ccccc1 65364077 ABLLRQSYEDVMFM-OAQYLSRUSA-N 386.407 3.097 5 50 GGBA Cn1c2ccccc2n2c(SCc3nc4ccc([N+](=O)[O-])cc4[nH]3)nnc12 4149113 GHJKSFPXDAPLNL-UHFFFAOYSA-N 379.405 3.298 5 50 GGBA Cc1nn(C[C@@H](C)c2nc3c4c(C)c(C)sc4ncn3n2)c(C)c1[N+](=O)[O-] 2808283 HRTOBLYTDCKJRV-MRVPVSSYSA-N 385.453 3.481 5 50 GGBA O=C1NCCc2c(NCc3ccc(Br)cc3[N+](=O)[O-])cccc21 1875329520 APYIRAHDKIACRA-UHFFFAOYSA-N 376.210 3.255 5 50 GGBA Cc1cc(F)c(F)cc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 4498411 WHHATXFPOBZEHO-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA O=C(Nc1nccs1)c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 2933543 ZJDJHQNOXNHHKL-UHFFFAOYSA-N 394.368 3.104 5 50 GGBA COc1ccccc1N1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 752480 LJKNSKVLUIYTEJ-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=[N+]([O-])c1c(Nc2ccccc2Cl)cc(N2CCOCC2)c2nonc12 4142144 NIGLLCWAQDESLV-UHFFFAOYSA-N 375.772 3.365 5 50 GGBA COc1ccc(CCNc2cc(N3CCOCC3)ccc2[N+](=O)[O-])cc1OC 4687372 QHOSSPKSJHOFNA-UHFFFAOYSA-N 387.436 3.103 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 1154367 XDWZBVOUNLOZSA-GOSISDBHSA-N 380.404 3.478 5 50 GGBA COc1ccccc1[C@H]1SCCN1S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4903148 OKACGWRJTOAVLI-QGZVFWFLSA-N 394.474 3.348 5 50 GGBA COc1ccc(C2=NN(C(=O)CCC(=O)O)[C@@H](c3cccc([N+](=O)[O-])c3)C2)cc1 647487 BWDNJAUUIINZMS-GOSISDBHSA-N 397.387 3.146 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)Nc1cc(OC)c(OC)c(OC)c1 5041970 CKXWMXGWKCJBRD-UHFFFAOYSA-N 377.353 3.273 5 50 GGBA O=C(Nc1cc(SCCO)cc([N+](=O)[O-])c1)c1ccc(Br)o1 2765280 QVTJMESLRGZFQB-UHFFFAOYSA-N 387.211 3.287 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 55544029 YZKHNZSEUGCODI-UHFFFAOYSA-N 376.800 3.479 5 50 GGBA COc1cc(CN2CCN(c3ccccc3Cl)CC2)cc([N+](=O)[O-])c1O 1227111 LPJDJXJLZAUXMT-UHFFFAOYSA-N 377.828 3.285 5 50 GGBA Cc1nn(Cc2c(C(=O)Nc3ccc(Cl)cn3)noc2C)c(C)c1[N+](=O)[O-] 13961481 BGSHTTDLWHEGGK-UHFFFAOYSA-N 390.787 3.054 5 50 GGBA COC(=O)c1cc(C(=O)N2CCC(Cc3ccccc3)CC2)cc([N+](=O)[O-])c1 651290 ZSFCYSOHLQOEBF-UHFFFAOYSA-N 382.416 3.476 5 50 GGBA O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1I 1157877 KOAZGKXQSAPJNH-UHFFFAOYSA-N 398.156 3.217 5 50 GGBA CCc1c(C)sc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1C(=O)OC 4750546 WOTWXBBWFWGKKN-UHFFFAOYSA-N 378.406 3.331 5 50 GGBA Cc1c(CN(C)CC(=O)Nc2nnc(CC(C)C)s2)cccc1[N+](=O)[O-] 225520417 UMYXBUAQNCMSBO-UHFFFAOYSA-N 377.470 3.024 5 50 GGBA COc1ccc([C@H]2SCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 5016934 PEYYWPOZIVEQBO-MRXNPFEDSA-N 380.447 3.040 5 50 GGBA CC(C)NC(=O)c1ccc(N[C@H](CO)Cc2c[nH]c3ccccc23)c([N+](=O)[O-])c1 463060769 LJKDVILOGUIFJD-INIZCTEOSA-N 396.447 3.230 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 792945 GUKLNNOASPYBFV-SFHVURJKSA-N 381.388 3.308 5 50 GGBA CCCCn1c(=O)c(C(=O)Nc2ncc([N+](=O)[O-])s2)c(O)c2ccccc21 100504360 RTIGRDJIRSZGGW-UHFFFAOYSA-N 388.405 3.124 5 50 GGBA O=C(c1ccccc1[N+](=O)[O-])N1CCN(Cc2ccc(F)cc2Cl)CC1 20472601 LMHBEYKRVONYCQ-UHFFFAOYSA-N 377.803 3.345 5 50 GGBA NC(=O)N1CCc2ccc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)cc21 428028491 AAHBRZTYCPJYKE-UHFFFAOYSA-N 398.422 3.375 5 50 GGBA CCOc1ccc(NC(=O)c2c(Br)cnn2CC)c([N+](=O)[O-])c1 5674592 LVMODGSQZUXYKM-UHFFFAOYSA-N 383.202 3.225 5 50 GGBA O=C(Nc1ccccc1[N+](=O)[O-])c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O 5077795 LRSRAUYQGNROMQ-UHFFFAOYSA-N 391.339 3.236 5 50 GGBA COc1cccc([C@@H]2C[C@@H](c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 2914036 XJMGABAWHPNIEG-HOTGVXAUSA-N 381.392 3.350 5 50 GGBA COc1cccc(C(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 5102884 OMSZURMVOJJLNS-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C1c2cccc([N+](=O)[O-])c2C(=O)N1c1cnn(Cc2ccc(Cl)cc2)c1 13961391 FGWGACTVMYAMLG-UHFFFAOYSA-N 382.763 3.294 5 50 GGBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2172254 BZVVOJFIBFIPGF-UHFFFAOYSA-N 399.146 3.387 5 50 GGBA CCCC(=O)Nc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 4676871 YHDDPLSFVRAEFT-UHFFFAOYSA-N 396.447 3.296 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H]1COc2ccccc2O1 4040796 FRYGYEHYFDYSOW-AWEZNQCLSA-N 379.166 3.136 5 50 GGBA O=C(NCc1ccccc1)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1 4844190 XMPLPCDAOAXXRG-QGOAFFKASA-N 391.383 3.275 5 50 GGBA O=C(Nc1ccc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1)c1cccnc1 71767020 KXZSDNDXTBGRRW-UHFFFAOYSA-N 383.385 3.075 5 50 GGBA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 1168749 IUYBHPNUCMTLDS-KRWDZBQOSA-N 385.376 3.354 5 50 GGBA O=c1c2cc3c(=O)n(-c4ccccc4)ccc3nc2ccn1Cc1ccccn1 36125582 TVRVDBBACRDJGF-UHFFFAOYSA-N 380.407 3.144 5 50 GGBA COc1ccc(CN2CCN(c3c([N+](=O)[O-])ccc4c3CCN4)CC2)cc1F 170601972 DKETYUMDTPAWHD-UHFFFAOYSA-N 386.427 3.033 5 50 GGBA CCOc1cc(C=O)cc(Cl)c1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 2986679 PVEWWPXPDXAWAX-UHFFFAOYSA-N 385.781 3.227 5 50 GGBA CCOC1(c2nc([C@H]3CCCO3)no2)CCN(c2ccccc2[N+](=O)[O-])CC1 225838603 DRMACAFKJOHCBM-MRXNPFEDSA-N 388.424 3.362 5 50 GGBA O=[N+]([O-])c1cc([N+](=O)[O-])c2cccnc2c1NNc1nncc2ccccc12 13576486 SPFNDBITVSZNEN-UHFFFAOYSA-N 377.320 3.433 5 50 GGBA O=[N+]([O-])c1ccc(-n2nc(-c3ccccc3)n[n+]2-c2ccc([N+](=O)[O-])cc2)cc1 43794440 NYPAVSNOWQLDSO-UHFFFAOYSA-N 389.351 3.027 5 50 GGBA Cc1nc(NC(=O)c2csc([N+](=O)[O-])c2)ccc1I 170654481 UMUDTBWSLLBYPY-UHFFFAOYSA-N 389.174 3.217 5 50 GGBA CCOc1ccccc1N1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 997964 RTFGARSYPMRHIU-FMIVXFBMSA-N 381.432 3.356 5 50 GGBA COc1ccc(N2C3=[N+](CCCCC3)C[C@]2(O)c2cccc([N+](=O)[O-])c2)cc1 17159650 BWKFRWKJOGXHGF-NRFANRHFSA-N 382.440 3.254 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1I 1157552 RBSJRIFVWMBLHF-UHFFFAOYSA-N 398.156 3.217 5 50 GGBA COc1ccccc1-c1n[nH]c(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1 4581323 IFVFIWLPAURAFW-UHFFFAOYSA-N 385.405 3.119 5 50 GGBA O=C(Cc1ccc(Br)cc1)OCC(=O)c1cccc([N+](=O)[O-])c1 1150211 KCEXRWJOSIGKPK-UHFFFAOYSA-N 378.178 3.326 5 50 GGBA CN1CCN(C(=O)c2cccc(Oc3c(Cl)cccc3[N+](=O)[O-])c2)CC1 4857485 WLNRSFNWQNCZMZ-UHFFFAOYSA-N 375.812 3.428 5 50 GGBA O=C(O)C[C@@H]1CCCN1C(=O)c1cc(F)cc2c(O)c3cc(F)ccc3nc12 262998425 QXWMLDNNAOYJPU-LBPRGKRZSA-N 386.354 3.451 5 50 GGBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1 4550729 QGSBGDYDUAZFDY-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(N)cc1 4687269 AEOIPLQHRNTCNP-UHFFFAOYSA-N 398.448 3.186 5 50 GGBA Cc1ncsc1CN(C)S(=O)(=O)c1cc([N+](=O)[O-])cc(Cl)c1Cl 225834862 XSDPPTJGGIKIGO-UHFFFAOYSA-N 396.277 3.487 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccccc1Br 4037816 RORDUDHOWYMZAH-UHFFFAOYSA-N 381.182 3.383 5 50 GGBA CCCOc1ccc(N2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1 2812322 PHKKBYHOGXJWFI-CQSZACIVSA-N 383.404 3.375 5 50 GGBA COc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1I 2969473 LIDINAWFJHSUSZ-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CC[C@@](CO)(c2ccccc2)C1 366025791 XYCCXSJJPLEOMM-RUZDIDTESA-N 398.462 3.458 5 50 GGBA CCOC(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1 1080547 DFXYGQZJSLTJGV-UHFFFAOYSA-N 382.328 3.130 5 50 GGBA CC(C)C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 991249 CQJZLRLAQGNNDS-KRWDZBQOSA-N 381.388 3.244 5 50 GGBA CC(C)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(c2ccccc2)CC1 5034559 CSWWDFZZCZFQKX-UHFFFAOYSA-N 389.477 3.229 5 50 GGBA C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1ccc2c(c1)OCCO2 225748235 WPZCIUOCGDEOHJ-LLVKDONJSA-N 389.383 3.062 5 50 GGBA COc1cc(C(=O)Nc2nnc(CC(C)(C)C)s2)c([N+](=O)[O-])cc1OC 1113402 BNZUAGKBMLKNPG-UHFFFAOYSA-N 380.426 3.304 5 50 GGBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1ccc(F)cc1F 4918940 JOCAJCXHTBLALS-NSHDSACASA-N 379.338 3.363 5 50 GGBA Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 126383165 YTICXATZALUELW-ROUUACIJSA-N 390.484 3.101 5 50 GGBA CC(=O)Nc1nonc1-c1nc2ccccc2n1Cc1ccc([N+](=O)[O-])cc1 860593 JMKLCMNIEZSMDW-UHFFFAOYSA-N 378.348 3.001 5 50 GGBA COc1cccc(N2CCC(NC(=O)CCc3ccccc3)CC2)c1[N+](=O)[O-] 170598666 QJBGNFUOIOMDNC-UHFFFAOYSA-N 383.448 3.321 5 50 GGBA COc1cc(NC(=O)Cn2nc(C(F)(F)F)c(Cl)c2C)cc([N+](=O)[O-])c1 848506 MCTONIGJVVJMNG-UHFFFAOYSA-N 392.721 3.419 5 50 GGBA COc1ccc(C2=NN(C(=O)CCC(=O)O)[C@H](c3cccc([N+](=O)[O-])c3)C2)cc1 647489 BWDNJAUUIINZMS-SFHVURJKSA-N 397.387 3.146 5 50 GGBA COc1ccc(NC(=O)c2ccc(Cn3nc([N+](=O)[O-])cc3C)cc2)c(OC)c1 2734357 OEULKMOKDOSCNI-UHFFFAOYSA-N 396.403 3.418 5 50 GGBA COC(=O)c1cc(C)sc1NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])c(C)c1 4749997 OXECEIMEUGJXHB-NSHDSACASA-N 378.406 3.466 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1 845694 QODHZTSIVZRQRQ-KRWDZBQOSA-N 382.445 3.335 5 50 GGBA CC(C)(C)OC(=O)CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 4958076 OQALHETVXZLCLL-UHFFFAOYSA-N 392.433 3.132 5 50 GGBA C[C@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1S(=O)(=O)c1ccc(Cl)cc1 4131934 VMIJGRRSWDHVNC-ZDUSSCGKSA-N 395.868 3.148 5 50 GGBA CCOC(=O)c1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(Cl)cc2)c1 1401059 SEHSUMOUWUIOQG-UHFFFAOYSA-N 383.809 3.399 5 50 GGBA CC(C)(C)OC(=O)n1nc(I)c2ccc([N+](=O)[O-])cc21 71864045 LDINLYRPDJPXTG-UHFFFAOYSA-N 389.149 3.332 5 50 GGBA C[C@](O)(/C=C1/Oc2ccc([N+](=O)[O-])cc2[C@H]1N1CCOCC1)[C@H]1C[C@H]2C=C[C@H]1C2 245256370 PSHLMLNENHNYFX-JXJFUXRPSA-N 398.459 3.208 5 50 GGBA Cc1cc(C(=O)N2CCC(N3CCc4ccccc43)CC2)c(N)c([N+](=O)[O-])c1 225736858 XRKWPMQSLZBSQN-UHFFFAOYSA-N 380.448 3.153 5 50 GGBA CC1=C(C(=O)Nc2cc(C)ccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1137261 IAEMKYMBDQHBFF-GOSISDBHSA-N 380.404 3.478 5 50 GGBA Cc1ccccc1Cn1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1 17077910 LFYZAXHJLUUDJI-UHFFFAOYSA-N 381.348 3.309 5 50 GGBA O=C(Nc1nccs1)c1cccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1 2900171 DWXBVDDRAOSEPV-UHFFFAOYSA-N 394.368 3.104 5 50 GGBA COc1cc(NC(=O)c2ccccc2Cn2cc([N+](=O)[O-])cn2)cc([N+](=O)[O-])c1 2796290 REPUVSDAFJJNIN-UHFFFAOYSA-N 397.347 3.009 5 50 GGBA O=C1C[C@H]2c3ccccc3[C@H]1[C@@H]1C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]12 245240537 ZXEWWXJSZFWEBU-XKDXWZMYSA-N 396.786 3.208 5 50 GGBA O=C(CSc1nc(-c2cccc([N+](=O)[O-])c2)cs1)NC[C@@H]1CCCO1 2890897 OTLQOSXXZJCAGN-ZDUSSCGKSA-N 379.463 3.106 5 50 GGBA CC(C)NC(=O)c1ccc(N[C@@H](CO)Cc2c[nH]c3ccccc23)c([N+](=O)[O-])c1 463060772 LJKDVILOGUIFJD-MRXNPFEDSA-N 396.447 3.230 5 50 GGBA Cc1ccccc1[C@@H]1C[C@H]1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 126463418 UXQXPSYNGVHNMF-RPVQJOFSSA-N 397.406 3.068 5 50 GGBA CC1=C(C(=O)OCCOc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 17080969 HVZCUZHCWGNISJ-GOSISDBHSA-N 396.399 3.095 5 50 GGBA COC(=O)N1CCC([C@@H](C)NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 170600786 VARUQINDBFTCOM-CHWSQXEVSA-N 395.481 3.059 5 50 GGBA O=[N+]([O-])c1ccc(N2CCC([C@H](O)c3ncc[nH]3)CC2)nc1-c1ccccc1 170088704 SHCZPZBIBUUHIL-IBGZPJMESA-N 379.420 3.330 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(C3CCN(CCc4ccccc4)CC3)CC2)cc1 4981305 CPJPTVNQRYLKET-UHFFFAOYSA-N 394.519 3.424 5 50 GGBA CN(C[C@H](O)C(F)(F)F)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 180790199 JMVVJCLQNJURLN-HNNXBMFYSA-N 383.326 3.334 5 50 GGBA Cc1cc(C)c(S(=O)(=O)N[C@H](CC(=O)O)c2cccc([N+](=O)[O-])c2)c(C)c1 4580687 HRIFAYUIKISDQB-MRXNPFEDSA-N 392.433 3.014 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 1213130 FZYKPCUPBIWGIX-KRWDZBQOSA-N 380.400 3.258 5 50 GGBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCNS(=O)(=O)c1ccccc1 4575570 FYAIVXUSZYABFE-UHFFFAOYSA-N 389.355 3.004 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1C 831859 BIJFKIAHWPDKMW-SFHVURJKSA-N 381.388 3.308 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 1131223 JJSBVCXBAJZYOO-SFHVURJKSA-N 390.403 3.422 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 845676 JUQUKERQNHYTBJ-KRWDZBQOSA-N 382.445 3.335 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(I)cc1 1122852 NWPNUHRLUQVRDM-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA CC(=O)c1cccc(NC(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 1133154 YQULWOUBIMNJMY-UHFFFAOYSA-N 395.415 3.288 5 50 GGBA O=[N+]([O-])c1ccc(COc2ccc(CO)cc2I)cc1 1148500 DXFPFFWXINFTTK-UHFFFAOYSA-N 385.157 3.271 5 50 GGBA CCOC(=O)N1CCN(C(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)CC1 4832904 YDBJAKZPPBMRGL-UHFFFAOYSA-N 399.403 3.301 5 50 GGBA O=C(Nc1ccc(Cl)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NCCCO 4982051 AIGMBDJCESQVEW-UHFFFAOYSA-N 394.771 3.203 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@@H](C)c1ccc2c(c1)OCO2 4999199 UOVPCMHQWQCFIA-JTQLQIEISA-N 375.406 3.380 5 50 GGBA CCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 1173956 UIBFNPXGQFSYCI-UHFFFAOYSA-N 386.433 3.460 5 50 GGBA CC[C@@H](Sc1nnnn1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 2848587 VZYYFARKJASXLD-OAHLLOKOSA-N 384.421 3.080 5 50 GGBA COc1ccc(NC(=O)COc2ccccc2Br)c([N+](=O)[O-])c1 4037817 QJKFVBALAHJFCV-UHFFFAOYSA-N 381.182 3.383 5 50 GGBA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccc(Br)cc1[N+](=O)[O-] 101356368 BPWMWNACLRHPAX-QYAIJTBZSA-N 377.194 3.059 5 50 GGBA Cc1nn(CC(=O)Nc2c(F)cc(F)cc2Br)c(C)c1[N+](=O)[O-] 826504 RRGINSPMAOGTJL-UHFFFAOYSA-N 389.156 3.088 5 50 GGBA Cc1cc(C)cc(N([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 2871894 WSBXRICCCTZEAP-CQSZACIVSA-N 391.449 3.005 5 50 GGBA C[C@H](Cc1ccccc1[N+](=O)[O-])[C@@H](C)N[C@@H]1CCCN(CC(F)(F)F)C1=O 225514528 JRYVQVSWNRULKX-UMVBOHGHSA-N 387.402 3.305 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C2CCCCC[C@@H]2[C@@]1(O)C(F)(F)F 845879 QYZFHWDKCCIZQU-XJKSGUPXSA-N 385.342 3.167 5 50 GGBA Cc1csc(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1 2871819 NQVRIQCDKNHKCA-UHFFFAOYSA-N 377.407 3.141 5 50 GGBA CCCOC(=O)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 2135245 BGNCGDDWNNLPGC-UHFFFAOYSA-N 387.417 3.288 5 50 GGBA O=C(O)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1Cl 3000871 HYOUNLGVEAWYQJ-UHFFFAOYSA-N 379.781 3.073 5 50 GGBA Cc1csc(CNS(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2Cl)n1 225833481 REEMRIUVDYDJSH-UHFFFAOYSA-N 382.250 3.145 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)N(c1nccs1)C2=O 3212575 QPSGEPIELGYBCR-UHFFFAOYSA-N 379.353 3.083 5 50 GGBA CC1=C(C(=O)Nc2ccccc2F)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 4990972 WOABXYOLHCIPNQ-MRXNPFEDSA-N 386.408 3.165 5 50 GGBA CC[C@H](Sc1nnnn1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 2848586 VZYYFARKJASXLD-HNNXBMFYSA-N 384.421 3.080 5 50 GGBA O=c1c(Cc2c(F)cccc2Cl)c(O)ccn1Nc1ncccc1[N+](=O)[O-] 4050788 HXJWOLAIWKGCRS-UHFFFAOYSA-N 390.758 3.116 5 50 GGBA Cc1nc(N2CCOC[C@@H]2c2c(C)nn(-c3ccccc3)c2C)ncc1[N+](=O)[O-] 952887192 KZKYYBGWTGRICP-GOSISDBHSA-N 394.435 3.074 5 50 GGBA CC1=C(C(=O)OCCOc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 4913155 NOFPUFQEFGLMFW-KRWDZBQOSA-N 396.399 3.095 5 50 GGBA O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4703631 GGPBHMDZHKEWNL-UHFFFAOYSA-N 398.438 3.297 5 50 GGBA CC[C@@H](Sc1nnnn1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4698888 KOCRXGCDCFBLKZ-OAHLLOKOSA-N 384.421 3.080 5 50 GGBA COc1ccc(COC(=O)C2=C(C)NC(=O)C[C@@H]2c2cccc([N+](=O)[O-])c2)cc1 4916746 UAQFXJSGDUCXKU-GOSISDBHSA-N 396.399 3.224 5 50 GGBA O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H]1CC[C@H](C(=O)O)CC1 238900528 JFMKUABNQSWPOK-WKILWMFISA-N 392.455 3.162 5 50 GGBA Cc1cc(F)c(F)c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)c1 5044408 FEDLGNLRARBVDE-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA CCOc1ccc2[nH]/c(=N\S(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)sc2c1 5000157 PQIJPCDKDOBJBE-UHFFFAOYSA-N 393.446 3.134 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2[N+](=O)[O-])N2C(=O)CCSC2=N1 2840528 VKEFXCLXSSWRPC-INIZCTEOSA-N 389.433 3.197 5 50 GGBA Cc1cccc(NC(=O)NCCN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C 55545151 IDNLPWIAQZLOPQ-UHFFFAOYSA-N 397.479 3.155 5 50 GGBA COc1ccc(COC(=O)C2=C(C)NC(=O)C[C@H]2c2ccccc2[N+](=O)[O-])cc1 4913228 WRRZENSBGBXBTF-KRWDZBQOSA-N 396.399 3.224 5 50 GGBA CN(C(=O)OC(C)(C)C)[C@H](CNc1ncc([N+](=O)[O-])cn1)Cc1ccccc1 871073841 YUNQVPNFHIIXPQ-HNNXBMFYSA-N 387.440 3.275 5 50 GGBA COc1ccccc1N1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 997764 HQULFRAZWPSALG-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(c2ncncc2Cl)CC1 225491979 HSOLEAQYBZNXFS-UHFFFAOYSA-N 387.749 3.384 5 50 GGBA COC(=O)c1c(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)sc2c1CCCCC2 4686787 KXGSESNOXIYZOS-SNVBAGLBSA-N 392.437 3.108 5 50 GGBA CC(C)(C)N[S@](=NS(=O)(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 3121980 ZENNPEGQGWGSNA-DEOSSOPVSA-N 381.479 3.448 5 50 GGBA Cc1cc(C(F)(F)F)nn1CC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 2745206 BTOCFCHKWGFPPP-UHFFFAOYSA-N 385.327 3.367 5 50 GGBA C[C@H](OC(=O)c1ccc(C(=O)O)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 820182849 JTRRSZWNAZEHFV-JTQLQIEISA-N 383.316 3.261 5 50 GGBA O=C(Cn1cc(Nc2ccc3ncccc3c2[N+](=O)[O-])cn1)Nc1cccnc1 1875254557 ISZDUSHATPCONJ-UHFFFAOYSA-N 389.375 3.117 5 50 GGBA O=C(Nc1ccccc1[N+](=O)[O-])c1cc(S(=O)(=O)N2CCCCC2)cs1 4953617 MPXGNWOFCFYITN-UHFFFAOYSA-N 395.462 3.083 5 50 GGBA COC(=O)c1sc2cc(NC(=O)c3n[nH]cc3[N+](=O)[O-])ccc2c1Cl 6265869 CUZLFIBMJMMTGV-UHFFFAOYSA-N 380.769 3.225 5 50 GGBA O=c1[nH]c2c(c(=O)[nH]1)[C@H](c1cccc([N+](=O)[O-])c1)c1c(ccc3ccccc13)N2 4624102 OBGZEFXOPUQWRN-MRXNPFEDSA-N 386.367 3.362 5 50 GGBA O=C(OCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(Cl)c1 52521494 VNJGHIBVQCLSTC-UHFFFAOYSA-N 389.839 3.227 5 50 GGBA COc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 4703606 MNCNOOVDCBRWNU-UHFFFAOYSA-N 383.326 3.464 5 50 GGBA C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 170601132 UPBYJZHXRKQFTD-PYAUHKIHSA-N 389.452 3.370 5 50 GGBA COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc(C(=O)OC)c1 663192 PUAXFWOIHMENCO-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA Cc1ccccc1Oc1cc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)cc([N+](=O)[O-])c1 239125155 KABZEXOEDWBXCZ-NCXUSEDFSA-N 394.383 3.362 5 50 GGBA CN1C(=O)c2ccc(NC(=O)c3ccc(-c4cccc([N+](=O)[O-])c4)o3)cc2C1=O 1063053 FEFOORKNWTYJPK-UHFFFAOYSA-N 391.339 3.333 5 50 GGBA COc1ccc(NC(=S)NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1Cl 881992 AWFCCZIMSZZMEL-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA Cc1cc(F)c(NC(=O)NCCc2csc(N3CCCC3)n2)cc1[N+](=O)[O-] 225851080 RJLREZJVEPOGKI-UHFFFAOYSA-N 393.444 3.463 5 50 GGBA CCCCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(OC)cc1 5503659 RSRYEHDZSBDZMY-XMHGGMMESA-N 397.431 3.291 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(=O)N(c1cccc(O)c1)C2=O 3150568 AHFWJYTYVCEJIG-UHFFFAOYSA-N 388.335 3.332 5 50 GGBA Cn1cc([N+](=O)[O-])c(C(=O)Nc2cnn(Cc3ccc(Cl)cc3Cl)c2)n1 2756381 XDQZJGVZTGRGNG-UHFFFAOYSA-N 395.206 3.132 5 50 GGBA COc1ccc(CN2CCCN(c3c([N+](=O)[O-])ccc4c3CCN4)CC2)cc1 170601980 CHFAYHBHRUXNDY-UHFFFAOYSA-N 382.464 3.284 5 50 GGBA COc1ccc(OC)c(C(=O)c2coc3cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c23)c1 3182544 BCSAPBAFNHUAJG-UHFFFAOYSA-N 388.288 3.203 5 50 GGBA CN1CCN(c2ccc(C(=O)NC34CC5CC(CC(C5)C3)C4)cc2[N+](=O)[O-])CC1 4662871 MHCWMSWSQABZAL-UHFFFAOYSA-N 398.507 3.045 5 50 GGBA Cc1nc(N2CCC(C)CC2)nc(N2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] 4918592 OQOUUIGTOSQIBY-UHFFFAOYSA-N 396.495 3.256 5 50 GGBA CC(C)C(=O)Nc1cccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c1 1165478 AAXDQKMJGTUGIX-UHFFFAOYSA-N 386.433 3.316 5 50 GGBA Cc1ccc(Cn2ccc(NC(=O)CCCn3nc([N+](=O)[O-])cc3C)n2)cc1 2885045 BJPBAVYKZLSXDP-UHFFFAOYSA-N 382.424 3.072 5 50 GGBA O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879986 AHTAMHSLNMLENL-UHFFFAOYSA-N 390.783 3.119 5 50 GGBA COc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c(NC4CC4)c3)CC2)c1 4575225 DGICAXVMDXSPQW-UHFFFAOYSA-N 396.447 3.140 5 50 GGBA CC(C)NS(=O)(=O)c1ccc(N2CC[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])c1 241942316 ULOAPUMIOAMKFR-CABCVRRESA-N 381.498 3.298 5 50 GGBA C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 17000761 GBHHDWSSOJAWDH-TXEJJXNPSA-N 388.332 3.294 5 50 GGBA CCOC(=O)c1c(NC(=O)COc2ccccc2[N+](=O)[O-])sc2c1CCC2 1891907 GWYWXWPQDGMOHU-UHFFFAOYSA-N 390.417 3.339 5 50 GGBA COc1ccc(NC(=O)CSc2nnc(-c3ccccc3)n2C)c([N+](=O)[O-])c1 4695048 DOPPUGSOCSTQGJ-UHFFFAOYSA-N 399.432 3.130 5 50 GGBA Cc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3c3c(C)nc4ccccc4n23)cc1 1131346 WFOFCXNWTLURQC-UHFFFAOYSA-N 384.439 3.322 5 50 GGBA Cn1cc(CN2C[C@@H](O)[C@H](Cc3ccccc3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 898142204 LHXNKWYUFASWKQ-WIYYLYMNSA-N 392.459 3.031 5 50 GGBA CCOc1ccc(NC(=O)C[C@H]2Nc3cc(C)c(C)cc3NC2=O)c([N+](=O)[O-])c1 4143464 HUCRAAIIVOHMPA-QGZVFWFLSA-N 398.419 3.372 5 50 GGBA Cc1cc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2Cl)no1 225833974 SQANSDJPIXGOBP-UHFFFAOYSA-N 380.209 3.019 5 50 GGBA Cc1cc(C)c(NC(=O)CSc2nnc(-c3ccncc3)n2C)c([N+](=O)[O-])c1 4698050 SSYSPNJRGMBUQR-UHFFFAOYSA-N 398.448 3.133 5 50 GGBA COc1ccc(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)cc1 862150 WSSLUBSRKKDHDD-UHFFFAOYSA-N 399.432 3.130 5 50 GGBA COc1ccc(NC(=O)N2CCN(c3cc(C)c(F)cc3[N+](=O)[O-])CC2)cc1 63121417 BOEQAZPVJRQFDQ-UHFFFAOYSA-N 388.399 3.405 5 50 GGBA O=C(NC(=S)/N=c1/[nH]c(-c2ccc([N+](=O)[O-])cc2)cs1)c1ccccc1 2993524 IRDBQMPSBSOULB-UHFFFAOYSA-N 384.442 3.267 5 50 GGBA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1 1140778 AQTSRWYAMQUSHJ-LLVKDONJSA-N 388.376 3.141 5 50 GGBA Cc1nc(N2CCOC[C@H]2c2c(C)nn(-c3ccccc3)c2C)ncc1[N+](=O)[O-] 952887205 KZKYYBGWTGRICP-SFHVURJKSA-N 394.435 3.074 5 50 GGBA CCc1nnc2sc(-c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)nn12 2865852 AJSKMCKQOGPXGT-UHFFFAOYSA-N 384.377 3.169 5 50 GGBA CC(=O)N[C@H](NC(=S)Nc1ccc([N+](=O)[O-])cc1C)C(Cl)(Cl)Cl 4531818 AQKWOIFUHUHBMR-SNVBAGLBSA-N 399.687 3.022 5 50 GGBA O=C(c1cccc(Br)c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3879665 GKYXTJTXHQKWMQ-UHFFFAOYSA-N 390.237 3.320 5 50 GGBA O=C(NC(=S)Nc1ccccc1[N+](=O)[O-])c1ccccc1Br 4089203 SAIWOEOKTQNKER-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA NC(=O)c1cccc(N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] 225540460 FVIQUOLRYNRJFM-SFHVURJKSA-N 389.839 3.297 5 50 GGBA O=C(N[C@@H]1CCCC[C@H]1C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc12 117235158 WLQCCVLDICUAER-TZMCWYRMSA-N 383.326 3.287 5 50 GGBA C[C@@H](c1cccc(F)c1)N1CCN(c2cc3ncnc(O)c3cc2[N+](=O)[O-])CC1 302770059 BRZJGFUGNPKAHS-ZDUSSCGKSA-N 397.410 3.266 5 50 GGBA Cc1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NCC(C)C)cc1 2677590 SVEFGWNCVYRJHX-XDHOZWIPSA-N 381.432 3.446 5 50 GGBA COc1cccc([C@H]2C[C@@H](c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 2914034 XJMGABAWHPNIEG-JKSUJKDBSA-N 381.392 3.350 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1 4809421 HRDMMHTTWLTFHY-UHFFFAOYSA-N 395.400 3.105 5 50 GGBA O=[N+]([O-])c1cc(Cl)c(F)c(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)c1 225554160 IMWXZQDOYLSLFM-UHFFFAOYSA-N 396.787 3.374 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H]2CCCC[C@@]21c1ccccc1 134367257 CZKMBSLVWFWJJP-IIBYNOLFSA-N 379.416 3.461 5 50 GGBA Cc1cc(=O)oc2cc(OCC(=O)N3CCCc4ccccc43)c([N+](=O)[O-])cc12 937217 RCBSNMOBTGMMCI-UHFFFAOYSA-N 394.383 3.368 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccc(I)c1 1170338 DTHPFXMXRDXSAS-UHFFFAOYSA-N 382.157 3.381 5 50 GGBA CC(C)(C)Oc1ccc(C[C@H](NSc2ncccc2[N+](=O)[O-])C(=O)O)cc1 28631510 DTMLYWDPCJWGPQ-AWEZNQCLSA-N 391.449 3.460 5 50 GGBA C[C@H]1C[C@@H](C)CN(c2nc(O)c3c(n2)NC(=O)C[C@H]3c2ccccc2[N+](=O)[O-])C1 822355264 XGIVOGNBSOECIA-SCRDCRAPSA-N 397.435 3.047 5 50 GGBA CCCN(C[C@@H]1CCCCO1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] 170622695 GVYYIXSTNVOVBU-ZDUSSCGKSA-N 376.862 3.218 5 50 GGBA O=[N+]([O-])c1ccc2c(c1)[C@H](N1CCOCC1)/C(=C/COc1ccc(F)cc1)O2 19708469 KMVDMQZVRNHJDE-DNATVEMMSA-N 386.379 3.463 5 50 GGBA O=C(COC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ccc(Br)cc1 36092124 NIFIIRYSZZNQTD-UHFFFAOYSA-N 380.150 3.103 5 50 GGBA CCCCCc1nnc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)s1 2855955 DTRWVIGTXIEUOV-UHFFFAOYSA-N 378.410 3.218 5 50 GGBA Cc1ccc(NC(=O)Cn2c(C)cn(-c3cccc([N+](=O)[O-])c3)c2=O)cc1C 225824508 POQQMMSYUPALKK-UHFFFAOYSA-N 380.404 3.111 5 50 GGBA COC(=O)c1cc(C(=O)Nc2cc(OC)c(Cl)cc2OC)cc([N+](=O)[O-])c1 1097970 RXPZDKIVMRPBQJ-UHFFFAOYSA-N 394.767 3.304 5 50 GGBA CCc1ccccc1NC(=O)CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 3462483 LFVCVPYLWXJWKZ-UHFFFAOYSA-N 384.388 3.302 5 50 GGBA O=C(O)c1ccc(CN2C(=O)c3cccc4c([N+](=O)[O-])ccc(c34)C2=O)cc1 4536568 OHYGMNNVBHAASU-UHFFFAOYSA-N 376.324 3.242 5 50 GGBA CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C[C@@H]1CCCO1 4857671 OJNQQTUASQJPIQ-AWEZNQCLSA-N 377.448 3.274 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCN(c2cccc(Cl)c2)CC1 2790731 TXFQHBVDUAGZML-UHFFFAOYSA-N 390.783 3.119 5 50 GGBA CCN1CCN(c2cc(N3CCc4ccccc4C3)c(F)cc2[N+](=O)[O-])CC1 4168600 MZQGFOWHHQGHQE-UHFFFAOYSA-N 384.455 3.439 5 50 GGBA CO[C@@H]1C[C@@H]2[C@H](C[C@]1(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2(C)C 12384152 LKISZDGHIQPGMP-FSZRXZPDSA-N 378.381 3.500 5 50 GGBA biogenic COc1ccc(/C=C(/NC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)NC(C)(C)C)cc1 13123236 ZHGFDHIFRZURAJ-QGOAFFKASA-N 397.431 3.289 5 50 GGBA CN1C(=O)[C@@H]2Cc3c([nH]c4ccccc34)[C@H](c3ccc([N+](=O)[O-])cc3)N2C1=S 754509 PGHRYKVFGYHOTR-WMZOPIPTSA-N 392.440 3.149 5 50 GGBA O=C(Cc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4688208 AVPUDMQPWIJCHM-UHFFFAOYSA-N 380.448 3.060 5 50 GGBA O=C(O)[C@H]1CCCN(C(=O)c2cc(F)cc3c(O)c4cc(F)ccc4nc23)C1 261647842 FFCUQNQCBVCMPI-JTQLQIEISA-N 386.354 3.309 5 50 GGBA CCCS(=O)(=O)c1ccc(COC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 1124377 KDVHFMOFJBUGOJ-UHFFFAOYSA-N 377.418 3.064 5 50 GGBA Cc1ccccc1C(=O)N1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 1202069 IAQNPJIBLYXCKE-UHFFFAOYSA-N 382.445 3.475 5 50 GGBA CCOC(=O)c1sc(N(C(=O)c2cccc([N+](=O)[O-])c2)C2CC2)nc1C 13961238 DREJTLDBMVBHCF-UHFFFAOYSA-N 375.406 3.346 5 50 GGBA CCOc1ccc(N2C(=O)/C(=C/c3ccc(O)c([N+](=O)[O-])c3)N(C)C2=S)cc1 15011070 GXNONVBMZWYTOR-WJDWOHSUSA-N 399.428 3.304 5 50 GGBA O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(I)c1 1165065 PEXYYHHYPFLSEU-UHFFFAOYSA-N 398.156 3.217 5 50 GGBA CN(C(=O)c1ccccc1I)c1ccc([N+](=O)[O-])cc1 4799632 NTBMGKFPAVWLSR-UHFFFAOYSA-N 382.157 3.476 5 50 GGBA O=[N+]([O-])c1cc(S(=O)(=O)NCc2ccccc2)ccc1N1CCCCC1 4811418 WUPHAMVHQMNAGZ-UHFFFAOYSA-N 375.450 3.064 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)Cc1ccc(Cl)cc1 4663274 GYVVJEUQTBJQFA-UHFFFAOYSA-N 379.825 3.313 5 50 GGBA CCOC(=O)c1c(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])cn2)sc2c1CCCC2 2758207 XDGZAVGPLZKKNT-SNVBAGLBSA-N 392.437 3.108 5 50 GGBA COc1cccc([C@H]2CC(=O)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)c1OC 4626332 POFLSIBPXFETFA-CQSZACIVSA-N 395.371 3.443 5 50 GGBA C[C@]1(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1(Br)Br 1830791 GAXOVOFXMMIZDI-SNVBAGLBSA-N 378.020 3.429 5 50 GGBA Nc1nccc([C@@H]2CCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)n1 225415792 LFGYHNQMSXNHPJ-CQSZACIVSA-N 396.476 3.470 5 50 GGBA CC[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](CC)CN1CC(C)(C)O 170613511 NBHREHWMXWYGLG-HZPDHXFCSA-N 378.473 3.072 5 50 GGBA Cc1nn(Cc2cccc(F)c2)c(C)c1NC(=O)c1n[nH]c([N+](=O)[O-])c1Cl 653369 HINSVFMSVXDUTK-UHFFFAOYSA-N 392.778 3.224 5 50 GGBA CNS(=O)(=O)c1ccc(N2C[C@H](C)CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 253417635 DDRQXDDAECXLIS-PBHICJAKSA-N 389.477 3.481 5 50 GGBA CCN(C)Cc1cc(O[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)C2)ccn1 856643676 UCZPWUJNOVILML-SFHVURJKSA-N 398.463 3.043 5 50 GGBA O=C(CCC(=O)OCC(=O)c1ccccc1Cl)Nc1cccc([N+](=O)[O-])c1 2751340 SOZLCLZAZIKMSD-UHFFFAOYSA-N 390.779 3.393 5 50 GGBA CSc1ccc(C(=O)OCC2CCN(c3cnccn3)CC2)cc1[N+](=O)[O-] 774556497 FDBZIDSHGVAIJU-UHFFFAOYSA-N 388.449 3.180 5 50 GGBA CCn1c(Sc2ccc([N+](=O)[O-])cn2)nnc1-c1cc(OC)cc(OC)c1 1049438 GCVGHPHBDKJZMP-UHFFFAOYSA-N 387.421 3.437 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)C(=O)N(C(C)(C)C)C2=O 1163896 YHEVSEIFWCMQDU-UHFFFAOYSA-N 397.387 3.250 5 50 GGBA COc1ccc([C@@]2(O)CC(c3ccc([N+](=O)[O-])cc3)=[N+]3CCCCCN32)cc1 5670644 ZNNOQIHCUDDRAE-NRFANRHFSA-N 382.440 3.055 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)CC(=O)N1 1213547 WYTPICAPFFEGOR-SFHVURJKSA-N 380.400 3.258 5 50 GGBA CCCN(C(=O)c1ccccc1[N+](=O)[O-])c1c(C)n(C)n(-c2ccccc2)c1=O 1180436 UALWQCUMQLRRKG-UHFFFAOYSA-N 394.431 3.449 5 50 GGBA CCOc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1 4580736 YQKQXQQRLJTGED-UHFFFAOYSA-N 397.387 3.008 5 50 GGBA CCCOc1ccc(C(C)(C)C)cc1S(=O)(=O)n1c([N+](=O)[O-])cnc1C 2325879401 UHKMAXYDHBVTJB-UHFFFAOYSA-N 381.454 3.423 5 50 GGBA COc1cc(SC)ccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4562541 ATYFEZHKFBVTRL-UHFFFAOYSA-N 387.461 3.288 5 50 GGBA C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 170601130 UPBYJZHXRKQFTD-WRXNQZLMSA-N 389.452 3.370 5 50 GGBA O=[N+]([O-])c1ccc(N2CCC(F)(F)[C@H](CO)C2)nc1OCc1ccccc1 461881960 JTSFGLBPDMJQGV-AWEZNQCLSA-N 379.363 3.023 5 50 GGBA COC(=O)c1cc(N(C)Cc2c(C)noc2C)c(Br)cc1[N+](=O)[O-] 1875326986 VHFHMOHFADDQJU-UHFFFAOYSA-N 398.213 3.385 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1 845695 QODHZTSIVZRQRQ-QGZVFWFLSA-N 382.445 3.335 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1N1C(=O)C[C@H](Sc2ccccc2C(=O)O)C1=O 1156059 CXAHMXIYRMPRFX-HNNXBMFYSA-N 386.385 3.026 5 50 GGBA CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2)sc(C(=O)OC)c1C 2102997 VHBCLXHBRNUFPW-UHFFFAOYSA-N 392.389 3.180 5 50 GGBA CCOC(=O)[C@]1(C)C=C(Nc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1 100718505 BEHLJJYIXXDXLC-FQEVSTJZSA-N 381.388 3.259 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1nc(C(F)(F)F)cc1C1CC1 2756198 ANXCHQSHAQUABP-UHFFFAOYSA-N 384.314 3.335 5 50 GGBA CCOC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(OC)cc1 3622656 LVCGDZXBDQLXAC-KRWDZBQOSA-N 386.404 3.336 5 50 GGBA CCC(CC)c1nnc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)s1 2734879 VBGVKRUKRLRNQA-UHFFFAOYSA-N 378.410 3.389 5 50 GGBA O=C(CSc1nnc2c(n1)[nH]c1ccccc12)Nc1ccccc1[N+](=O)[O-] 4903278 DRNVFMFGEZPSDP-UHFFFAOYSA-N 380.389 3.145 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 1213604 MPCMLDQPUXMPSZ-GOSISDBHSA-N 380.400 3.258 5 50 GGBA O=C(NC(NC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1)c1ccccc1 721818 RJMSDFUMRVEWOY-UHFFFAOYSA-N 375.384 3.453 5 50 GGBA CC[N+](C)(CC)CCN1C[C@H]2CC[C@H]1[C@H]1CC[C@H]2N(CC[N+](C)(CC)CC)C1 101042032 LIFOCVASPKUNPU-NVPYSNMXSA-N 394.692 3.134 5 50 GGBA Cc1nn(C(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)c(C)c1Br 1428857 GZQHOQJXERYNDM-UHFFFAOYSA-N 384.234 3.105 5 50 GGBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccccc2F)C1 1163428 QBTXWFWDEFVSGI-JTQLQIEISA-N 377.759 3.379 5 50 GGBA Cc1ccc(C(=O)c2c(NC(=O)Cn3cnc([N+](=O)[O-])n3)sc(C)c2C)cc1 461225824 KEQYXIMYOYWLMO-UHFFFAOYSA-N 399.432 3.043 5 50 GGBA O=[N+]([O-])c1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)o1 952891926 ATRBWYRCPMHNQX-OAHLLOKOSA-N 395.297 3.343 5 50 GGBA COc1cncc(/C=C/C(=O)Nc2cccc(Oc3c([N+](=O)[O-])ncn3C)c2)c1 2325729309 XIGMRXUHIYNUBI-VOTSOKGWSA-N 395.375 3.176 5 50 GGBA CCCN(C(=O)c1ccc([N+](=O)[O-])cc1)c1c(C)n(C)n(-c2ccccc2)c1=O 1184051 TYWBYHSLFGLGRB-UHFFFAOYSA-N 394.431 3.449 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1c(F)c(F)c(F)c(F)c1F 4100491 MWHLLCYCKBGXIQ-UHFFFAOYSA-N 383.250 3.366 5 50 GGBA CC(C)c1ccccc1OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4757498 JBCYFQGJPZKFBL-UHFFFAOYSA-N 383.448 3.446 5 50 GGBA COc1ccc(C(=O)NC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] 170601154 SFCSITQUZKWZPU-UHFFFAOYSA-N 393.440 3.123 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1 5041447 LKKTVNNGIZQQQR-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA C[C@H](NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 1126606 MMJVDTHWMBMUTG-HNNXBMFYSA-N 381.432 3.324 5 50 GGBA CCC[C@@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 2209463 WEEIACNYUMMZHT-SNVBAGLBSA-N 383.451 3.259 5 50 GGBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)CCN1S(=O)(=O)c1ccccc1 4687391 JYFHWOHMCMFXAO-CYBMUJFWSA-N 395.868 3.148 5 50 GGBA O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCN(c2ccccc2)C(=O)C1 445208726 FGJMPCXKAYGEKG-UHFFFAOYSA-N 397.434 3.170 5 50 GGBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1C 4681995 AWNZOPKRYJOGPU-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA COc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4543696 KGZSEVSQGLEARC-UHFFFAOYSA-N 396.447 3.140 5 50 GGBA CCOC(=O)[C@]1(C)C=C(Nc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 100702023 SCKFSIDKSXWKPI-FQEVSTJZSA-N 381.388 3.259 5 50 GGBA Cc1cc(C)c(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 4286103 VORMOXQUOVPUNC-UHFFFAOYSA-N 389.477 3.031 5 50 GGBA O=C(NCc1cc2ccccc2nc1O)c1cc(-c2ccccc2[N+](=O)[O-])on1 2325873902 YESHFGKOKJDTPP-UHFFFAOYSA-N 390.355 3.434 5 50 GGBA CC(=O)O[C@@H](c1ccccc1)[C@@H](OC(C)=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 25762019 MESSPIUNPLYNSV-ROUUACIJSA-N 388.332 3.412 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@H]2c2ccccc2[N+](=O)[O-])cc1OC 647180 BKQWZTUDYJJDNF-IBGZPJMESA-N 388.445 3.429 5 50 GGBA COc1cccc(OC)c1C(=O)NC(=S)Nc1ccc(Cl)cc1[N+](=O)[O-] 5014122 SRLJLCWXBXCQKW-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA Cc1cccc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)c1[N+](=O)[O-] 2829353 MXITWMCUEWXPPD-UHFFFAOYSA-N 391.430 3.169 5 50 GGBA O=C(c1cccc(Br)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4187911 LEHUCJWTZLRXKN-UHFFFAOYSA-N 390.237 3.320 5 50 GGBA CO[C@@H]1C[C@@H]2[C@H](C[C@@]1(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2(C)C 4104765 LKISZDGHIQPGMP-BASYENTBSA-N 378.381 3.500 5 50 GGBA biogenic,in-vitro Cc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 4543498 UFTQQWXMILMEMP-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccco3)c2)CC1 4144145 KDXYJMKDRUOCSZ-UHFFFAOYSA-N 396.403 3.355 5 50 GGBA O=C(c1ccccc1)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1 4499269 DQWLLVXJHUGZNH-UHFFFAOYSA-N 398.438 3.297 5 50 GGBA COc1cc(C(=O)Nc2ccccc2C(=O)NC(C)C)c([N+](=O)[O-])cc1OC 2877543 GSHYOHSEUHZYJL-UHFFFAOYSA-N 387.392 3.003 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 844342 AUHPIPVKWRRTAY-LJQANCHMSA-N 395.415 3.351 5 50 GGBA O=C(Nc1ccccc1[N+](=O)[O-])c1ccc(S(=O)(=O)N2CCCCC2)cc1 4427720 IRROIPYXOOWLMZ-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA O=C(NCc1ccco1)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1cccs1 2270082 PHSLQZMFMKKTJP-WJDWOHSUSA-N 397.412 3.337 5 50 GGBA COc1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NCC(C)C)cc1 33879241 XKDAOPCVXOXRJE-XDHOZWIPSA-N 397.431 3.147 5 50 GGBA CC1CCN(C(=O)c2ccccc2S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 6700924 DXDLCNCTCFFPRK-UHFFFAOYSA-N 388.445 3.300 5 50 GGBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Br)cc1[N+](=O)[O-])[C@H]1C=C[C@H]2CC1 100171456 BPWMWNACLRHPAX-WBRVRECLSA-N 377.194 3.059 5 50 GGBA O=C(Oc1ccccc1N1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccc([N+](=O)[O-])cc1 13856193 DZWQNUHPXYZDBG-IYBDPMFKSA-N 392.367 3.270 5 50 GGBA COc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1NC(=O)C(C)C 2840622 NMPWGCFWUHNSFO-UHFFFAOYSA-N 387.392 3.215 5 50 GGBA CCOc1cc([N+](=O)[O-])ccc1NC(=O)C[C@@H]1Sc2ccccc2NC1=O 4602709 UWQHWLIYCXVDBZ-INIZCTEOSA-N 387.417 3.435 5 50 GGBA O=C(NC(=S)NCc1cccnc1)c1ccc(-c2cccc([N+](=O)[O-])c2)o1 1050467 HIXMUERZIJQIMV-UHFFFAOYSA-N 382.401 3.054 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2[N+](=O)[O-])N2C(=O)[C@@H](C)SC2=N1 2463262 OHZSFLMMWBVWGO-IAQYHMDHSA-N 389.433 3.195 5 50 GGBA Cc1ccc([C@@H]2CC(c3ccccc3[N+](=O)[O-])=NN2C(=O)CCC(=O)O)cc1 240333486 FDMYHNZKZLAZKE-SFHVURJKSA-N 381.388 3.446 5 50 GGBA COc1ccc(Cl)cc1N1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 5028131 QSZWIRJGMDXONV-NSHDSACASA-N 389.795 3.248 5 50 GGBA COc1cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(=O)O)cc1OC 1072053 NJIDYCNKATVJHY-UHFFFAOYSA-N 380.740 3.216 5 50 GGBA CCOc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1 4746652 AUXUQSJIDJRADC-UHFFFAOYSA-N 376.365 3.272 5 50 GGBA COc1ccc(CCNC(=S)Nc2ccc(F)cc2[N+](=O)[O-])cc1OC 5041399 ICQJTAINXHMIJA-UHFFFAOYSA-N 379.413 3.280 5 50 GGBA CCOC(=O)c1c(C)n(C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccc(O)cc12 896353 PKODFZMPDADMEA-SFHVURJKSA-N 384.388 3.474 5 50 GGBA CCOc1cc(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)ccc1OC 4725045 YFPZKRKGWUFJET-UHFFFAOYSA-N 385.464 3.320 5 50 GGBA CCOC(=O)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 1183132 MLLTZSAVULQXDT-UHFFFAOYSA-N 387.417 3.207 5 50 GGBA CCOC(=O)c1sc2ncn3nc(-c4ccc([N+](=O)[O-])cc4)nc3c2c1C 2787018 UASWHGSFXBOBCV-UHFFFAOYSA-N 383.389 3.399 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(c3ccc(Cl)nn3)CC2)c(C(F)(F)F)c1 4187452 QQPLAJWCQZQQHN-UHFFFAOYSA-N 387.749 3.384 5 50 GGBA CCN(CC)CCNC(=O)Cn1c2ccccc2c2nc3ccccc3nc21 4708727 ZPFGSHNACLRMRY-UHFFFAOYSA-N 375.476 3.196 5 50 GGBA Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCCc3occc3C2)ccc1[N+](=O)[O-] 377507414 LBGSJJHTXINCJD-SFHVURJKSA-N 397.431 3.076 5 50 GGBA C[C@H](C(=O)Nc1cnn(Cc2c(F)cccc2Cl)c1)n1cc([N+](=O)[O-])cn1 2756196 WUESAEYESZASIU-SNVBAGLBSA-N 392.778 3.028 5 50 GGBA COC(=O)c1ccc(N2CCN(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 4054080 MABIHHRKSFYNEQ-UHFFFAOYSA-N 375.812 3.361 5 50 GGBA O=c1c(Br)cn(-c2nc(-c3ccccc3)ns2)cc1[N+](=O)[O-] 127375804 GCHWKPAZGGCCMW-UHFFFAOYSA-N 379.195 3.027 5 50 GGBA O=C1C[C@H]2c3ccccc3[C@H]1[C@H]1C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]21 245240536 ZXEWWXJSZFWEBU-PSMGESJCSA-N 396.786 3.208 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCSc2nc3ccccc3s2)c1 4547327 AKNSIAWASPRKJE-UHFFFAOYSA-N 395.487 3.275 5 50 GGBA COc1ccccc1C(=O)N1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 871867 FUPOADSOQOFLFD-UHFFFAOYSA-N 398.444 3.176 5 50 GGBA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(Br)cc1[N+](=O)[O-])[C@H]1C=C[C@H]2C12CC2 101197827 YIYRSRIZYGXCCZ-JYILRKAJSA-N 389.205 3.059 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(c2c(C)cccc2C)CC1 4192348 LUUCBEFISRPRAK-UHFFFAOYSA-N 389.477 3.031 5 50 GGBA COC(=O)c1cc(Br)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1 942048 KXYWTFKTXHIDLW-UHFFFAOYSA-N 379.166 3.396 5 50 GGBA Cc1c(CC(=O)OCCOc2cncc(Br)c2)cccc1[N+](=O)[O-] 170617313 IBSSDYRWHJNMSY-UHFFFAOYSA-N 395.209 3.225 5 50 GGBA COCCN1C(=O)c2oc3ccc(F)cc3c(=O)c2[C@H]1c1ccc([N+](=O)[O-])cc1 2704848 KAYXOMDKACZGJR-QGZVFWFLSA-N 398.346 3.032 5 50 GGBA O=C(O[C@H]1C[C@H]2CC[C@@H](C2)[C@@]12CCCO2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 104305484 QQDACIZZQACJDB-BMGJLBJMSA-N 376.365 3.398 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1)c1ncc(C(F)(F)F)cc1N1CCOCC1 1401438 WLXFAEMBEMOSTA-UHFFFAOYSA-N 381.310 3.076 5 50 GGBA COc1cc(CN2CCN(C/C=C/c3ccccc3)CC2)c([N+](=O)[O-])cc1OC 4990104 SUSHZKJWXCYYRB-RMKNXTFCSA-N 397.475 3.443 5 50 GGBA O=C(Oc1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1)c1ccco1 1130031 FXPMBOSKLIMOHR-UHFFFAOYSA-N 378.296 3.208 5 50 GGBA COc1ccnc(N2CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)n1 225513728 DEHMWXUUTIPBSC-UHFFFAOYSA-N 399.454 3.149 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 845681 OSDGOZWRPWSDKL-QGZVFWFLSA-N 382.445 3.335 5 50 GGBA O=C(CN1CCN(c2ccc(F)cc2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 52537462 BAFYQZSNQXACHB-UHFFFAOYSA-N 392.818 3.148 5 50 GGBA O=C(c1cc(F)c(F)cc1Cl)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4045595 DFNWVCWQAFSAOH-UHFFFAOYSA-N 381.766 3.489 5 50 GGBA CCOC(=O)c1c(NC(=O)[C@@H](C)n2nc(C)c([N+](=O)[O-])c2C)sc(C)c1C 1067327 OHXADGHIGNHBTE-LLVKDONJSA-N 394.453 3.463 5 50 GGBA Cc1c(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C 1058180 VDAMECRWEWPQFC-UHFFFAOYSA-N 386.795 3.298 5 50 GGBA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)Cn1ccc2c([N+](=O)[O-])cccc21 253411076 ODSBWDUDWOIGJG-FUHWJXTLSA-N 384.480 3.272 5 50 GGBA biogenic COc1ccc(C(=O)NC(=S)Nc2cccc3ncccc23)cc1[N+](=O)[O-] 1065386 UUVXDNLYZNQPQY-UHFFFAOYSA-N 382.401 3.278 5 50 GGBA COc1cccc(NC(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 1132992 LKRUVEFHSDLLSU-UHFFFAOYSA-N 383.404 3.094 5 50 GGBA COC(=O)c1cc(OC)c(OC)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 5041605 JOWPZCGDMGKPII-UHFFFAOYSA-N 375.337 3.043 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1OC 859225 MVYHLVNPNPHADK-IBGZPJMESA-N 388.445 3.429 5 50 GGBA COc1cc(N2CCN(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])cc1[N+](=O)[O-] 3880498 VKVJXNBIFXRIBA-UHFFFAOYSA-N 392.799 3.492 5 50 GGBA O=C(N[C@H]1CCCC[C@H]1C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc12 117235160 WLQCCVLDICUAER-OCCSQVGLSA-N 383.326 3.287 5 50 GGBA Cc1ccc(C(=O)[C@@H](C)OC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1 789081 XRUIETFJVTWKIG-GFCCVEGCSA-N 381.340 3.438 5 50 GGBA aggregator Cc1cc(N2CCC(Oc3cnccn3)CC2)nc(-c2cccc([N+](=O)[O-])c2)n1 2325743612 XCLONNWVKWTSBY-UHFFFAOYSA-N 392.419 3.198 5 50 GGBA CCOc1cc(C=O)ccc1Oc1nc([N+](=O)[O-])nn1Cc1ccccc1F 1049481 AKISFIKASASFJH-UHFFFAOYSA-N 386.339 3.377 5 50 GGBA CC(=O)O[C@@H](c1ccccc1)[C@H](OC(C)=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 25762030 MESSPIUNPLYNSV-ZWKOTPCHSA-N 388.332 3.412 5 50 GGBA O=C1C[C@H]2c3ccccc3[C@H]1[C@@H]1C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@H]12 245240535 ZXEWWXJSZFWEBU-LSZYVWPRSA-N 396.786 3.208 5 50 GGBA CC1=C(C(=O)Nc2ccccc2F)[C@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 4990971 WOABXYOLHCIPNQ-INIZCTEOSA-N 386.408 3.165 5 50 GGBA COC(=O)c1c(NC(=O)COc2ccc(C)cc2[N+](=O)[O-])sc2c1CCC2 6690869 ZBUZNCHXOWGVAH-UHFFFAOYSA-N 390.417 3.258 5 50 GGBA O=C(COc1ccccc1)NC(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 22018768 ONFFESMKHJZNTN-UHFFFAOYSA-N 383.282 3.341 5 50 GGBA COc1cc2c(cc1OC)CN(Cc1cc(OC)c(OC)cc1[N+](=O)[O-])CC2 19536204 XLEGXLRZLPKCHM-UHFFFAOYSA-N 388.420 3.188 5 50 GGBA NC(=O)c1cc2cc(NC(=O)c3cc(-c4ccccc4[N+](=O)[O-])on3)ccc2[nH]1 2325873452 HQDWDSMTVUHNRE-UHFFFAOYSA-N 391.343 3.082 5 50 GGBA O=C1c2ccc(-c3nc4ccc([N+](=O)[O-])cc4o3)cc2C(=O)N1C[C@@H]1CCCO1 1064375 DQQQFDXAJFBLKC-ZDUSSCGKSA-N 393.355 3.178 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1)c1cccc([N+](=O)[O-])c1 101319825 FOKCWSHBXXVJLD-QZTJIDSGSA-N 394.383 3.494 5 50 GGBA COc1cccc([C@@H]2C=C(c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 101198589 CPCKRDFRJNDAIK-INIZCTEOSA-N 379.376 3.260 5 50 GGBA CCn1c(=O)c([N+](=O)[O-])c(N2CCN(Cc3ccccc3)CC2)c2ccccc21 19956573 IMUKJUOAEHQBBF-UHFFFAOYSA-N 392.459 3.252 5 50 GGBA O=C(N=c1[nH]ccc2cc([N+](=O)[O-])ccc12)[C@H](c1ccccc1)N1CCCC1 2325827773 QDOAECNXTSBIGT-IBGZPJMESA-N 376.416 3.341 5 50 GGBA O=C(c1ccco1)N1CCN(C(=O)c2cc([N+](=O)[O-])cc(Cl)c2Cl)CC1 225703739 QTXDMKQQGICHAW-UHFFFAOYSA-N 398.202 3.093 5 50 GGBA COc1cc(OC)cc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2Cl)c1 1182752 KZTTXUXPUGYQNO-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c(N4CCCC4)c3)CC2)cc1 4703640 RZOQUXJWQZATDY-UHFFFAOYSA-N 394.475 3.466 5 50 GGBA CC(=O)O[C@H](c1ccccc1)[C@H](OC(C)=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 25762025 MESSPIUNPLYNSV-QZTJIDSGSA-N 388.332 3.412 5 50 GGBA COc1ccc(C(=O)N[C@H](CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1 4686709 JUZNACMQPINLJB-OAHLLOKOSA-N 378.768 3.203 5 50 GGBA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 367211845 GAOQNOHZAIPDIU-CABCVRRESA-N 379.420 3.038 5 50 GGBA O=[N+]([O-])c1ccc([C@H](c2nnn[nH]2)c2ncc(C(F)(F)F)cc2Cl)cc1 263639946 PMEWIDAEHXPRJC-NSHDSACASA-N 384.705 3.355 5 50 GGBA CC(C)C(=O)N1CCN(c2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2)CC1 5063881 DBUHTXDRPNBMMU-UHFFFAOYSA-N 396.447 3.152 5 50 GGBA Cc1nn(CC(=O)N(C)c2ccc(OC(F)(F)Cl)cc2)c(C)c1[N+](=O)[O-] 1427456 HPLANLDLABRRHB-UHFFFAOYSA-N 388.758 3.239 5 50 GGBA CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 956234 FFLJABZTZUSHNS-QGZVFWFLSA-N 376.376 3.114 5 50 GGBA CC1(c2ccc([N+](=O)[O-])c(CS(=O)(=O)c3ccc(Cl)cc3)c2)OCCO1 1388725 NZVVDOLZVRXXDF-UHFFFAOYSA-N 397.836 3.442 5 50 GGBA O=[N+]([O-])c1cccc(-c2cn(-c3cccc(I)c3)nn2)c1 473082919 LSVWEYNSNZJEGB-UHFFFAOYSA-N 392.156 3.447 5 50 GGBA CCc1cccc2c1N(C(=O)[C@@H]1CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C1)CC2 746791120 UXNPCJGKEJKMQB-OAHLLOKOSA-N 397.406 3.239 5 50 GGBA Cc1nn(CCc2nnc(S)n2-c2ccc(F)c(Cl)c2)c(C)c1[N+](=O)[O-] 5424898 SBCMXNYFDTYMDB-UHFFFAOYSA-N 396.835 3.313 5 50 GGBA O=C(NCc1ccc2oc(-c3ccc(F)cc3)nc2c1)c1c[nH]nc1[N+](=O)[O-] 1875336993 MVIOCMQYSIHGPE-UHFFFAOYSA-N 381.323 3.195 5 50 GGBA O=C(NCCNc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Br)o1 4507014 HOALFJAUJPRRQC-UHFFFAOYSA-N 388.605 3.446 5 50 GGBA Cn1c(COc2ccccc2)nnc1SCC(=O)c1cccc([N+](=O)[O-])c1 1061518 LMZYGYWIBAPZMC-UHFFFAOYSA-N 384.417 3.277 5 50 GGBA CCOc1ccc(NC(=O)C[C@@H]2Sc3ccccc3NC2=O)c([N+](=O)[O-])c1 4263629 IWNQKGVTDXPQBE-INIZCTEOSA-N 387.417 3.435 5 50 GGBA Cc1ccc(OCc2ccc(C(=O)Nc3ccc(C(N)=O)cc3)o2)c([N+](=O)[O-])c1 1002145 RFWYRKRQZNEKPN-UHFFFAOYSA-N 395.371 3.426 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)Oc1cccnc1I 4001948 CDQKNAFIBICOSF-UHFFFAOYSA-N 385.117 3.205 5 50 GGBA Cc1nnc2sc(-c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4)cc3)nn12 1116136 BFTRMWNLJCYEAP-UHFFFAOYSA-N 380.389 3.322 5 50 GGBA CNc1cc(N2CCN(C(=O)c3cccc(OC(C)C)c3)CC2)ccc1[N+](=O)[O-] 4688301 OEXKEDJCPQXROK-UHFFFAOYSA-N 398.463 3.386 5 50 GGBA NC(=O)[C@H]1CCCN(c2cc(Br)c(C(F)(F)F)cc2[N+](=O)[O-])C1 1875340306 VILABSVTPHEYPP-ZETCQYMHSA-N 396.163 3.078 5 50 GGBA COc1cc(/C=C2\SC(=N)NC2=O)ccc1OCc1ccc([N+](=O)[O-])cc1 12650432 XVALLBMPSDDMPQ-SXGWCWSVSA-N 385.401 3.321 5 50 GGBA Cn1c(SCC(=O)Nc2ccc(F)cc2)nnc1-c1ccc([N+](=O)[O-])cc1 2835339 ACHLPQPLUKWKHL-UHFFFAOYSA-N 387.396 3.260 5 50 GGBA O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCNCC2)c([N+](=O)[O-])c1 4983845 VXRSWHFFRSBNQS-UHFFFAOYSA-N 394.353 3.276 5 50 GGBA Cc1cc([N+](=O)[O-])ccc1N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 4740950 QTTXSFXQCSKFKG-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](C(=O)O)c1ccccc1 6673201 ABLLRQSYEDVMFM-NRFANRHFSA-N 386.407 3.097 5 50 GGBA C[C@@H](Sc1nnc(-c2ccco2)n1CCC(N)=O)c1ccccc1[N+](=O)[O-] 463248817 BYNAUKROVBYOOK-LLVKDONJSA-N 387.421 3.175 5 50 GGBA CC(C)(C)OC(=O)N1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 34613421 SSRDVUJPBHVBFR-UHFFFAOYSA-N 386.246 3.414 5 50 GGBA CC[C@H](C)n1c(=N)c(C(=O)NC2CCCC2)cc2c(=O)n3cccc(C)c3nc21 100662743 SPBXHVJEXRAAKM-AWEZNQCLSA-N 393.491 3.080 5 50 GGBA CCOC(=O)c1c(NC(=O)COc2ccc([N+](=O)[O-])cc2)sc2c1CCC2 939153 IABRMYOFCKXXNK-UHFFFAOYSA-N 390.417 3.339 5 50 GGBA Cc1sccc1C(=O)N1CCC(O)(CNc2ccc([N+](=O)[O-])cc2)CC1 1775991638 LVBVVGQRKADENI-UHFFFAOYSA-N 375.450 3.044 5 50 GGBA CC(C)(C)OC(=O)N1CCC2(CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 253420058 UKKFCHXWSMIJAG-UHFFFAOYSA-N 389.452 3.458 5 50 GGBA Cc1cccc(Oc2cc(NC(=O)Cn3cc([N+](=O)[O-])cn3)cc([N+](=O)[O-])c2)c1 2113111 HLTNQCSHYOZOEF-UHFFFAOYSA-N 397.347 3.439 5 50 GGBA CCO[C@@H]1C[C@H](O)C12CCN(c1cc(C)c([N+](=O)[O-])cc1Br)CC2 302677011 NGXYXASBROJORK-JKSUJKDBSA-N 399.285 3.422 5 50 GGBA Cc1cc(C(=O)NC(=S)Nc2ccc(Cl)c(C(=O)O)c2)ccc1[N+](=O)[O-] 2833175 XPUYSZIZRWUREW-UHFFFAOYSA-N 393.808 3.382 5 50 GGBA Cc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4703594 MJKVFHLPYOIROM-UHFFFAOYSA-N 394.475 3.466 5 50 GGBA Cc1nc(C)n(C[C@H]2CCCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)n1 266028886 QZPSVHYHAVABLX-INIZCTEOSA-N 385.468 3.020 5 50 GGBA CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 845590 ICVQDBMNUJMDJQ-SFHVURJKSA-N 396.403 3.260 5 50 GGBA CC1=C(C(=O)Nc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 949453 JHHYSYJYNHIJIY-KRWDZBQOSA-N 376.376 3.114 5 50 GGBA COc1ccccc1C(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 4599632 BGZYWBRZLLQVGW-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C(c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4543445 PFYOQBYCBVGYSH-UHFFFAOYSA-N 384.411 3.271 5 50 GGBA O=[N+]([O-])c1ccc(C(F)(F)c2nc(Cc3nncn3-c3ccccc3)no2)cc1 446004638 OCGUTJCRHRYWKC-UHFFFAOYSA-N 398.329 3.289 5 50 GGBA COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc(C(=O)OC)c1 5511293 MEUQKBLZTCONQK-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA O=C(Nc1ccc2cc[nH]c2c1)N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 2325746986 DJDKCDAZRVJAMJ-UHFFFAOYSA-N 393.403 3.066 5 50 GGBA O=[N+]([O-])c1cccnc1N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 20405551 UYKCASJJWCNADU-UHFFFAOYSA-N 387.749 3.384 5 50 GGBA COc1ccc(C(=O)NCCCNc2ccc([N+](=O)[O-])cc2Cl)cc1OC 5094224 XGEXHLPBKYLOQS-UHFFFAOYSA-N 393.827 3.497 5 50 GGBA CC[C@H]1CCN(C(=O)c2ccc3ncn(C)c(=O)c3c2)c2cc([N+](=O)[O-])ccc21 2325806497 BVTWTKGZDSNCHY-ZDUSSCGKSA-N 392.415 3.386 5 50 GGBA C[C@H](NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)c1ccc2c(c1)OCCO2 225748204 WPZCIUOCGDEOHJ-NSHDSACASA-N 389.383 3.062 5 50 GGBA Cc1cc(C)cc(N2CC3=C(C2=O)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)c1 4753698 SVWUEMUPMITTEB-IBGZPJMESA-N 392.415 3.209 5 50 GGBA CCCCCC[C@@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@H]1C 2325871991 CXJFCXGSWHWFHN-MGPQQGTHSA-N 383.420 3.073 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 949451 FDWLQXQRNXLSPS-SFHVURJKSA-N 391.387 3.219 5 50 GGBA Cc1ccc(NC(=O)Cn2nc([N+](=O)[O-])c(Br)c2C)cc1Cl 1429845 YZQMRGKVXDXDPL-UHFFFAOYSA-N 387.621 3.463 5 50 GGBA CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 949452 JHHYSYJYNHIJIY-QGZVFWFLSA-N 376.376 3.114 5 50 GGBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1ccc(Cl)cc1)S(C)(=O)=O 2874756 UICWTZGPDLUMHP-NSHDSACASA-N 397.840 3.041 5 50 GGBA COC(=O)c1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])sc2c1CCCCCC2 6265873 DUTCCUMVBWHGMN-UHFFFAOYSA-N 378.410 3.077 5 50 GGBA CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1 845591 ICVQDBMNUJMDJQ-GOSISDBHSA-N 396.403 3.260 5 50 GGBA CCOc1ccc(NC(=O)[C@H](C)n2nc([N+](=O)[O-])c(Br)c2C)cc1 2883822 WHRNMALBKWFKKJ-JTQLQIEISA-N 397.229 3.461 5 50 GGBA Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)N1CCc2ccccc2C1 4820473 FRAXVDNLOKLWLX-LLVKDONJSA-N 393.241 3.008 5 50 GGBA COc1cc(C(=O)N2CCN(c3cccc(C)c3C)CC2)c([N+](=O)[O-])cc1OC 1182595 CNIVNVOMRAKCME-UHFFFAOYSA-N 399.447 3.191 5 50 GGBA O=C(Nc1nc2ccccc2s1)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 2459153 ATCQUQYYNMDXLG-NSHDSACASA-N 382.401 3.196 5 50 GGBA Cc1cc(C(=O)Nc2ccc(I)c(C)n2)ccc1[N+](=O)[O-] 2857490 VAQADJUPOBWIKX-UHFFFAOYSA-N 397.172 3.464 5 50 GGBA COC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)[C@H]1c1ccccc1[N+](=O)[O-] 591993 VKQFCGNPDRICFG-SFHVURJKSA-N 388.420 3.202 5 50 GGBA biogenic,fda CN(C)c1noc([C@H]2CCCN2c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)n1 170619634 QQBHUESGYKFBHV-OAHLLOKOSA-N 380.408 3.447 5 50 GGBA O=C(COC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)NC1C2CC3CC(C2)CC1C3 917330622 CTAHGYWBEJEMDM-UHFFFAOYSA-N 397.431 3.174 5 50 GGBA O=C(N[C@H](Cc1ccccc1)C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2060580 IUZMYHGFGQBERI-CQSZACIVSA-N 383.282 3.406 5 50 GGBA O=[N+]([O-])c1ccc(Nc2ccc(I)cc2)c2nonc12 3879014 YCHZXTMBZKCBPL-UHFFFAOYSA-N 382.117 3.479 5 50 GGBA C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 225385005 DURNGRGZAUNRDK-UTKZUKDTSA-N 394.475 3.079 5 50 GGBA Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CCC(=O)N1CCc2sccc2C1 225712667 WXNYZYMUBPMHKQ-UHFFFAOYSA-N 391.424 3.407 5 50 GGBA COc1ccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 834222 PKYGRKOYTVJAGQ-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA CCOc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(CC)CC1 4954393 OWJMSHQDVXTMOA-UHFFFAOYSA-N 398.463 3.388 5 50 GGBA Cn1ccc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c21 170606376 IPMULAJGKKZOTH-UHFFFAOYSA-N 394.387 3.413 5 50 GGBA Cc1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)c(F)cc1[N+](=O)[O-] 4117310 FJSKMHPBBOEMQA-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 1678611 GBHHDWSSOJAWDH-VXGBXAGGSA-N 388.332 3.294 5 50 GGBA NC(=O)[C@@H]1CCCN(c2cc(Br)c(C(F)(F)F)cc2[N+](=O)[O-])C1 1875340305 VILABSVTPHEYPP-SSDOTTSWSA-N 396.163 3.078 5 50 GGBA O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2060579 IUZMYHGFGQBERI-AWEZNQCLSA-N 383.282 3.406 5 50 GGBA CC(=O)c1cccc(NC(=O)[C@@H](C)n2cc([N+](=O)[O-])c(-c3nccs3)n2)c1 225653968 ZWDHOOICVUEVBJ-SNVBAGLBSA-N 385.405 3.317 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 1154366 XDWZBVOUNLOZSA-SFHVURJKSA-N 380.404 3.478 5 50 GGBA COc1ccc([C@H]2CC(=O)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)cc1OC 4626525 XKGAVDGHYJWYLW-CQSZACIVSA-N 395.371 3.443 5 50 GGBA O=C(NC1C2CC3CC(C2)CC1C3)c1ccn(COc2ccccc2[N+](=O)[O-])n1 2800191 NPICFLOPAKZSJZ-UHFFFAOYSA-N 396.447 3.382 5 50 GGBA Cc1cc(C)c(S(=O)(=O)N[C@@H](CC(=O)O)c2cccc([N+](=O)[O-])c2)c(C)c1 4580686 HRIFAYUIKISDQB-INIZCTEOSA-N 392.433 3.014 5 50 GGBA O=C(COC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Nc1ccccc1O 170593723 SPTRGNAREHQUGU-UHFFFAOYSA-N 382.328 3.356 5 50 GGBA COc1ccc(CC[N@+]2([O-])CCO[C@H](COc3cccc(C)c3)C2)cc1OC 261361535 NFODBQBZYLQKOM-REWPJTCUSA-N 387.476 3.347 5 50 GGBA O=C(NC(=S)Nc1ccccc1Br)c1ccccc1[N+](=O)[O-] 2854510 DPRXARXDPPFTPL-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA O=C(c1ccco1)N1CCN(c2nc(-c3cccc([N+](=O)[O-])c3)cs2)CC1 2873562 FUHNEYLIPSTOFT-UHFFFAOYSA-N 384.417 3.274 5 50 GGBA Cc1cccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 5120006 LSVFLGOWWFFXIE-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1c(F)cccc1F 6369635 XJDRWRQSOVODQV-LLVKDONJSA-N 379.338 3.363 5 50 GGBA CC(C)C[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2ON1c1ccccc1 226989860 OQTSTRMAGBTNRN-CEXWTWQISA-N 395.415 3.319 5 50 GGBA O=[N+]([O-])c1cccc(CN2CCC(N3CCN(Cc4ccccc4)CC3)CC2)c1 4745458 SZSRDUPEBZWKHT-UHFFFAOYSA-N 394.519 3.377 5 50 GGBA O=C1[C@H]2CS[C@H](c3cccc([N+](=O)[O-])c3)N2C(=S)N1c1ccc(F)cc1 4686627 KUXIOXFQKPWCFU-GDBMZVCRSA-N 389.433 3.482 5 50 GGBA Cc1cc(N2CCN(C(=O)c3cccc(F)c3F)CC2)c(F)cc1[N+](=O)[O-] 5033467 ANMOMUNJOXTUFB-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA COc1cc(OC)cc(C(=O)N[C@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])c1 4573294 WSKSQCYQAPQTEQ-LLVKDONJSA-N 393.827 3.496 5 50 GGBA O=C(CSc1nnc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc2c(c1)OCCO2 2843384 PYHBCJQOEXGHMH-UHFFFAOYSA-N 399.384 3.391 5 50 GGBA O=C([C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1)N1CCc2ccccc2C1 4745123 QKTXRIQXPHODJP-FQEVSTJZSA-N 379.460 3.392 5 50 GGBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H]1c1nc(-c2cccc(C(F)(F)F)c2)c[nH]1 253394205 ALIIUGKTORWBID-VHDGCEQUSA-N 394.353 3.424 5 50 GGBA O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H]1CC[C@H](CO)CC1 154738960 DZEMFPCFIKLAJL-BJHJDKERSA-N 389.374 3.083 5 50 GGBA CS[C@@H]1CN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C[C@H]1N(C)C 241693902 QIRNWTDYQGLUQH-RTBURBONSA-N 385.489 3.308 5 50 GGBA COc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)n2)cc1 18254780 YUBMNEFEDCLGRP-UHFFFAOYSA-N 385.405 3.119 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc2nc(N3C(=O)CCC3=O)sc2c1 3464170 SSFRIZZZRWDWTN-UHFFFAOYSA-N 396.384 3.110 5 50 GGBA Cc1cc([N+](=O)[O-])nn1Cc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2 2795551 ZLCBCWJYWZWZDT-UHFFFAOYSA-N 394.387 3.172 5 50 GGBA CCc1ccc(N2CC3=C(C2=O)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)cc1 4753687 OWEVNPOJMUBFFV-LJQANCHMSA-N 392.415 3.154 5 50 GGBA Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 1079728 KGSSEVTXHIRACQ-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA COc1ccc(NC(=S)NC(=O)CCCOc2ccccc2)c([N+](=O)[O-])c1 4422207 VRPBQKNSZGWMFE-UHFFFAOYSA-N 389.433 3.276 5 50 GGBA Cc1cn(-c2cccc([N+](=O)[O-])c2)c(=O)n1CC(=O)N(c1ccccc1)C(C)C 252490508 KVPASAVPLAXGOM-UHFFFAOYSA-N 394.431 3.297 5 50 GGBA CCC[C@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 2209464 WEEIACNYUMMZHT-JTQLQIEISA-N 383.451 3.259 5 50 GGBA CC(=O)Nc1cccc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)c1 2796320 ACSWIUWLKZSVAF-UHFFFAOYSA-N 393.403 3.359 5 50 GGBA CCOC(=O)c1c(NC(=O)COc2ccc([N+](=O)[O-])cc2)sc(C)c1C 943868 PREGCJNOXAZLBR-UHFFFAOYSA-N 378.406 3.467 5 50 GGBA Cc1cccc(OCCOc2ccc([N+](=O)[O-])cc2/C=C2\SC(=N)NC2=O)c1 2977621 IMKQHMOVUNRIJE-BOPFTXTBSA-N 399.428 3.500 5 50 GGBA CC(C)CCN1C(=O)c2ccc(C(=O)Nc3ccccc3[N+](=O)[O-])cc2C1=O 4825096 JVRWVHUCMRGBQO-UHFFFAOYSA-N 381.388 3.489 5 50 GGBA Cc1ccc(OCC(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 4561919 YXNWYGZOUUWYPE-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA C[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1S(=O)(=O)c1ccccc1 4687537 KBZAIBZSMBEVSK-CYBMUJFWSA-N 395.868 3.148 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H]2CCCC[C@]21c1ccccc1 134367239 CZKMBSLVWFWJJP-IERDGZPVSA-N 379.416 3.461 5 50 GGBA O=[N+]([O-])c1ccc(C2=NNC(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])=CS2)cc1 104153381 ZFDBPPHNTJSLMO-UHFFFAOYSA-N 387.333 3.408 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(Cc2ccccc2)n[nH]1 4809716 YISLFRAKCYDAQE-UHFFFAOYSA-N 399.432 3.043 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)NC(=O)c1cc(Cl)ccc1OC 4682347 GMUSJQYSGFUILD-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 126382936 YTICXATZALUELW-MSOLQXFVSA-N 390.484 3.101 5 50 GGBA O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)Nc2ccccn2)c1 5392768 AQHCQKDAWUOUHT-UHFFFAOYSA-N 398.400 3.043 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1 4675792 KLOHTEXBRVLSME-VMPITWQZSA-N 388.376 3.281 5 50 GGBA O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1cc(OCC(F)(F)F)cc([N+](=O)[O-])c1 2763731 IHKSVVIOCCZBMR-OLZOCXBDSA-N 390.314 3.365 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 954659 GXIBOOZGADKBJI-GOSISDBHSA-N 390.403 3.422 5 50 GGBA C[C@@]1(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1(Br)Br 1830790 GAXOVOFXMMIZDI-JTQLQIEISA-N 378.020 3.429 5 50 GGBA COC(=O)c1ccc(-c2nc(NC(C)=O)c3c(=O)oc4ccccc4c3n2)cc1 780324 YNNYHGOUIFULDG-UHFFFAOYSA-N 389.367 3.148 5 50 GGBA CCOc1ccc(NC(=O)[C@@H](C)n2nc([N+](=O)[O-])c(Br)c2C)cc1 2883821 WHRNMALBKWFKKJ-SNVBAGLBSA-N 397.229 3.461 5 50 GGBA COCCCn1c2nc3ccccc3nc2c2c(=O)n(CCC(C)C)cnc21 2199541 CVVUUZBMXAQEFS-UHFFFAOYSA-N 379.464 3.377 5 50 GGBA CSc1nnc2c(n1)O[C@@H](c1cc(O)ccc1[N+](=O)[O-])Nc1ccccc1-2 35337283 FSQWMFRSGFTAMY-HNNXBMFYSA-N 383.389 3.377 5 50 GGBA Cc1ccccc1[C@@H]1C[C@@H]1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 230216381 UXQXPSYNGVHNMF-OWQGQXMQSA-N 397.406 3.068 5 50 GGBA Cc1c(Cl)cccc1NC(=O)CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 1125189 QNBXLBXIONYDRE-UHFFFAOYSA-N 387.779 3.181 5 50 GGBA COc1cccc([C@H](C)NC(=O)c2ccccc2Cn2cc([N+](=O)[O-])cn2)c1 2796403 DJWCYGRMYXFDAV-AWEZNQCLSA-N 380.404 3.339 5 50 GGBA O=c1[nH]c(/C=C/c2ccc(OCc3ccccc3Cl)cc2)c([N+](=O)[O-])c(=O)[nH]1 13607674 BCUVBXUQSVVKHZ-JXMROGBWSA-N 399.790 3.374 5 50 GGBA COc1ccc(-n2nc3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3n2)cc1 830455 UWQMANULSFQEIU-UHFFFAOYSA-N 379.332 3.183 5 50 GGBA COc1ccc(Br)cc1Cn1c(=O)[nH]c2cc([N+](=O)[O-])ccc21 1218171 GKBFSCSRDSCIGW-UHFFFAOYSA-N 378.182 3.057 5 50 GGBA O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1ccc(Cl)c(Cl)c1 4703723 FFFJCVPDGHRNON-UHFFFAOYSA-N 390.248 3.292 5 50 GGBA CCOC(=O)c1cc(N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)ccc1[N+](=O)[O-] 242338941 ZDSHFQGGQPPOLA-UGSOOPFHSA-N 392.358 3.362 5 50 GGBA CSc1nnc2c(n1)O[C@H](c1cc(O)ccc1[N+](=O)[O-])Nc1ccccc1-2 35337284 FSQWMFRSGFTAMY-OAHLLOKOSA-N 383.389 3.377 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(I)c1 1165132 OHECHEBTHQRROW-UHFFFAOYSA-N 398.156 3.217 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)Nc2ccccn2)c1 4062795 BSMWNHWMVFZXAW-UHFFFAOYSA-N 398.400 3.043 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@@H]2CCCC[C@@]21c1ccccc1 134367297 CZKMBSLVWFWJJP-HRAATJIYSA-N 379.416 3.461 5 50 GGBA CCCC(=O)Nc1cccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c1 1183963 VLJQOOFPRXCDBD-UHFFFAOYSA-N 386.433 3.460 5 50 GGBA COc1ccc(C(=O)N2CCC(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 2999179 CQYXZKOQXKEGEJ-UHFFFAOYSA-N 383.404 3.094 5 50 GGBA CC[C@@H]1CCN(C(=O)c2ccc3ncn(C)c(=O)c3c2)c2cc([N+](=O)[O-])ccc21 2325806496 BVTWTKGZDSNCHY-CYBMUJFWSA-N 392.415 3.386 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1 4192340 CTDQURXOOJQSPR-UHFFFAOYSA-N 395.868 3.068 5 50 GGBA Cc1nc2cc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc2n1C1CC1 252507428 WLHCZYSFZLLUQV-UHFFFAOYSA-N 386.433 3.066 5 50 GGBA COc1ccc(CC[N@@+]2([O-])CCO[C@H](COc3cccc(C)c3)C2)cc1OC 261361533 NFODBQBZYLQKOM-NZQKXSOJSA-N 387.476 3.347 5 50 GGBA CN1C(=O)N[C@H](c2cccc([N+](=O)[O-])c2)C2=C1CN(c1cccc(Cl)c1)C2=O 4753690 QQZSSVUZAZBIQY-QGZVFWFLSA-N 398.806 3.245 5 50 GGBA CC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](CC)CN1CC(C)(C)O 230288674 NBHREHWMXWYGLG-HOTGVXAUSA-N 378.473 3.072 5 50 GGBA O=C(C[S@](=O)c1ccccc1[N+](=O)[O-])Oc1ccc(Br)cc1 4387493 UNRSKOJEWWAKMS-JOCHJYFZSA-N 384.207 3.071 5 50 GGBA COc1cc(CN2CCN(c3ccc(Cl)cc3)CC2)cc([N+](=O)[O-])c1O 1227126 SFKGBPHIMDTBDF-UHFFFAOYSA-N 377.828 3.285 5 50 GGBA C[C@H]1C[C@@H](C)CN(c2nc(O)c3c(n2)NC(=O)C[C@@H]3c2ccccc2[N+](=O)[O-])C1 822355263 XGIVOGNBSOECIA-MBNYWOFBSA-N 397.435 3.047 5 50 GGBA Cc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1Cl 850483 PENSHCIXKDHPKR-UHFFFAOYSA-N 387.779 3.181 5 50 GGBA C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1 1678612 GBHHDWSSOJAWDH-RYUDHWBXSA-N 388.332 3.294 5 50 GGBA CC(C)C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O 3958695 VHBVRHUKEBRBBZ-QGZVFWFLSA-N 381.388 3.244 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccccc1S(=O)(=O)N1CCCC1 1875389538 RWCALMPZCDLPIH-UHFFFAOYSA-N 390.421 3.023 5 50 GGBA Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ccc(F)c(Cl)c1 1430021 KCFJIILKLSIWMA-UHFFFAOYSA-N 391.584 3.293 5 50 GGBA O=[N+]([O-])c1ccccc1OCCN1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 286057610 CICRLJCAPQDGBL-DOTOQJQBSA-N 388.424 3.435 5 50 GGBA COc1ccc(NC(=O)c2ccccc2I)c([N+](=O)[O-])c1 4950125 DKSMZZUYQPRKSX-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc(O)cc1[N+](=O)[O-] 170595802 UCWQMZPNDOEVOK-KRWDZBQOSA-N 383.448 3.285 5 50 GGBA COC(=O)[C@@H]1C[C@@]23CCC[N@@+]4(C)CC[C@@]5(c6ccccc6N(C(C)=O)[C@]15CC2)[C@@H]34 252460008 AVRZAJRDJDMMDG-RIEDBUDVSA-N 395.523 3.016 5 50 GGBA Cc1cnc(N[C@H]2CC[C@H](NC(=O)c3conc3C3CC3)CC2)c([N+](=O)[O-])c1 1775986931 ZQAVQLAIXHQSBG-HDJSIYSDSA-N 385.424 3.317 5 50 GGBA COc1ccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2C)cc1 4918727 YDIDHTNNHJWUTL-UHFFFAOYSA-N 399.432 3.130 5 50 GGBA O=C(c1cc(F)c(F)cc1Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 4045597 TUFDWTLWIUOITB-UHFFFAOYSA-N 381.766 3.489 5 50 GGBA COC(=O)c1cccc(NC(=O)c2ccccc2Cn2nc([N+](=O)[O-])cc2C)c1 2796365 RILSARZUUPILHO-UHFFFAOYSA-N 394.387 3.187 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@@H]2c2cccc([N+](=O)[O-])c2)cc1OC 863601 UMVVDGNEOFPERV-LJQANCHMSA-N 388.445 3.429 5 50 GGBA COc1cc(OC)cc(C(=O)N[C@@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])c1 4573293 WSKSQCYQAPQTEQ-NSHDSACASA-N 393.827 3.496 5 50 GGBA O=[N+]([O-])c1cc2c(cc1CN1CCN(C/C=C/c3ccccc3)CC1)OCO2 4698826 WYZVGISWGRQHQB-QPJJXVBHSA-N 381.432 3.155 5 50 GGBA O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1C[C@]12CCc1ccccc12 439191393 UTCQYVWUPLWQBO-JXFKEZNVSA-N 375.388 3.223 5 50 GGBA C[C@@H](OC(=O)c1ccc(C(=O)O)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 820182851 JTRRSZWNAZEHFV-SNVBAGLBSA-N 383.316 3.261 5 50 GGBA Cn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc2c1CCCC2 17076975 JYTMICKBMJOLLI-UHFFFAOYSA-N 376.467 3.277 5 50 GGBA CC[C@H]1CCc2c(sc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C(N)=O)C1 1112855 YANWEWQWLVZBBZ-NSHDSACASA-N 387.461 3.451 5 50 GGBA O=[N+]([O-])c1cnc(Nc2ccc(Oc3ccc(CO)cc3)cc2)[nH]c1=NC1CC1 1875256691 YKDZSZSBZFJDDZ-UHFFFAOYSA-N 393.403 3.409 5 50 GGBA COc1ccc(CC[N@+]2([O-])CCO[C@@H](COc3cccc(C)c3)C2)cc1OC 261361534 NFODBQBZYLQKOM-OFNKIYASSA-N 387.476 3.347 5 50 GGBA O=[N+]([O-])c1ccc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)o1 952891918 ATRBWYRCPMHNQX-HNNXBMFYSA-N 395.297 3.343 5 50 GGBA CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 1128882 SKXQWKFVPMCMJM-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA CN(C[C@@H](O)C(F)(F)F)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 180790218 JMVVJCLQNJURLN-OAHLLOKOSA-N 383.326 3.334 5 50 GGBA O=[N+]([O-])c1ccc(N2CCNCC2)cc1NCCOc1ccc(Cl)cc1 4310061 MJYMQPLZJNMTDN-UHFFFAOYSA-N 376.844 3.149 5 50 GGBA Cn1c2ccccc2c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)nc21 4676567 HBYMBLIIXMCOOS-UHFFFAOYSA-N 394.416 3.156 5 50 GGBA CCOc1cc(OCC)cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 5090865 FBBAHJYWSFWIOZ-UHFFFAOYSA-N 399.447 3.355 5 50 GGBA CCCN(CCC)c1c([N+](=O)[O-])cc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 4595323 ARMYDSISEBKSDW-UHFFFAOYSA-N 399.347 3.423 5 50 GGBA Cn1cc(C(=N)O)c([C@H]2CCCN(c3cc4c(cc3[N+](=O)[O-])CCC(O)=N4)C2)n1 328607391 WBJRZVWLRVWQDY-LBPRGKRZSA-N 398.423 3.130 5 50 GGBA CC(C)(C)OC(=O)n1nc(I)c2cc([N+](=O)[O-])ccc21 40443253 ZHDZMZIIIKQAGB-UHFFFAOYSA-N 389.149 3.332 5 50 GGBA in-vitro CCC(=O)N1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)CC1 4121244 CQKPCQVJLFDUTM-UHFFFAOYSA-N 396.447 3.214 5 50 GGBA Cc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)n2C)cc1 4680741 PLNMJCLZEFNUCE-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA CCCCOc1ccc(C(=O)N/C(=C/c2ccc([N+](=O)[O-])cc2)C(N)=O)cc1 2898870 XZZJJVBLVUAMGE-QGOAFFKASA-N 383.404 3.030 5 50 GGBA CCOc1cc([N+](=O)[O-])ccc1NC(=O)C[C@H]1Sc2ccccc2NC1=O 4602707 UWQHWLIYCXVDBZ-MRXNPFEDSA-N 387.417 3.435 5 50 GGBA O=c1c2c3c(sc2ncn1C[C@H](O)c1cccc([N+](=O)[O-])c1)CCCCC3 134596809 PKKJDFSSYRKWIG-HNNXBMFYSA-N 385.445 3.369 5 50 GGBA CCn1ncc([N+](=O)[O-])c1C(=O)Nc1c(C)nn(Cc2ccc(F)cc2)c1C 2755443 WTYAQCZCSMENSF-UHFFFAOYSA-N 386.387 3.064 5 50 GGBA CC1=C(C(=O)OCc2ccc(C)cc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 1189069 QLEIRTMAPGNDKF-GOSISDBHSA-N 381.388 3.275 5 50 GGBA CCCCNC(=O)/C(=C\c1ccc(OC)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1 5010003 POPQISHLFSOOIX-XMHGGMMESA-N 397.431 3.291 5 50 GGBA O=C1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]2CCCc3cccc(c32)N1 366313249 OVJHVUHXVSFPAH-SFHVURJKSA-N 395.415 3.293 5 50 GGBA O=C(Nc1ccccc1C(=O)N1CCCC[C@@H]1CCO)c1cccc([N+](=O)[O-])c1 1141245 LFJUIRFBLHOUHG-MRXNPFEDSA-N 397.431 3.224 5 50 GGBA Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2495794 ZAILWGBGUHETBX-HKUYNNGSSA-N 396.403 3.260 5 50 GGBA O=C(Cc1ccc(Br)cc1)OCC(=O)c1ccc([N+](=O)[O-])cc1 1173205 YMVFEJQQGLDINY-UHFFFAOYSA-N 378.178 3.326 5 50 GGBA CN1C(=O)N[C@@H](c2cccc([N+](=O)[O-])c2)C2=C1CN(c1ccc(Cl)cc1)C2=O 4753706 ZYQYLEORANNDMK-KRWDZBQOSA-N 398.806 3.245 5 50 GGBA CC(C)NS(=O)(=O)c1ccc(N2CC[C@@H]3CCCC[C@H]3C2)c([N+](=O)[O-])c1 241942317 ULOAPUMIOAMKFR-GJZGRUSLSA-N 381.498 3.298 5 50 GGBA Cc1cc(NS(=O)(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)no1 4755581 WDHWORYYGLCBLK-UHFFFAOYSA-N 375.362 3.484 5 50 GGBA CCc1cc(N[C@@H](CO)CCN(CC)CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 225535891 OFSWBDQBBJUCTQ-QGZVFWFLSA-N 387.484 3.119 5 50 GGBA Cc1cc(F)c(S(=O)(=O)N(C)c2cccc3cccnc23)cc1[N+](=O)[O-] 242197016 XHAIEHIEUJJYIT-UHFFFAOYSA-N 375.381 3.416 5 50 GGBA C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(c1ccc(Cl)cc1)S(C)(=O)=O 2874757 UICWTZGPDLUMHP-LLVKDONJSA-N 397.840 3.041 5 50 GGBA COc1ccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])cc(Cl)c2O)cc1 4946356 PFOWQHMAVLTBOC-UHFFFAOYSA-N 381.797 3.089 5 50 GGBA CCC(=O)NC(=S)Nc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 1130205 KSBSEHKCZSRISC-UHFFFAOYSA-N 386.433 3.379 5 50 GGBA COc1ccc([C@]2(O)CC(c3ccc([N+](=O)[O-])cc3)=[N+]3CCCCCN32)cc1 5670625 ZNNOQIHCUDDRAE-OAQYLSRUSA-N 382.440 3.055 5 50 GGBA Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 248098429 ZAILWGBGUHETBX-IEBWSBKVSA-N 396.403 3.260 5 50 GGBA O=C(Nc1ccccc1OC(F)F)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4840188 BNNNCLMZFBPMSP-UHFFFAOYSA-N 393.346 3.285 5 50 GGBA O=C(COC(=O)c1cccc(NC(=O)c2ccco2)c1)c1cccc([N+](=O)[O-])c1 1182564 GJTIWUMVJFCLOA-UHFFFAOYSA-N 394.339 3.480 5 50 GGBA O=C(CCS(=O)(=O)c1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1 732297 RQTBTLJRBJHNCE-UHFFFAOYSA-N 398.234 3.404 5 50 GGBA C[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)[C@H](C)Cc1ccccc1[N+](=O)[O-] 252536876 JRYVQVSWNRULKX-IPYPFGDCSA-N 387.402 3.305 5 50 GGBA COc1ccc([C@@H]2SCCN2S(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 705272 OJXKSEJUSGPALG-KRWDZBQOSA-N 394.474 3.348 5 50 GGBA in-vitro COc1ccc(Cl)cc1N1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O 5028130 QSZWIRJGMDXONV-LLVKDONJSA-N 389.795 3.248 5 50 GGBA Cn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nnc1C(F)(F)F 1088820 CCPHVTYHBVMGCY-UHFFFAOYSA-N 395.750 3.126 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCc2c[nH]c3ccc(Cl)cc23)c1 13957971 PEQZLWBCKUPNAT-UHFFFAOYSA-N 379.825 3.251 5 50 GGBA Cc1cc(NC(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)on1 121035850 AQWXFKLGPGIPRB-UHFFFAOYSA-N 380.429 3.114 5 50 GGBA Cc1nc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1I 2856249 MDOXUACPTZGQSI-UHFFFAOYSA-N 383.145 3.155 5 50 GGBA COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Br)cc1C(=O)O 1163137 OOZBSIGTPGDUGZ-UHFFFAOYSA-N 395.165 3.316 5 50 GGBA NC(=O)c1cccc(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] 225540492 FVIQUOLRYNRJFM-GOSISDBHSA-N 389.839 3.297 5 50 GGBA Cc1cc(C(=O)NC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c(C)o1 171289301 FCNBNKSYYAWDGR-UHFFFAOYSA-N 385.420 3.148 5 50 GGBA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccc(Br)cc1[N+](=O)[O-] 100171452 BPWMWNACLRHPAX-LBLXLQPISA-N 377.194 3.059 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C2CCCCC[C@H]2[C@@]1(O)C(F)(F)F 845880 QYZFHWDKCCIZQU-CZUORRHYSA-N 385.342 3.167 5 50 GGBA O=C(c1ccccc1)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@@]1(O)C(F)(F)F 1194956 AZRNCVGIYLPKIS-MRXNPFEDSA-N 379.294 3.096 5 50 GGBA CCCCOc1ccc(C(=O)N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)NC)cc1 2902196 LYBDHVSELCOQSR-XMHGGMMESA-N 397.431 3.291 5 50 GGBA CCOC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(OC)cc1 3622657 LVCGDZXBDQLXAC-QGZVFWFLSA-N 386.404 3.336 5 50 GGBA CCCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1OC 2815067 IXYAQLOHSXZLTB-JXAWBTAJSA-N 397.431 3.291 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2cccc([N+](=O)[O-])c2)n2ncnc2N1 1131226 JJSBVCXBAJZYOO-GOSISDBHSA-N 390.403 3.422 5 50 GGBA CC(C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccco3)c2)CC1 4187957 KLKGDVXKFCAXPQ-UHFFFAOYSA-N 386.452 3.495 5 50 GGBA C[C@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])CCN1S(=O)(=O)c1ccccc1 4687538 KBZAIBZSMBEVSK-ZDUSSCGKSA-N 395.868 3.148 5 50 GGBA COc1cc(C=O)cc(Br)c1OC(=O)c1cccc([N+](=O)[O-])c1 1163148 BSDWJWUAWOPHIX-UHFFFAOYSA-N 380.150 3.398 5 50 GGBA CN(C)c1nccc([C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CCO2)n1 281503625 OUJFFUOBDKJVDE-HNNXBMFYSA-N 397.357 3.048 5 50 GGBA COCCOC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 1891385 ZNFPHFDISPSQQS-UHFFFAOYSA-N 378.768 3.304 5 50 GGBA CCn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1O 2868945 NXFYTHWMXHOBOM-UHFFFAOYSA-N 399.432 3.310 5 50 GGBA CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2C[C@H]1CCCO1 4857674 OJNQQTUASQJPIQ-CQSZACIVSA-N 377.448 3.274 5 50 GGBA COc1ccccc1NC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc([N+](=O)[O-])c1 862517 CSUAVSIEPXPULF-QGZVFWFLSA-N 398.444 3.035 5 50 GGBA O=C(c1cccs1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4703738 OGLHFXFJOUQEGK-UHFFFAOYSA-N 386.477 3.219 5 50 GGBA CC[C@@H](C)n1c(=N)c(C(=O)NC2CCCC2)cc2c(=O)n3cccc(C)c3nc21 100662746 SPBXHVJEXRAAKM-CQSZACIVSA-N 393.491 3.080 5 50 GGBA O=C(Nc1nc2c(s1)CCCC2)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4819353 MMJKTCVPAWGJEU-UHFFFAOYSA-N 388.449 3.019 5 50 GGBA Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)Nc1ccc(OC(F)(F)F)cc1 826488 OXKPIMBRDDALBY-UHFFFAOYSA-N 378.694 3.290 5 50 GGBA COc1cc(C)c(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)c(C(=O)O)c1 170595122 ILGDUKGEMAEVDJ-UHFFFAOYSA-N 394.405 3.028 5 50 GGBA CCCC1=C(C(=O)OCC)[C@H](c2cc([N+](=O)[O-])ccc2OCC)NC(=S)N1 1126960 FDBWQOACHVALRX-INIZCTEOSA-N 393.465 3.130 5 50 GGBA C[C@@H](Oc1ccccc1)C(=O)N[C@H](CC(=O)O)c1cc([N+](=O)[O-])ccc1Cl 4689771 WRLVSFAKBTZMRE-BDJLRTHQSA-N 392.795 3.348 5 50 GGBA COc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 3880663 VGHVMCALIYNCDU-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)N1CCc2ccccc2C1 4820472 FRAXVDNLOKLWLX-NSHDSACASA-N 393.241 3.008 5 50 GGBA CN1CCN(c2ccc([N+](=O)[O-])c(NCCOc3ccc(Cl)cc3)c2)CC1 4599996 RARWAAHCGYBBFF-UHFFFAOYSA-N 390.871 3.491 5 50 GGBA CCOc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1[N+](=O)[O-] 2997459 JGYWYGSFCHLCDA-UHFFFAOYSA-N 389.433 3.285 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CC=C(c2c[nH]c3ccccc23)CC1 128862684 VQRDMVSZVFFDKQ-UHFFFAOYSA-N 390.399 3.331 5 50 GGBA CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)nc2c1c(=O)oc1ccccc12 1158639 AYOJZQNTJUWLAM-UHFFFAOYSA-N 376.328 3.270 5 50 GGBA O=C(Nc1ccc(Br)cc1Br)c1n[nH]cc1[N+](=O)[O-] 5642264 VQNDUFQAMTWQHD-UHFFFAOYSA-N 389.991 3.095 5 50 GGBA CCOC(=O)c1cc(C(=O)c2cccc([N+](=O)[O-])c2)n2ccc(C(C)=O)cc12 5672961 MHDKJSNYOWOEBF-UHFFFAOYSA-N 380.356 3.458 5 50 GGBA O=[N+]([O-])c1ccc(NCCNc2ccc(-c3ccccc3)nn2)c([N+](=O)[O-])c1 732022070 WRJGGQAODWPKAY-UHFFFAOYSA-N 380.364 3.484 5 50 GGBA Cc1ccccc1OCC(=O)N1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 5119949 QACYHPNONORWQX-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA O=C1c2ccccc2C(=O)N1CN(C(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 2942735 HDJWBUUYKYCGIX-UHFFFAOYSA-N 391.339 3.088 5 50 GGBA O=C(O)CC12C[C@@H]3C[C@H](C1)CC(n1cc(Br)c([N+](=O)[O-])n1)(C3)C2 2731981 LIFHFMVOSXLOLB-SEGBCRLWSA-N 384.230 3.324 5 50 GGBA O=C(CCCC(=O)OCC(=O)c1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1 2995741 FUYNQRLDGVMAPJ-UHFFFAOYSA-N 388.351 3.269 5 50 GGBA CNS(=O)(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 169809496 DDEDEGDJXSXOOG-UHFFFAOYSA-N 376.312 3.314 5 50 GGBA C[C@H]1CCSCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 170611255 QAZSPOJACWEEFP-VIFPVBQESA-N 384.401 3.220 5 50 GGBA CC(C)CCN1C(=O)c2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3O)cc2C1=O 4807198 UJIDGCIYOVAWPR-UHFFFAOYSA-N 397.387 3.195 5 50 GGBA Cc1ccc(C)c(-n2ccc3nc4ccn(-c5ccn[nH]5)c(=O)c4cc3c2=O)c1 40399084 ZCGYWJDOVSBVMN-UHFFFAOYSA-N 383.411 3.030 5 50 GGBA CN(C[C@H]1CCCN2CCCC[C@@H]12)C(=O)Cn1ccc2c([N+](=O)[O-])cccc21 409414771 ODSBWDUDWOIGJG-AEFFLSMTSA-N 384.480 3.272 5 50 GGBA CCOC(=O)c1cn(-c2ccc(O)cc2)c2cc(Cl)c([N+](=O)[O-])cc2c1=O 5334096 YMKNFVOSIYYCLK-UHFFFAOYSA-N 388.763 3.435 5 50 GGBA CSc1ccc(C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1[N+](=O)[O-] 253418028 XVCXOBRUSGGFFQ-UHFFFAOYSA-N 389.433 3.455 5 50 GGBA O=C1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]2CCCc3cccc(c32)N1 366313248 OVJHVUHXVSFPAH-GOSISDBHSA-N 395.415 3.293 5 50 GGBA CC(C)[C@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(I)c1 241701795 QLDNPMCKXIRKQN-QMMMGPOBSA-N 377.182 3.365 5 50 GGBA CC(C)C(=O)Nc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1 1121186 SAOIFXVYIHDJRU-UHFFFAOYSA-N 386.433 3.316 5 50 GGBA O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 328607771 XAXIZCUKXKGYIW-IIBYNOLFSA-N 396.447 3.053 5 50 GGBA COC(=O)c1ccc([N+](=O)[O-])c(NC2CCN(C(=O)OC(C)(C)C)CC2)c1 63110872 SRAQDWGSKGRXLC-UHFFFAOYSA-N 379.413 3.193 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)Nc2nccs2)c1 2318813 NGKOQZUKWIEMGY-UHFFFAOYSA-N 398.400 3.321 5 50 GGBA O=c1c2cc3c(=O)n(Cc4ccco4)ccc3nc2ccn1Cc1ccccc1 40398783 XSRDBKOTERNYSD-UHFFFAOYSA-N 383.407 3.401 5 50 GGBA CCOc1cc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)ccc1OC 4725240 CWVXQYGXYHPVJX-UHFFFAOYSA-N 385.464 3.320 5 50 GGBA COc1cc(/C=C(/Cc2ccccc2)c2nccc(=O)[nH]2)cc([N+](=O)[O-])c1O 170610377 FQEOGDFYHBNBCQ-GDNBJRDFSA-N 379.372 3.176 5 50 GGBA COc1ccc(CCn2ccc3c(c(=O)oc4ccccc43)c2=N)cc1OC 1848442897 NUNFOSZVPUZHOL-UHFFFAOYSA-N 376.412 3.487 5 50 GGBA C[C@@H](O)Cc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1-c1ccccc1 1124437 NNVBARCSKGYLDE-CYBMUJFWSA-N 398.444 3.074 5 50 GGBA O=C(Nc1ccccc1C(=O)N1CCCC[C@H]1CCO)c1cccc([N+](=O)[O-])c1 1141244 LFJUIRFBLHOUHG-INIZCTEOSA-N 397.431 3.224 5 50 GGBA Cc1cc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2C)cs1 17079482 IIRFFKKIZPCGNN-UHFFFAOYSA-N 389.462 3.491 5 50 GGBA Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCOC12CC3CC(CC(C3)C1)C2 4320446 KRTBSAPNDXTNMU-UHFFFAOYSA-N 394.493 3.167 5 50 GGBA COc1cc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])ccc1OCc1ccccc1 4719475 CYTZBOGGTNQYHK-VQHVLOKHSA-N 395.371 3.142 5 50 GGBA O=[N+]([O-])c1c(Nc2ccc(I)cc2)ccc2nonc12 5335711 NNURMGBFWVWAQK-UHFFFAOYSA-N 382.117 3.479 5 50 GGBA CC(C)C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O 3958694 VHBVRHUKEBRBBZ-KRWDZBQOSA-N 381.388 3.244 5 50 GGBA Cc1c([N+](=O)[O-])c(C(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)nn1C 6526743 LRNBKPDSJHYBGU-UHFFFAOYSA-N 384.440 3.011 5 50 GGBA O=C(NCc1cccnc1)c1nn(C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 4619358 VPYYKEHTLXETEB-UHFFFAOYSA-N 381.436 3.042 5 50 GGBA O=[N+]([O-])c1cc(Br)c(NC[C@H](O)COCc2ccccc2)cc1F 504439935 LJAHPSMJKVOOLY-LBPRGKRZSA-N 399.216 3.486 5 50 GGBA COC(=O)c1cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc(C(=O)OC)c1 1230472 OOKFUHFMGGFQSO-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA COc1ccc([C@H](CC(=O)O)NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 4594612 GLKFQWBYYXTKCN-AWEZNQCLSA-N 378.768 3.203 5 50 GGBA Cc1cc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1Cl 4901205 OXPNKWWDFFVIEX-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA O=[N+]([O-])c1c(Oc2ccc(I)nc2)nc2sccn12 225472530 MFSIBFYWUHBBQA-UHFFFAOYSA-N 388.146 3.096 5 50 GGBA COc1ccc(CN2CCOC23CCN(c2ccc([N+](=O)[O-])cc2)CC3)cc1 58980996 AZZICYIBRICOKF-UHFFFAOYSA-N 383.448 3.432 5 50 GGBA Cc1ccc(N([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1C 1070131 KJVYQIWEXFGULX-CQSZACIVSA-N 391.449 3.005 5 50 GGBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1O)c1ccc(Br)cc1 4937754 FJUGPALTYHRTPS-UHFFFAOYSA-N 396.222 3.190 5 50 GGBA COc1cc(-c2nc(N)c3c(=O)oc4ccccc4c3n2)cc(OC)c1OC 827204 XBJKKPZBVRSNIL-UHFFFAOYSA-N 379.372 3.011 5 50 GGBA O=[n+]1c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)cn(O)c2ccccc21 368146797 JKDNRZFQYWOROY-UHFFFAOYSA-N 381.375 3.433 5 50 GGBA Cc1ccc(N2C[C@H]3[C@H](NC(=O)Cc4coc5ccccc45)[C@H]3C2)c([N+](=O)[O-])c1 1775993171 WUAKCUZELZRUIK-YPGOJHLTSA-N 391.427 3.443 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 792944 GUKLNNOASPYBFV-GOSISDBHSA-N 381.388 3.308 5 50 GGBA COc1ccccc1[C@@H]1SCCN1S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 4903150 OKACGWRJTOAVLI-KRWDZBQOSA-N 394.474 3.348 5 50 GGBA O=C(NC(=S)/N=c1/[nH]c(-c2ccccc2)cs1)c1ccccc1[N+](=O)[O-] 2985897 WZUJPSZKRUIEKJ-UHFFFAOYSA-N 384.442 3.267 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O 1110350 TZSHYWVOPSEOTH-UHFFFAOYSA-N 376.324 3.215 5 50 GGBA O=c1c2cc3c(=O)n(-c4ccccc4)ccc3nc2ccn1Cc1cccnc1 38829137 AKLLXVSFAAYQQX-UHFFFAOYSA-N 380.407 3.144 5 50 GGBA CCOC(=O)N1CCN(c2cc(N3CCC(C)CC3)c(F)cc2[N+](=O)[O-])CC1 5060792 KHUHNTDUHARQPW-UHFFFAOYSA-N 394.447 3.249 5 50 GGBA CNC(=O)[C@@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C 4052732 ZMDRBAMYRFLMHU-LLVKDONJSA-N 378.307 3.094 5 50 GGBA Cc1nn(C)c(C)c1NC(=O)c1nn(C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 6184299 QLNIPPCEFKWWOI-UHFFFAOYSA-N 398.467 3.319 5 50 GGBA COC(=O)c1c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)sc2c1CCCC2 6578900 GUYIVWZFRSQKOV-UHFFFAOYSA-N 396.446 3.123 5 50 GGBA O=C1c2cccc3cccc(c23)C(=O)N1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2901798 BLFNKDCMQSAJFR-UHFFFAOYSA-N 379.284 3.246 5 50 GGBA CC(=O)Nc1ccc(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 1181354 OTQZBYYULAPJMR-BJMVGYQFSA-N 384.417 3.080 5 50 GGBA COc1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cc1[N+](=O)[O-] 4263285 KHSWBBCQMHFAOV-UHFFFAOYSA-N 390.461 3.247 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(c1nccs1)C2=O 844882 HMBGVULVYAMJOZ-UHFFFAOYSA-N 379.353 3.083 5 50 GGBA O=[N+]([O-])c1ccccc1S(=O)(=O)NCCSCc1ccc(Cl)cc1 2980921 CKAQFYDGLHTXNE-UHFFFAOYSA-N 386.882 3.460 5 50 GGBA O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)cc1 4181339 UFHCEZWFXJZECH-UHFFFAOYSA-N 397.456 3.259 5 50 GGBA COC(=O)[C@@H]1C[C@@]23CCC[N@+]4(C)CC[C@@]5(c6ccccc6N(C(C)=O)[C@]15CC2)[C@@H]34 252460007 AVRZAJRDJDMMDG-PHJBHIMUSA-N 395.523 3.016 5 50 GGBA CCOC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])o2)c(C(=O)OCC)c1C 2998336 VDCLHJYXXIBLKD-UHFFFAOYSA-N 396.377 3.163 5 50 GGBA O=C1CN(C(=O)c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c2ccccc2N1 3878876 CYVGPZSENLMOCJ-UHFFFAOYSA-N 380.404 3.184 5 50 GGBA O=C(Nc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1)c1ccco1 6270511 WLQNYNVLDZMUIA-UHFFFAOYSA-N 387.373 3.241 5 50 GGBA CCO[C@H]1C[C@H](O)C12CCN(c1cc(C)c([N+](=O)[O-])cc1Br)CC2 302677007 NGXYXASBROJORK-HOTGVXAUSA-N 399.285 3.422 5 50 GGBA O=C(Nc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1)c1ccco1 1125638 AAYOEDBEMMGHBQ-UHFFFAOYSA-N 387.373 3.241 5 50 GGBA O=C(Nc1nccs1)c1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1 3109383 SJLFQFCZKCCDJD-UHFFFAOYSA-N 394.368 3.104 5 50 GGBA COc1ccc(C(=O)NC(=S)Nc2ccccc2OC(F)F)cc1[N+](=O)[O-] 1113948 CXTKIJOVHXGXOW-UHFFFAOYSA-N 397.359 3.332 5 50 GGBA C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)n1cc([N+](=O)[O-])c(-c2nccs2)n1 225653845 MQEQRKIUFNKDKU-VIFPVBQESA-N 388.365 3.023 5 50 GGBA COc1cc2c(cc1OC)[C@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])CC(=O)N2 4913742 VOTZSQVAULQOSR-SNVBAGLBSA-N 388.376 3.103 5 50 GGBA O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CNc1ccc(Br)cc1 864618 NQQBVFLQWJOTRL-UHFFFAOYSA-N 376.166 3.023 5 50 GGBA Cc1nn(C)c(C(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)c1[N+](=O)[O-] 4652179 ZZXPKORRVMKLNV-UHFFFAOYSA-N 384.440 3.011 5 50 GGBA O=[N+]([O-])c1cc2c(c(CS(=O)(=O)Cc3ccc4c(c3)CCC4)c1)OCOC2 170628769 UEHYUNUPGWJZCM-UHFFFAOYSA-N 389.429 3.065 5 50 GGBA Cc1nc(CO[C@@H]2CCN(c3ncc(Br)cc3[N+](=O)[O-])C2)cs1 225396898 ARPWXELPTXWBPX-GFCCVEGCSA-N 399.270 3.313 5 50 GGBA CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)Cc1ccccc1[N+](=O)[O-] 873009 PECYTDHCXJHSNB-UHFFFAOYSA-N 394.387 3.138 5 50 GGBA O=[N+]([O-])c1ccc2c(c1)[C@@H](N1CCOCC1)/C(=C/COc1ccc(F)cc1)O2 19708471 KMVDMQZVRNHJDE-NOLXPEPHSA-N 386.379 3.463 5 50 GGBA CCOc1cccc(C(=O)NC(=S)Nc2ccc(OC)cc2[N+](=O)[O-])c1 4687309 BAUMIVFGXBMECB-UHFFFAOYSA-N 375.406 3.129 5 50 GGBA O=C(NCc1ccco1)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1 4833440 QGFMDEHDOOTLKD-UYRXBGFRSA-N 391.383 3.275 5 50 GGBA O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(N2CCOCC2)c(Cl)c1 861653 AROCIECMHBBIQN-UHFFFAOYSA-N 391.811 3.102 5 50 GGBA C[C@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1S(=O)(=O)c1ccccc1 4188666 GYZCCWZXUKPMBU-ZDUSSCGKSA-N 395.868 3.148 5 50 GGBA C[C@@H](Oc1ccccc1)C(=O)N[C@@H](CC(=O)O)c1cc([N+](=O)[O-])ccc1Cl 4689768 WRLVSFAKBTZMRE-BZNIZROVSA-N 392.795 3.348 5 50 GGBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(Cc2ccccc2)n1C 4715505 QUOVXPOSBBTDLC-UHFFFAOYSA-N 397.460 3.353 5 50 GGBA COCCOc1ccc(Cl)cc1NC(=O)COc1ccccc1[N+](=O)[O-] 4821151 FPRHHUNMWVBFDS-UHFFFAOYSA-N 380.784 3.291 5 50 GGBA Cc1nc(C)n(C[C@@H]2CCCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)n1 266028888 QZPSVHYHAVABLX-MRXNPFEDSA-N 385.468 3.020 5 50 GGBA CCOC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(OCC)cc1 4653349 PUSMRUYBNPCMKX-SFHVURJKSA-N 386.404 3.418 5 50 GGBA CCc1cccc(S(=O)(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)c1 435194623 AINVXUSANHUTCB-UHFFFAOYSA-N 386.433 3.452 5 50 GGBA COc1cc(/C=C/c2nc(O)c([N+](=O)[O-])c(=O)[nH]2)ccc1OCc1ccccc1 16214823 LUXNFPDWFZDOAP-CSKARUKUSA-N 395.371 3.142 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccc3ccccc23)CC1 893103 NJSOBDBFRCEQCK-UHFFFAOYSA-N 389.411 3.346 5 50 GGBA CNC(=O)[C@H](Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C 4052733 ZMDRBAMYRFLMHU-NSHDSACASA-N 378.307 3.094 5 50 GGBA CCOc1ccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc1[N+](=O)[O-] 19683076 HSKFAPOVAAIHAU-UHFFFAOYSA-N 385.420 3.078 5 50 GGBA O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1C(=O)NCc1ccco1 1111574 CRPDAHGYPJYRHR-UHFFFAOYSA-N 379.372 3.299 5 50 GGBA O=C(N[C@@H]1CNc2ccccc2C1)c1cc(F)cc([N+](=O)[O-])c1Br 2325862152 KTIVSUAOHDPSOF-NSHDSACASA-N 394.200 3.263 5 50 GGBA Cn1c(SCC(=O)Nc2ccccc2F)nnc1-c1ccc([N+](=O)[O-])cc1 1165447 PNJBQZCZTRONCU-UHFFFAOYSA-N 387.396 3.260 5 50 GGBA COc1cc(/C=C/C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc(OC)c1OC 1150059 OSTJOUGCAYILAZ-QPJJXVBHSA-N 376.340 3.412 5 50 GGBA COc1ccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])o2)cc1 4475491 PFSVLODJRJRRDF-UHFFFAOYSA-N 386.389 3.384 5 50 GGBA COc1ccc(OC)c(NC(=O)c2cn(Cc3ccc([N+](=O)[O-])cc3)cn2)c1 71775246 BBZTYOHLWTZIKX-UHFFFAOYSA-N 382.376 3.109 5 50 GGBA CCn1cc(NC(=O)c2cccc([N+](=O)[O-])c2)c(C(=O)Nc2ccccc2)n1 2796514 WSSXEPFMIGKOPP-UHFFFAOYSA-N 379.376 3.316 5 50 GGBA O=c1[nH]c(/C=C/c2ccc(OCc3ccc(Cl)cc3)cc2)c([N+](=O)[O-])c(=O)[nH]1 13607313 OVZHIMFEHXCLTH-BJMVGYQFSA-N 399.790 3.374 5 50 GGBA CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1C 817960 LCWPLSIEHXWGNW-GOSISDBHSA-N 381.388 3.308 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 847278 UKAQQSAQPFVDPS-GOSISDBHSA-N 381.388 3.009 5 50 GGBA C[C@@H](C(=O)Nc1cnn(Cc2c(F)cccc2Cl)c1)n1cc([N+](=O)[O-])cn1 2756195 WUESAEYESZASIU-JTQLQIEISA-N 392.778 3.028 5 50 GGBA CCn1ncc(-c2ccnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2)c1C 2809256 SFPKJUHRGMMCNN-UHFFFAOYSA-N 398.448 3.307 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=S)N[C@H](C)c1ccc2c(c1)OCO2 4999200 UOVPCMHQWQCFIA-SNVBAGLBSA-N 375.406 3.380 5 50 GGBA CC(C)Oc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1 951047 IHMFPQVHLYMNSF-UHFFFAOYSA-N 397.387 3.007 5 50 GGBA C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 225385065 DURNGRGZAUNRDK-UWJYYQICSA-N 394.475 3.079 5 50 GGBA COC(=O)c1c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)sc2c1CCC2 672953 NHIAQRNQVINIGK-UHFFFAOYSA-N 376.390 3.193 5 50 GGBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Br 4663376 OKWJRXDLBRXTTH-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA COc1ccc(-c2noc(CCC(=O)Nc3ccccc3[N+](=O)[O-])n2)cc1OC 4784023 NMDBUGSTWSQJRR-UHFFFAOYSA-N 398.375 3.233 5 50 GGBA O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccccc2F)C1 1163429 QBTXWFWDEFVSGI-SNVBAGLBSA-N 377.759 3.379 5 50 GGBA CC(=O)Nc1cccc(NC(=O)CSc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 2773111 OHSXLILLPWXWSK-UHFFFAOYSA-N 385.405 3.160 5 50 GGBA Cn1ncc(-c2nc3ccccc3[nH]2)c1NC(=O)c1cc(F)c([N+](=O)[O-])cc1F 328596573 DHFMJCQGZDJUDR-UHFFFAOYSA-N 398.329 3.402 5 50 GGBA CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccccc2[N+](=O)[O-])n2ncnc2N1 954658 GXIBOOZGADKBJI-SFHVURJKSA-N 390.403 3.422 5 50 GGBA O=C(CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])OCC(=O)c1ccccc1 4982291 HQMTZNRLVDUCQU-UHFFFAOYSA-N 387.348 3.121 5 50 GGBA COc1ccc(NC(=O)CSc2nc(C)c3c(n2)CCCC3)c([N+](=O)[O-])c1 4820628 UOQOFYVFIIFECA-UHFFFAOYSA-N 388.449 3.311 5 50 GGBA COc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)o2)cc1 4475469 QFWVACFPNILPMP-UHFFFAOYSA-N 386.389 3.384 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCOCC2)c(Cl)c1 1167370 BNEVMVPOVIJAFE-UHFFFAOYSA-N 391.811 3.102 5 50 GGBA O=C(c1ccccc1)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@]1(O)C(F)(F)F 1194954 AZRNCVGIYLPKIS-INIZCTEOSA-N 379.294 3.096 5 50 GGBA CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@]2(C(=O)NCc2ccccc2[N+](=O)[O-])C1 240886254 IOGPNJUARDHEFJ-FOIQADDNSA-N 389.452 3.248 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1)c1ccc([N+](=O)[O-])cc1 95393626 MZTCVDDYQVINPU-ROUUACIJSA-N 394.383 3.494 5 50 GGBA O=C(Nc1ccc(F)c(Cl)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4820848 PCFLHEHTJAZKQV-UHFFFAOYSA-N 379.775 3.476 5 50 GGBA C[C@H](Cc1ccccc1[N+](=O)[O-])[C@@H](C)N[C@H]1CCCN(CC(F)(F)F)C1=O 252536877 JRYVQVSWNRULKX-NFAWXSAZSA-N 387.402 3.305 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])CC(=O)N1 1213128 FZYKPCUPBIWGIX-QGZVFWFLSA-N 380.400 3.258 5 50 GGBA O=C(Nc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccnc1)c1cccs1 1165505 IOYFSHMYHLESLK-UHFFFAOYSA-N 382.401 3.234 5 50 GGBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(Cl)cc1C(=O)c1ccccc1 2764863 QMZMVRLHJIBTPF-UHFFFAOYSA-N 384.779 3.314 5 50 GGBA COc1ccc(S(=O)(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)cc1 855067 YWWUASIVCOONIQ-INIZCTEOSA-N 380.447 3.040 5 50 GGBA CCN(C(=O)c1cccc([N+](=O)[O-])c1)c1c(C)n(C)n(-c2ccccc2)c1=O 1186193 NWSLNYKZGYKBFT-UHFFFAOYSA-N 380.404 3.059 5 50 GGBA O=[N+]([O-])c1ccc(OC[C@@H](O)Cn2c(C(F)(F)F)nc3ccccc32)cc1 4819254 QFAKQPYVTQVNFM-LBPRGKRZSA-N 381.310 3.403 5 50 GGBA COC(=O)c1cc(C)sc1NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])c(C)c1 4749998 OXECEIMEUGJXHB-LLVKDONJSA-N 378.406 3.466 5 50 GGBA O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@@H]2CCCC[C@]21c1ccccc1 134367277 CZKMBSLVWFWJJP-KKSFZXQISA-N 379.416 3.461 5 50 GGBA O=C1[C@@H]2CS[C@@H](c3cccc([N+](=O)[O-])c3)N2C(=S)N1c1ccc(F)cc1 4686626 KUXIOXFQKPWCFU-HOCLYGCPSA-N 389.433 3.482 5 50 GGBA CCn1ncc(Cl)c1C(=O)NC(=S)Nc1c(C)cc(C)cc1[N+](=O)[O-] 5585574 PGLDBNZKBZUTOW-UHFFFAOYSA-N 381.845 3.208 5 50 GGBA CCOc1ccc(NC(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 1134039 JTZTXTYOTAQBDK-UHFFFAOYSA-N 397.431 3.484 5 50 GGBA COc1ccc(C(=O)N2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)cc1 4310062 RIHMZRJSBOXKJG-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(I)cc1 1227070 UCRRXNDIFQGCGG-UHFFFAOYSA-N 382.157 3.381 5 50 GGBA Cc1ccccc1NC(=O)CSc1nnc(-c2ccc([N+](=O)[O-])cc2)n1C 1137380 YAFRUFICSGTKKK-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA Cc1ccc(C(=O)[C@H](C)OC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1 789083 XRUIETFJVTWKIG-LBPRGKRZSA-N 381.340 3.438 5 50 GGBA aggregator CCOC(=O)N1CCN(c2cc(N3CCCCCC3)c(F)cc2[N+](=O)[O-])CC1 4619348 UQSWPOIWGHULPB-UHFFFAOYSA-N 394.447 3.393 5 50 GGBA CO[C@@H]1C[C@@H]2[C@@H](C[C@]1(C)OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2(C)C 239338913 LKISZDGHIQPGMP-ADAWSYLGSA-N 378.381 3.500 5 50 GGBA O=[N+]([O-])c1ccc(N2CCC(c3ccnn3CCO)CC2)cc1C(F)(F)F 170649941 VLDKOWGPWAPSCJ-UHFFFAOYSA-N 384.358 3.186 5 50 GGBA O=C(Cc1ccccc1)N1N=C(c2ccc([N+](=O)[O-])cc2)C[C@]1(O)C(F)(F)F 1214640 PMVWPIZSMPHRPE-KRWDZBQOSA-N 393.321 3.025 5 50 GGBA O=[N+]([O-])c1ccccc1CN1CCN(C2CCN(Cc3ccccc3)CC2)CC1 4724318 DPJGXWZKSCLWPA-UHFFFAOYSA-N 394.519 3.377 5 50 GGBA CCc1ccc(C(=O)COC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 4865525 VQDSEUNRAHMUNZ-UHFFFAOYSA-N 384.388 3.302 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)C[C@H]2CSc3nc4ccccc4n32)cc1 2853702 JXWKIQVKEOTOPH-GFCCVEGCSA-N 375.431 3.065 5 50 GGBA Cc1cc(N2CCN(C(=O)c3ccc(F)c(F)c3)CC2)c(F)cc1[N+](=O)[O-] 4498420 ZCRFXHOPRCVJAF-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA CCOC(=O)c1c(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)sc(C)c1C 17903259 MRFATQKNBVINFU-UHFFFAOYSA-N 384.435 3.251 5 50 GGBA Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1 126383658 YTICXATZALUELW-ZWKOTPCHSA-N 390.484 3.101 5 50 GGBA O=C(CCc1ccccc1)N1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 871870 AGUDJCOGXVPHKZ-UHFFFAOYSA-N 396.472 3.486 5 50 GGBA O=C(N[C@H]1CC[C@H](Nc2ccccc2[N+](=O)[O-])CC1)c1nc[nH]c1C(F)(F)F 1775986906 RKBMRCOLHNQILR-XYPYZODXSA-N 397.357 3.490 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2OC)cc1 4090419 NVVSULQLSZGWMH-UHFFFAOYSA-N 375.406 3.129 5 50 GGBA O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1cc(OCC(F)(F)F)cc([N+](=O)[O-])c1 2763730 IHKSVVIOCCZBMR-STQMWFEESA-N 390.314 3.365 5 50 GGBA O=[N+]([O-])c1ccc(NC(=S)NNC(=S)Nc2ccc(Cl)cc2)cc1 4999153 VOLULTJZXZPKKH-UHFFFAOYSA-N 381.870 3.436 5 50 GGBA C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 170601129 UPBYJZHXRKQFTD-IYKWBQJMSA-N 389.452 3.370 5 50 GGBA O=C(c1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4143413 NWBOSBOQTRTWOR-UHFFFAOYSA-N 384.411 3.271 5 50 GGBA O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4045850 KTAXFVIBAKYFJU-UHFFFAOYSA-N 390.783 3.119 5 50 GGBA Cc1n[nH]c(-n2ccc3nc4ccn(C5CCCCCC5)c(=O)c4cc3c2=O)n1 40268743 IRIFHCKAJWFTSS-UHFFFAOYSA-N 390.447 3.022 5 50 GGBA COc1cccc(CN2CCN(C(=S)Nc3ccc([N+](=O)[O-])cc3)CC2)c1 20274240 OFKCMNBHGABNQQ-UHFFFAOYSA-N 386.477 3.118 5 50 GGBA COc1ccccc1N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 713414 ZWHCRISXJBNTQI-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA CC(C)Oc1ccc(/C=C/c2nc(O)[nH]c(=O)c2[N+](=O)[O-])cc1Br 5041817 IIGCWXGOZFXUHM-HWKANZROSA-N 396.197 3.104 5 50 GGBA COc1ccc(C(=O)CSc2nc(C)[nH]c2[N+](=O)[O-])cc1Br 5490228 PUQBOZJOWSKZCZ-UHFFFAOYSA-N 386.227 3.372 5 50 GGBA COc1ccc(-c2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2C)cc1 1064020 MLFBLOSXCWYDTI-UHFFFAOYSA-N 384.417 3.374 5 50 GGBA O=C(c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1)N1CCCCCC1 1111759 MCURHHAYVUASTF-UHFFFAOYSA-N 393.399 3.412 5 50 GGBA COc1ccc(C(=O)Nc2cccc(I)c2)cc1[N+](=O)[O-] 1121606 VSTXSTTWVMQQSE-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA COc1ccc(C[C@@H](C)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC 23283095 ZGZWGNADAYDZDC-MRXNPFEDSA-N 385.464 3.365 5 50 GGBA CCCN(C[C@H]1CCCCO1)S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] 170622697 GVYYIXSTNVOVBU-CYBMUJFWSA-N 376.862 3.218 5 50 GGBA CCNc1ccc(S(=O)(=O)C(F)(F)[C@@H](F)C(F)(F)F)cc1[N+](=O)[O-] 5101863 AXOOGHCZRZPZLW-VIFPVBQESA-N 380.266 3.294 5 50 GGBA CCN1CCN(c2c(Cl)cccc2NC(=O)c2ccc([N+](=O)[O-])o2)CC1 5027970 KWFBVEATMWFFBA-UHFFFAOYSA-N 378.816 3.235 5 50 GGBA Cn1c(Cc2ccccc2)nnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1 4690776 KUFSVKHSOOHOCK-UHFFFAOYSA-N 383.433 3.045 5 50 GGBA N=C1S/C(=C/c2c[nH]nc2-c2cccc([N+](=O)[O-])c2)C(=O)N1c1nccs1 12428904 YFHBTHLIUXEHRF-RJUSJVAFSA-N 398.429 3.497 5 50 GGBA CN(C)CCn1ncc(C(=O)Nc2cccc([N+](=O)[O-])c2)c1-c1ccccc1 253431960 VEYGBEYTSJIWNH-UHFFFAOYSA-N 379.420 3.272 5 50 GGBA C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1C(=O)c1ccc(F)cc1F 4918936 JOCAJCXHTBLALS-LLVKDONJSA-N 379.338 3.363 5 50 GGBA Cc1ccc([C@H]2CC(c3ccccc3[N+](=O)[O-])=NN2C(=O)CCC(=O)O)cc1 240333485 FDMYHNZKZLAZKE-GOSISDBHSA-N 381.388 3.446 5 50 GGBA COC(=O)CN1C(=O)S/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1=O 1138079 VTMBWPXHSIHMHC-ZSOIEALJSA-N 388.357 3.064 5 50 GGBA Cc1ccccc1Cn1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1 17077911 NUHZDINCHVYBFC-UHFFFAOYSA-N 381.348 3.309 5 50 GGBA Cc1ccccc1Oc1cc(N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc([N+](=O)[O-])c1 226739828 KABZEXOEDWBXCZ-YRXWBPOGSA-N 394.383 3.362 5 50 GGBA O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1O)C12CC3CC(CC(C3)C1)C2 3878499 XHSFKUFTMVTAPU-UHFFFAOYSA-N 375.450 3.330 5 50 GGBA COc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 4608184 QRJSTVDOEXPBIT-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA Cc1nn(C(=O)c2nn(C)cc2[N+](=O)[O-])c(C)c1C12CC3CC(CC(C3)C1)C2 6525973 WAFGCTMSEIUCLH-UHFFFAOYSA-N 383.452 3.298 5 50 GGBA COC(=O)[C@@H]1C[C@@]23CCC[N@+]4(C)CC[C@@]5(c6ccccc6N(C(C)=O)[C@@]15CC2)[C@@H]34 253614748 AVRZAJRDJDMMDG-LFBVJSBHSA-N 395.523 3.016 5 50 GGBA biogenic,in-vitro O=C(O)c1ccc([N+](=O)[O-])cc1N1C(=O)c2cc(Cl)c(Cl)cc2C1=O 1163330 JIMGCKGPCSAORM-UHFFFAOYSA-N 381.127 3.400 5 50 GGBA CCCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(OC)cc1 5012058 RSRYEHDZSBDZMY-RGEXLXHISA-N 397.431 3.291 5 50 GGBA CN(C[C@H]1OCCc2ccccc21)C(=O)c1cc2cc([N+](=O)[O-])ccc2n1C 2325862349 QRPWIPMGWJDBLE-HXUWFJFHSA-N 379.416 3.473 5 50 GGBA Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc3cc(Br)ccc3[nH]2)c1=O 2332239386 ONRLEINPMNVNBX-UHFFFAOYSA-N 390.193 3.192 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C2CCCCC[C@H]2[C@]1(O)C(F)(F)F 845878 QYZFHWDKCCIZQU-CJNGLKHVSA-N 385.342 3.167 5 50 GGBA Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N(C)Cc1cc(F)c(F)c(F)c1 122242244 GAIRAENLQPWRDU-UHFFFAOYSA-N 395.337 3.226 5 50 GGBA CC(C)C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O 991250 CQJZLRLAQGNNDS-QGZVFWFLSA-N 381.388 3.244 5 50 GGBA Cc1c(C(=O)NC(=S)Nc2ccc(Cl)c(C(=O)O)c2)cccc1[N+](=O)[O-] 3000735 HFIZUSOMJYKLLM-UHFFFAOYSA-N 393.808 3.382 5 50 GGBA O=c1oc(-c2ccc(F)cc2)nn1Cc1ccc(Br)c([N+](=O)[O-])c1 170617575 UZOUVWABXFEMAS-UHFFFAOYSA-N 394.156 3.361 5 50 GGBA CC(C)c1ccccc1NC(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 850458 ANJHLZFOYWUCJE-UHFFFAOYSA-N 381.388 3.343 5 50 GGBA O=C(NC(=S)/N=c1/[nH]c(-c2cccc([N+](=O)[O-])c2)cs1)c1ccccc1 2978798 XKFOYEIMAYADHJ-UHFFFAOYSA-N 384.442 3.267 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)N1N=C(c2ccccc2)C[C@@]1(O)C(F)(F)F 1211764 WBDVRMIMBIHEOF-MRXNPFEDSA-N 379.294 3.096 5 50 GGBA O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc1cccc([N+](=O)[O-])c1 1774477 PWXFZMVWDDZTAG-UHFFFAOYSA-N 381.388 3.390 5 50 GGBA COc1cc(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])c(OC)cc1Cl 1775971564 UYTSWYGSPQQGLQ-UHFFFAOYSA-N 380.740 3.216 5 50 GGBA Cc1ccc(C(=O)COC(=O)CCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] 2339454 AXJNQYGJELFHMN-UHFFFAOYSA-N 388.351 3.187 5 50 GGBA Cc1ccc(-c2nn3c(C)nnc3s2)cc1NC(=O)c1ccc([N+](=O)[O-])o1 2861403 GWKKFPCUJZRPRA-UHFFFAOYSA-N 384.377 3.223 5 50 GGBA O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccccc2)c(C(F)(F)F)c1 4143446 LACYVQTZFLNCGK-UHFFFAOYSA-N 389.355 3.004 5 50 GGBA COC(=O)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc(C(=O)OC)c1 834097 XTDOJUAIZZCZJS-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA Cc1ccccc1Cn1ccc(NC(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)n1 2886437 HRBLVRQGAXUFTG-UHFFFAOYSA-N 396.451 3.380 5 50 GGBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 4619269 IEJJJXLLIFPGOZ-SNVBAGLBSA-N 377.759 3.379 5 50 GGBA Cn1ncc2c(-c3ccc4c(c3)n(C)c(=O)n4C)c3oc4cc(O)ccc4c3nc21 252508932 XYAVQFBJLKZXKZ-UHFFFAOYSA-N 399.410 3.431 5 50 GGBA CC(=O)N[C@@H](NC(=S)Nc1ccc([N+](=O)[O-])cc1C)C(Cl)(Cl)Cl 4531816 AQKWOIFUHUHBMR-JTQLQIEISA-N 399.687 3.022 5 50 GGBA Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccs1 10302838 YECDNIPFSRRZLG-UHFFFAOYSA-N 375.435 3.183 5 50 GGBA COc1ccccc1NC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc([N+](=O)[O-])cc1 862505 WLUBFPVTOTYMBD-QGZVFWFLSA-N 398.444 3.035 5 50 GGBA CCc1cccc2c1N(C(=O)[C@H]1CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C1)CC2 746791117 UXNPCJGKEJKMQB-HNNXBMFYSA-N 397.406 3.239 5 50 GGBA COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 1183453 KLPGXGHRJUKGNH-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(Br)cc2F)c1 5059510 HWNHWNQJMDCRPD-UHFFFAOYSA-N 375.175 3.297 5 50 GGBA O=C(NC(=S)/N=c1/[nH]c(-c2cccc([N+](=O)[O-])c2)cs1)c1cccs1 2814181 UYQSATPDFLOCAJ-UHFFFAOYSA-N 390.471 3.329 5 50 GGBA COc1ccc(NC(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1 4819555 IOMVZRAHQOEBJS-VMPITWQZSA-N 388.376 3.281 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)NCCOc2cccc(Cl)c2Cl)c1 5077909 JFTDQZVIYRAUCR-UHFFFAOYSA-N 391.232 3.259 5 50 GGBA Cc1c(N(C(=O)c2ccc([N+](=O)[O-])cc2)C(C)C)c(=O)n(-c2ccccc2)n1C 1203055 KWSBBYMTBOKFAZ-UHFFFAOYSA-N 394.431 3.448 5 50 GGBA CC(C)(C)Oc1ccc(C[C@@H](NSc2ncccc2[N+](=O)[O-])C(=O)O)cc1 28631508 DTMLYWDPCJWGPQ-CQSZACIVSA-N 391.449 3.460 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cnn2cc(Br)cnc12 4811158 TWPHSAZITRTTIV-UHFFFAOYSA-N 396.588 3.306 5 50 GGBA CC(=O)c1cccc(NC(=S)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 4999009 MJWKFEXYCDFMES-UHFFFAOYSA-N 384.461 3.316 5 50 GGBA CCOC(=O)C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(OCC)cc1 4653340 GADUUSDBELZTJN-QGZVFWFLSA-N 386.404 3.418 5 50 GGBA CCOc1ccc2c(c1)S[C@H](CC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N2 5013466 XFFAQIDOTSXFIM-MRXNPFEDSA-N 387.417 3.435 5 50 GGBA CCNc1cc(N2CCN(C(=O)c3cccc(C)c3OC)CC2)ccc1[N+](=O)[O-] 4739213 ZNPQVWPVAFBSME-UHFFFAOYSA-N 398.463 3.306 5 50 GGBA C[C@H]1CN(c2ccc(C(=O)c3ccccc3C(=O)O)cc2[N+](=O)[O-])C[C@H](C)O1 4978727 OGMBAKGZBAWXRQ-STQMWFEESA-N 384.388 3.138 5 50 GGBA O=C(NC(=S)Nc1cccc([N+](=O)[O-])c1)c1ccccc1Br 680948 TZWOUZJJQYAOMZ-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCO[C@@H](c3ccc(Cl)cc3)C2)c1 229512929 IYKIKJKJAKNLOC-IEBWSBKVSA-N 392.839 3.061 5 50 GGBA O=C(Cc1ccc([N+](=O)[O-])cc1)N1N=C2CCCCC[C@@H]2[C@]1(O)C(F)(F)F 845877 QYZFHWDKCCIZQU-BBRMVZONSA-N 385.342 3.167 5 50 GGBA O=[N+]([O-])c1ccccc1N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 4575398 XMYBFZXOJVREEF-UHFFFAOYSA-N 397.456 3.259 5 50 GGBA CC1=C(C(=O)Nc2cc(C)cc(C)c2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 5059381 UUQRBPUWUGISPX-GOSISDBHSA-N 380.404 3.478 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@H]2c2cccc([N+](=O)[O-])c2)cc1OC 863602 UMVVDGNEOFPERV-IBGZPJMESA-N 388.445 3.429 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1154480 CJUKVMWTGNAFAN-GOSISDBHSA-N 380.404 3.478 5 50 GGBA O=C1C(=O)N(CN2CCC(Cc3ccccc3)CC2)c2ccc([N+](=O)[O-])cc21 15636284 NHPOHTBEDNJLTQ-UHFFFAOYSA-N 379.416 3.036 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 3878917 MGCVKYONTPTAFN-UHFFFAOYSA-N 391.405 3.326 5 50 GGBA aggregator Cn1c(=O)n(C)c2cc(-c3c4cn[nH]c4nc4c3oc3cc(O)ccc34)ccc21 218214568 QOONGZAOTXWMTR-UHFFFAOYSA-N 385.383 3.420 5 50 GGBA O=C1c2ccc(-c3nc4ccc([N+](=O)[O-])cc4o3)cc2C(=O)N1C[C@H]1CCCO1 1064374 DQQQFDXAJFBLKC-CYBMUJFWSA-N 393.355 3.178 5 50 GGBA O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCc1ccc2ccccc2c1 5013345 XIGCTNCOEAIMRF-UHFFFAOYSA-N 390.351 3.087 5 50 GGBA O=C(N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1)C(Cl)(Cl)Cl 4457587 OTDDBXWSKWMISI-UHFFFAOYSA-N 387.050 3.267 5 50 GGBA O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(I)c1 1117697 XLJDQSRZMHXZRC-UHFFFAOYSA-N 382.157 3.381 5 50 GGBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1sc2c(c1C(=O)c1ccccc1)CCC2 178912197 NZUXDTHEXLHYTP-UHFFFAOYSA-N 396.428 3.211 5 50 GGBA CCOC(=O)N1CCN(C(=O)c2sc3cc([N+](=O)[O-])ccc3c2Cl)CC1 1053977 CVAYQOZOBXCNGF-UHFFFAOYSA-N 397.840 3.377 5 50 GGBA CC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](CC)CN1CC(C)(C)O 230288679 NBHREHWMXWYGLG-JKSUJKDBSA-N 378.473 3.072 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)Oc1ccc2c(C)cc(=O)oc2c1 4071433 UOMAIMHHMHSYCV-GFCCVEGCSA-N 398.371 3.424 5 50 GGBA CCn1c(=O)c2c(O)c(Cc3ccc([N+](=O)[O-])cc3)c(=O)oc2c2ccccc21 4038371 ZCIAAFZMOZKIBO-UHFFFAOYSA-N 392.367 3.332 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(Br)cc1 5092654 HFXBNGIHWKSJOJ-UHFFFAOYSA-N 381.182 3.383 5 50 GGBA COc1cc(CN2CCN(C/C=C/c3ccccc3)CC2)cc([N+](=O)[O-])c1O 19536756 WRVNAKWIFCESSP-VMPITWQZSA-N 383.448 3.140 5 50 GGBA CCOc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])cc(OC)c2oc1=O 789080 GMFSOPFBGNYWJU-UHFFFAOYSA-N 384.344 3.361 5 50 GGBA O=[N+]([O-])c1cc2c(cc1CN1CCN(c3cccc(Cl)c3)CC1)OCO2 55543679 SUGAZWZTCJZVRH-UHFFFAOYSA-N 375.812 3.299 5 50 GGBA O=C(Nc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1N1CCNCC1 4983943 IAOWLAUWMMZPTI-UHFFFAOYSA-N 394.353 3.276 5 50 GGBA Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)N1CCCc2ccccc21 2884316 LLKGMVMTRNLTOL-LLVKDONJSA-N 393.241 3.403 5 50 GGBA O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccn(Cc2ccc(Cl)cc2)n1 2760816 OTYOEROSJSCQIX-UHFFFAOYSA-N 392.824 3.294 5 50 GGBA C[C@@H](SCc1nc2ccccc2c2nc(=O)c(-c3ccccc3)nn12)C(=O)O 253429159 CBIORLVEYBBPPD-GFCCVEGCSA-N 392.440 3.011 5 50 GGBA CC(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccco3)c2)CC1 4575576 STOOPEWCLPGFQD-UHFFFAOYSA-N 386.452 3.495 5 50 GGBA CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1 1213961 GPXRCZCCZSPWFM-INIZCTEOSA-N 387.417 3.211 5 50 GGBA CCO[C@@H]1C[C@@H](O)C12CCN(c1cc(C)c([N+](=O)[O-])cc1Br)CC2 302677009 NGXYXASBROJORK-HZPDHXFCSA-N 399.285 3.422 5 50 GGBA O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H]1c1nc(-c2cccc(C(F)(F)F)c2)c[nH]1 225400951 ALIIUGKTORWBID-BPLDGKMQSA-N 394.353 3.424 5 50 GGBA O=C1c2ccccc2C(=O)N1c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] 4800291 JAADRFBFMFMTMM-UHFFFAOYSA-N 381.222 3.322 5 50 GGBA O=C(CCn1cc(Cl)c([N+](=O)[O-])n1)Nc1ccc(Br)cc1F 2731090 MRPXJOYIUJIPIZ-UHFFFAOYSA-N 391.584 3.375 5 50 GGBA CCOC(=O)c1cc2c(=O)n3cccc(C)c3nc2n(C2CCCCC2)c1=N 100627824 WPKAKBCTJBMFIT-UHFFFAOYSA-N 380.448 3.119 5 50 GGBA COC(=O)c1c(NC(=O)COc2ccc([N+](=O)[O-])cc2)sc2c1CCCC2 947099 NFZXIRLIJWGGRK-UHFFFAOYSA-N 390.417 3.339 5 50 GGBA CCn1ccc(C(=O)Nc2sccc2C(=O)Nc2ccc([N+](=O)[O-])cc2)n1 6490353 PPXPHLBNCBADNH-UHFFFAOYSA-N 385.405 3.377 5 50 GGBA CC1=C(C(=O)OCCOc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)CC(=O)N1 17080970 HVZCUZHCWGNISJ-SFHVURJKSA-N 396.399 3.095 5 50 GGBA Cn1c(CN2CCCC2)nc2cc(NC(=O)c3cccc([N+](=O)[O-])c3)ccc21 2214685 WIOKCFBVPJTPIT-UHFFFAOYSA-N 379.420 3.330 5 50 GGBA COc1cc([N+](=O)[O-])cc2cc(C(=O)N3c4ccccc4C[C@@H]3C)c(=O)oc12 4726965 VXXXAGYPIKLXKK-NSHDSACASA-N 380.356 3.301 5 50 GGBA CC(=O)c1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC2)c(F)c1 1205426 OSGHZSYTAFFZCF-UHFFFAOYSA-N 389.358 3.038 5 50 GGBA O=C1N/C(=C/c2ccc(Cl)c([N+](=O)[O-])c2)C(=O)N1Cc1ccccc1F 4699365 CGBIWCITJUWFQG-VGOFMYFVSA-N 375.743 3.480 5 50 GGBA O=C(Nc1cccc2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 133615653 FBZLRDPLOSHWND-UHFFFAOYSA-N 377.404 3.497 5 50 GGBA CC(C)c1noc([C@@]23CCC[C@@H]2CN(C(=O)c2ccc([N+](=O)[O-])s2)C3)n1 276361491 VWOOOKMJUSCBEB-PIGZYNQJSA-N 376.438 3.357 5 50 GGBA O=[N+]([O-])c1ccc(CN2CCC(N3CCN(c4ccccc4)CC3)CC2)cc1 1167464 MWKCEVSUTKOUEZ-UHFFFAOYSA-N 380.492 3.381 5 50 GGBA CNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(C(C)(C)C)cc1 4755538 CNZVCKLWBNGZTE-AQTBWJFISA-N 381.432 3.409 5 50 GGBA CC(C)C(=O)N1CCN(c2cc(N3CCCC[C@@H]3C)c(F)cc2[N+](=O)[O-])CC1 4983841 PWQVJYBPEORIEO-HNNXBMFYSA-N 392.475 3.417 5 50 GGBA O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CC[C@](CO)(c2ccccc2)C1 366025795 XYCCXSJJPLEOMM-VWLOTQADSA-N 398.462 3.458 5 50 GGBA O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCC[C@H]1c1nc(-c2cccc(C(F)(F)F)c2)c[nH]1 253394187 ALIIUGKTORWBID-SNPRPXQTSA-N 394.353 3.424 5 50 GGBA Cc1cc(C)cc(N2CC3=C(C2=O)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)c1 4753699 SVWUEMUPMITTEB-LJQANCHMSA-N 392.415 3.209 5 50 GGBA O=C(c1ccc(Br)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4846140 WCDSDQFIQNRKNV-UHFFFAOYSA-N 391.221 3.425 5 50 GGBA CC(C)NC(=O)c1cc2nc(-c3ccc([N+](=O)[O-])cc3)cc(C(F)(F)F)n2n1 845302 YYKWVTUOSNNMSQ-UHFFFAOYSA-N 393.325 3.462 5 50 GGBA CCCN(C[C@@H]1CCCCO1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 170622606 BFFHTSXKGZPBJU-KRWDZBQOSA-N 386.452 3.417 5 50 GGBA O=C(Nn1c(-c2ccccc2)nc2ccccc2c1=O)c1ccc([N+](=O)[O-])cc1 1179558 SZPUZMYOZQNDCW-UHFFFAOYSA-N 386.367 3.356 5 50 GGBA COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1Br 1122180 BXVOIWULLJLPDZ-UHFFFAOYSA-N 387.211 3.167 5 50 GGBA COc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 5120021 YSERJFJJPPXZJK-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 656864 WIZGXVKCBLXBIF-UHFFFAOYSA-N 382.220 3.468 5 50 GGBA CSc1ccccc1NC(=O)Cn1nc([N+](=O)[O-])c(Br)c1C 826481 WJMCQENDZDGXTG-UHFFFAOYSA-N 385.243 3.223 5 50 GGBA COc1cc(CN2CCN(c3cccc(Cl)c3)CC2)cc([N+](=O)[O-])c1O 1227246 SXDYHESDXSCPTO-UHFFFAOYSA-N 377.828 3.285 5 50 GGBA COc1ccc([C@@H]2CC(=O)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)cc1OC 4626524 XKGAVDGHYJWYLW-AWEZNQCLSA-N 395.371 3.443 5 50 GGBA Cc1c(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c(=O)n(-c2ccccc2)n1C 5930299 JJVIWDDRURYYII-UHFFFAOYSA-N 383.433 3.202 5 50 GGBA CCOC(=O)c1cc(N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1[N+](=O)[O-] 129275227 ZDSHFQGGQPPOLA-FZKQIMNGSA-N 392.358 3.362 5 50 GGBA Cc1c([N+](=O)[O-])ccc(F)c1NS(=O)(=O)c1ccc(C(F)(F)F)nc1 225708157 NXZPFMZRMDDCSB-UHFFFAOYSA-N 379.291 3.257 5 50 GGBA Cc1cccc2c1CCCN2C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 733946961 RLPMJNSAIYQUIQ-AWEZNQCLSA-N 397.406 3.375 5 50 GGBA CN(CC(=O)Nc1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2ccccc2c1 1114080 UUMWUFSLXHLXMG-UHFFFAOYSA-N 399.428 3.007 5 50 GGBA CCCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)/C=C/c1ccco1 2818206 VJUGWHPRAYWGJY-NQOIEDAHSA-N 383.404 3.275 5 50 GGBA CCCCNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccc(OC)cc1 2818308 KJQJOSAAYLNNRM-RGEXLXHISA-N 397.431 3.291 5 50 GGBA Cc1ccc(N([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1C 1070129 KJVYQIWEXFGULX-AWEZNQCLSA-N 391.449 3.005 5 50 GGBA Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCO[C@H](c2cccc(O)c2)C1 121601267 ZTNHUHXSJGJYGS-IBGZPJMESA-N 385.420 3.011 5 50 GGBA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F 374807605 LDCFUXRYVHLPFD-CABCVRRESA-N 399.426 3.116 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)Oc1ccc2c(C)cc(=O)oc2c1 4071432 UOMAIMHHMHSYCV-LBPRGKRZSA-N 398.371 3.424 5 50 GGBA O=[N+]([O-])c1ccc(CN2CCN(C3CCN(Cc4ccccc4)CC3)CC2)cc1 4725273 OTPXPROSMDUDEZ-UHFFFAOYSA-N 394.519 3.377 5 50 GGBA CNS(=O)(=O)c1ccc(N2CC3(CCC3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 432143233 LUZVVTJEYZEYKI-SFHVURJKSA-N 387.461 3.235 5 50 GGBA Cc1nn(CCc2nnc(S)n2-c2ccc(Cl)cc2)c(C)c1[N+](=O)[O-] 5424920 DJFWNHNQLKTOPU-UHFFFAOYSA-N 378.845 3.174 5 50 GGBA O=[N+]([O-])c1ccc2[nH]c(=Nc3ccc(O[C@@H]4CCCC[C@H]4O)cc3)cnc2c1 1875301712 QYMANINGFKOSRZ-RTBURBONSA-N 380.404 3.386 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 1172325 SRIVZSMJTMDZGU-UHFFFAOYSA-N 388.449 3.186 5 50 GGBA CN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccc([N+](=O)[O-])cc3)N2C1=S 754506 PGHRYKVFGYHOTR-SJLPKXTDSA-N 392.440 3.149 5 50 GGBA COC(=O)C(Cc1cccc(Cl)c1)(C(=O)OC)c1ccc([N+](=O)[O-])cc1 1396281 WCOGLSMUIOCGBF-UHFFFAOYSA-N 377.780 3.075 5 50 GGBA O=C(c1cccc(F)c1)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1 4310063 IBPMZXXEILXKSP-UHFFFAOYSA-N 384.411 3.271 5 50 GGBA Cc1nn(CC(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)c(C)c1[N+](=O)[O-] 5677838 NRNKFBDNKBUUCI-UHFFFAOYSA-N 398.467 3.169 5 50 GGBA COc1ccc(NC(=O)CSc2nccc(-c3ccco3)n2)c([N+](=O)[O-])c1 6642279 SVLZFFZPYQRBMG-UHFFFAOYSA-N 386.389 3.384 5 50 GGBA COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1cc([N+](=O)[O-])ccc1Cl 861525 KPLOFHGCRPXDTN-UHFFFAOYSA-N 394.811 3.171 5 50 GGBA C[C@H](Oc1ccccc1)C(=O)N[C@H](CC(=O)O)c1cc([N+](=O)[O-])ccc1Cl 4689769 WRLVSFAKBTZMRE-MEDUHNTESA-N 392.795 3.348 5 50 GGBA CC(=O)N(c1ccc(N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1)C1CC1 842146775 ACKOKJUMXOTORK-FQEVSTJZSA-N 394.431 3.328 5 50 GGBA O=C(NCc1c(F)c(F)c(F)c(F)c1F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 3199436 ODUGCUGFQISEBZ-UHFFFAOYSA-N 391.208 3.129 5 50 GGBA O=C(Nc1nc(-c2ccc(Br)cc2)cs1)c1n[nH]cc1[N+](=O)[O-] 6448381 LKJHWCGVWIQDNK-UHFFFAOYSA-N 394.210 3.456 5 50 GGBA CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 832263 CPWAPBKLBNUQJD-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA COc1cc(CNc2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])cc1OC 2894119 XMWWYUAQRBSZLF-UHFFFAOYSA-N 378.381 3.250 5 50 GGBA Cc1cc(-c2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2C)cs1 17079481 QPTGQZFKNFYLHP-UHFFFAOYSA-N 389.462 3.491 5 50 GGBA Cc1nc(CO[C@H]2CCN(c3ncc(Br)cc3[N+](=O)[O-])C2)cs1 225396861 ARPWXELPTXWBPX-LBPRGKRZSA-N 399.270 3.313 5 50 GGBA CC[C@H](Sc1nnnn1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 4698887 KOCRXGCDCFBLKZ-HNNXBMFYSA-N 384.421 3.080 5 50 GGBA Cc1ccccc1[C@@H]1C[C@H]1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 230216390 UXQXPSYNGVHNMF-QANKJYHBSA-N 397.406 3.068 5 50 GGBA CCCn1ccc2nc3ccn(Cc4ccc(OC)cc4)c(=O)c3cc2c1=O 40398785 OHPKUPLFFJSBDT-UHFFFAOYSA-N 375.428 3.178 5 50 GGBA CCCCOC(=O)c1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 5868312 ZOBHCJHRTQYLRD-UHFFFAOYSA-N 378.406 3.353 5 50 GGBA Cc1nc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1I 2857826 ZGHFHDCMQIEKAX-UHFFFAOYSA-N 383.145 3.155 5 50 GGBA Cc1ccc(S(=O)(=O)CCC(=O)OCc2ccc([N+](=O)[O-])cc2Cl)cc1 4831930 PFTQNMGUOWNFGB-UHFFFAOYSA-N 397.836 3.464 5 50 GGBA CC1=C(C(=O)Nc2ccc(F)c(F)c2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1 1105503 JQYWPOLOFSMKST-MRXNPFEDSA-N 388.330 3.140 5 50 GGBA NC(=O)c1ccccc1NC(=O)CCSc1ccc([N+](=O)[O-])cc1Cl 2845020 XXGNCYSFTYBDEF-UHFFFAOYSA-N 379.825 3.468 5 50 GGBA O=C(c1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1 4676986 WZJZODPVADBEAP-UHFFFAOYSA-N 398.438 3.297 5 50 GGBA CC(=O)c1cccc(NC(=O)[C@H](C)n2cc([N+](=O)[O-])c(-c3nccs3)n2)c1 225653946 ZWDHOOICVUEVBJ-JTQLQIEISA-N 385.405 3.317 5 50 GGBA O=C(Nc1ncn(Cc2ccc(F)cc2Cl)n1)c1ccc([N+](=O)[O-])cc1 2794622 PBHIUUCYJNSRBP-UHFFFAOYSA-N 375.747 3.279 5 50 GGBA Cc1ccc(N2CC3=C(C2=O)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N3C)cc1C 4753696 APJWNKOACKAGMG-LJQANCHMSA-N 392.415 3.209 5 50 GGBA Nc1nccc([C@H]2CCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)n1 225415833 LFGYHNQMSXNHPJ-AWEZNQCLSA-N 396.476 3.470 5 50 GGBA COc1ccccc1NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 1133883 CDHNMDJMKQATPX-UHFFFAOYSA-N 383.404 3.094 5 50 GGBA Cc1cc(C)nc(SCC(=O)Nc2nc3ccc([N+](=O)[O-])cc3s2)n1 2088833 JOMWNMKPICBFFL-UHFFFAOYSA-N 375.435 3.342 5 50 GGBA O=c1c2c3c(sc2ncn1C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCCCC3 134596790 PKKJDFSSYRKWIG-OAHLLOKOSA-N 385.445 3.369 5 50 GGBA O=C(Nc1ncn(Cc2c(F)cccc2Cl)n1)c1ccc([N+](=O)[O-])cc1 2795474 XFLJTSLAWBIIDL-UHFFFAOYSA-N 375.747 3.279 5 50 GGBA CC1(C)Cc2c(cnn2-c2ccccc2Cl)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 952895262 YOHKMXDWCRBRGI-CZUORRHYSA-N 388.855 3.102 5 50 GGBA O=C(CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(Cl)c1 2078018 CPWJKYKXLASIOZ-UHFFFAOYSA-N 390.779 3.393 5 50 GGBA O=[N+]([O-])c1ccccc1OCCN1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 286057613 CICRLJCAPQDGBL-NVXWUHKLSA-N 388.424 3.435 5 50 GGBA Cc1ccnc(NC(=O)c2ccn(COc3ccc([N+](=O)[O-])cc3Cl)n2)c1 2799444 LRYDQWURXSBAHI-UHFFFAOYSA-N 387.783 3.437 5 50 GGBA Cc1ccccc1[C@@H]1C[C@@H]1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 126462919 UXQXPSYNGVHNMF-SKDZVZGDSA-N 397.406 3.068 5 50 GGBA CN1C(=O)N[C@H](c2cccc([N+](=O)[O-])c2)C2=C1CN(c1ccc(Cl)cc1)C2=O 4753708 ZYQYLEORANNDMK-QGZVFWFLSA-N 398.806 3.245 5 50 GGBA CCOC(=O)CSc1nc2ccccc2n1C(=O)c1ccccc1[N+](=O)[O-] 1153373 JWHXLOCQZVHRBB-UHFFFAOYSA-N 385.401 3.288 5 50 GGBA Cc1cc(C)cc(N([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)c1 2871893 WSBXRICCCTZEAP-AWEZNQCLSA-N 391.449 3.005 5 50 GGBA COc1ccc(CC[N@@+]2([O-])CCO[C@@H](COc3cccc(C)c3)C2)cc1OC 261361531 NFODBQBZYLQKOM-NFBKMPQASA-N 387.476 3.347 5 50 GGBA CCc1cc(N[C@H](CO)CCN(CC)CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 225535864 OFSWBDQBBJUCTQ-KRWDZBQOSA-N 387.484 3.119 5 50 GGBA O=[N+]([O-])c1cccc(-c2cc(NS(=O)(=O)c3ccc4c(c3)CCC4)n[nH]2)c1 434959608 MUTBPLBKIZKRKS-UHFFFAOYSA-N 384.417 3.274 5 50 GGBA O=c1[nH]c(=O)c2ccc3c4ccc5c(=O)[nH]c(=O)c6ccc(c7ccc1c2c73)c4c65 640220 KJOLVZJFMDVPGB-UHFFFAOYSA-N 390.354 3.016 5 50 GGBA in-vitro CC(C)C(=O)N1CCN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 4998405 WLBSSVQREYDERU-UHFFFAOYSA-N 396.447 3.152 5 50 GGBA CC(=O)c1ccc(N2CCN(C(=S)Nc3cccc([N+](=O)[O-])c3)CC2)cc1 2858515 SBFFCWYTAYIJNU-UHFFFAOYSA-N 384.461 3.316 5 50 GGBA O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cc1C(=O)O 4691285 PSOFFMRHSHZDMS-UHFFFAOYSA-N 395.165 3.073 5 50 GGBA Cc1c(C(=O)NC(=S)Nc2cc(C(=O)O)ccc2Cl)cccc1[N+](=O)[O-] 2832629 NEIAGPOUJAFONI-UHFFFAOYSA-N 393.808 3.382 5 50 GGBA O=[N+]([O-])c1cnc(NCCCc2nc3cccnc3[nH]2)c(Br)c1 225814356 JFWAAJQFBUHWOC-UHFFFAOYSA-N 377.202 3.068 5 50 GGBA CN(C[C@@H]1OCCc2ccccc21)C(=O)c1cc2cc([N+](=O)[O-])ccc2n1C 2325862348 QRPWIPMGWJDBLE-FQEVSTJZSA-N 379.416 3.473 5 50 GGBA O=C(c1ccccc1Br)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 3878787 SEDSYALFAKACNY-UHFFFAOYSA-N 390.237 3.320 5 50 GGBA COc1ccc(C(=O)N2CCOC23CCN(c2ccc([N+](=O)[O-])cc2)CC3)cc1 4053290 UYXUAZQOHRVXMT-UHFFFAOYSA-N 397.431 3.073 5 50 GGBA COC(=O)N1CCC([C@H](C)NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 170600785 VARUQINDBFTCOM-QWHCGFSZSA-N 395.481 3.059 5 50 GGBA CCCN(c1cc(C(F)(F)F)n[nH]1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 170596542 GNCKCGBAUPOMGK-UHFFFAOYSA-N 392.359 3.250 5 50 GGBA COc1ccc(CC(=O)N(C)Cc2cccc(N3CCCC3)c2)cc1[N+](=O)[O-] 2325764317 ZFDJOLNDIYJEAQ-UHFFFAOYSA-N 383.448 3.405 5 50 GGBA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1C 4948076 BLFWGZWHUMFBKO-UHFFFAOYSA-N 391.449 3.186 5 50 GGBA COC(=O)N1CCC([C@H](C)NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 170600787 VARUQINDBFTCOM-STQMWFEESA-N 395.481 3.059 5 50 GGBA O=[N+]([O-])c1cccc(CN2CCN(C3CCN(Cc4ccccc4)CC3)CC2)c1 4724929 BPJHSQHKMGAWEN-UHFFFAOYSA-N 394.519 3.377 5 50 GGBA CCOC(=O)COn1c(-c2ccc(Cl)cc2)nc2ccc([N+](=O)[O-])cc21 1389369 RWVMZLHWQJUDQV-UHFFFAOYSA-N 375.768 3.257 5 50 GGBA COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 5102369 MYAYTARWZGJOEQ-INIZCTEOSA-N 387.417 3.129 5 50 GGBA COc1nc2ccc(NC(=O)c3cc(-c4ccccc4[N+](=O)[O-])on3)cc2[nH]1 2325873864 WXZSSAOTIVOPFR-UHFFFAOYSA-N 379.332 3.387 5 50 GGBA CC(C)C(=O)N1CCN(c2cc(N3CCCC[C@H]3C)c(F)cc2[N+](=O)[O-])CC1 4983835 PWQVJYBPEORIEO-OAHLLOKOSA-N 392.475 3.417 5 50 GGBA COc1ccc2c(C)cc3nnc(SCCn4ccc([N+](=O)[O-])n4)n3c2c1 178447613 WYWFRIYIFCAYFV-UHFFFAOYSA-N 384.421 3.097 5 50 GGBA CC1=C(C(=O)Nc2ccccc2F)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1 4990871 AXKQHTVOGQKGDU-INIZCTEOSA-N 386.408 3.165 5 50 GGBA CCOC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@H]1c1ccccc1[N+](=O)[O-] 2327178 IXEZYFFCJKWBRT-SFHVURJKSA-N 391.387 3.176 5 50 GGBA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1Br 229903335 YIFWIYGNJAJPNK-QYAIJTBZSA-N 377.194 3.059 5 50 GGBA COCCOC(=O)c1c(C)oc2ccc(OC(=O)c3ccc([N+](=O)[O-])o3)cc12 1797678 JDOYIWNAIMIGAJ-UHFFFAOYSA-N 389.316 3.265 5 50 GGBA CC(=O)Nc1ccc2nc(NC(=O)COc3ccc([N+](=O)[O-])cc3)sc2c1 2860694 ADMOOFLTOJEMOT-UHFFFAOYSA-N 386.389 3.180 5 50 GGBA O=[N+]([O-])c1ccccc1OCn1ccc(-c2nc3c4ccccc4ncn3n2)n1 2806899 RSJUIGZARPRUKG-UHFFFAOYSA-N 387.359 3.086 5 50 GGBA O=C(c1ccccc1S(=O)(=O)c1ccccc1[N+](=O)[O-])N1CCCCCC1 6700741 WTPBLDKAZHRWNI-UHFFFAOYSA-N 388.445 3.444 5 50 GGBA Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 22016065 ZAILWGBGUHETBX-PKOBYXMFSA-N 396.403 3.260 5 50 GGBA O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N1Cc2ccccc2CO1 240668077 HMFFJXASKUFRAI-UHFFFAOYSA-N 388.323 3.340 5 50 GGBA O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccccc2Cl)C1 4619272 IEJJJXLLIFPGOZ-JTQLQIEISA-N 377.759 3.379 5 50 GGBA Cc1cc(I)cnc1NC(=O)c1ccccc1[N+](=O)[O-] 1108945 VSSVMVUXPANOCP-UHFFFAOYSA-N 383.145 3.155 5 50 GGBA CC1=C(C(=O)OC(C)C)[C@H](c2cccc([N+](=O)[O-])c2)N2C(=O)CCSC2=N1 1135100 HCRGERBQVMFAQG-INIZCTEOSA-N 389.433 3.197 5 50 GGBA O=[N+]([O-])c1cc(-c2nc(-c3ccc4c(c3)OCO4)no2)n(Cc2ccccc2)n1 4772074 OYIAITLQBGQPSG-UHFFFAOYSA-N 391.343 3.285 5 50 GGBA CCOC(=O)c1c(NC(=O)c2c(C(=O)O)cccc2[N+](=O)[O-])sc(C)c1C 2942597 WAHYPLPWYWLDHR-UHFFFAOYSA-N 392.389 3.400 5 50 GGBA CCOCCOC(=O)c1ccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 1745335 LQZYRFCPFBFEMV-IZZDOVSWSA-N 384.388 3.440 5 50 GGBA COc1ccc(C(=O)N[C@@H](CC(=O)O)c2cc([N+](=O)[O-])ccc2Cl)cc1 4686708 JUZNACMQPINLJB-HNNXBMFYSA-N 378.768 3.203 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)c1 6270379 WXGCRRBGXZJQKX-UHFFFAOYSA-N 392.824 3.294 5 50 GGBA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 663190 ADBWMOBVEDWREJ-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA COc1cc(CN2CCN(Cc3ccc(C)cc3)CC2)c([N+](=O)[O-])cc1OC 865136 JZRHAPUVZGGWOG-UHFFFAOYSA-N 385.464 3.238 5 50 GGBA COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(Br)s1 1130901 IGCFULXWGLABSX-UHFFFAOYSA-N 393.240 3.228 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)C[C@@H]2CSc3nc4ccccc4n32)cc1 2853703 JXWKIQVKEOTOPH-LBPRGKRZSA-N 375.431 3.065 5 50 GGBA NS(=O)(=O)c1ccc(Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 2981293 ZLHKIDPSDUZIKD-UHFFFAOYSA-N 376.419 3.109 5 50 GGBA Cc1ccc(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)cc1 2835390 IWBBBFFDIUUOBA-UHFFFAOYSA-N 383.433 3.430 5 50 GGBA O=C(Cc1ccc(Cl)cc1)Nc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 4998334 HSAZRPSVHYYTAS-UHFFFAOYSA-N 375.812 3.266 5 50 GGBA O=c1[nH]c2ccc(S(=O)(=O)N3CCc4ccccc43)cc2c2ccccc12 6668126 XHQXQHSOCPPOCF-UHFFFAOYSA-N 376.437 3.433 5 50 GGBA COc1cccc([C@@H]2CC(=O)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)c1OC 4626331 POFLSIBPXFETFA-AWEZNQCLSA-N 395.371 3.443 5 50 GGBA Cc1cc(OC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)ccc1Cl 938604 DCCRJDJOUFVZCS-UHFFFAOYSA-N 388.763 3.148 5 50 GGBA O=[N+]([O-])c1ccc(N2CCC(F)(F)[C@@H](CO)C2)nc1OCc1ccccc1 461881961 JTSFGLBPDMJQGV-CQSZACIVSA-N 379.363 3.023 5 50 GGBA Cc1ccccc1NC(=O)CCC(=O)OCC(=O)c1ccc(C)c([N+](=O)[O-])c1 2985103 ICXJLEHKOMMWMK-UHFFFAOYSA-N 384.388 3.356 5 50 GGBA CNS(=O)(=O)c1ccc(N2C[C@@H](C)CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 253417654 DDRQXDDAECXLIS-YOEHRIQHSA-N 389.477 3.481 5 50 GGBA Cc1ccccc1Oc1cc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)cc([N+](=O)[O-])c1 226739818 KABZEXOEDWBXCZ-MKXGPGLRSA-N 394.383 3.362 5 50 GGBA O=C(CCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1Cl 2078021 CGICKIRTBKQXKY-UHFFFAOYSA-N 390.779 3.393 5 50 GGBA CN1C(=O)[C@@H]2Cc3c([nH]c4ccccc34)[C@@H](c3ccc([N+](=O)[O-])cc3)N2C1=S 754508 PGHRYKVFGYHOTR-FUHWJXTLSA-N 392.440 3.149 5 50 GGBA CC[C@@H]1CCc2c(sc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C(N)=O)C1 1112856 YANWEWQWLVZBBZ-LLVKDONJSA-N 387.461 3.451 5 50 GGBA O=C(O)c1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 2829354 RJHZTZRUZJUWOM-UHFFFAOYSA-N 379.781 3.073 5 50 GGBA O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1cccc([N+](=O)[O-])c1 1098136 MMGZUUOXWSJERU-UHFFFAOYSA-N 398.400 3.043 5 50 GGBA C[C@H](O)Cc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1-c1ccccc1 1124434 NNVBARCSKGYLDE-ZDUSSCGKSA-N 398.444 3.074 5 50 GGBA O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4599363 GIBYJDICCXOBJP-UHFFFAOYSA-N 390.783 3.119 5 50 GGBA C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 225384970 DURNGRGZAUNRDK-DYESRHJHSA-N 394.475 3.079 5 50 GGBA Cc1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)c([N+](=O)[O-])c1 4158985 FPTHAWWRKWQGQR-OAHLLOKOSA-N 386.385 3.026 5 50 GGBA CC(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3cccnc3)c2)CC1 4688323 FBUXEQPKBPTJBY-UHFFFAOYSA-N 397.479 3.297 5 50 GGBA CC(C)[C@@H](C)NC(=O)Nc1ccc([N+](=O)[O-])c(I)c1 241701794 QLDNPMCKXIRKQN-MRVPVSSYSA-N 377.182 3.365 5 50 GGBA O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H]1COc2ccccc2O1 4040795 FRYGYEHYFDYSOW-CQSZACIVSA-N 379.166 3.136 5 50 GGBA O=C(NC(NC(=O)c1ccccc1)c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 36026072 NAMHHWCHCNKPKX-UHFFFAOYSA-N 391.383 3.159 5 50 GGBA O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCCC2)c1 4005927 JFKDRXFHZZEYFP-UHFFFAOYSA-N 389.433 3.022 5 50 GGBA O=C(Nc1ccc(NS(=O)(=O)C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 170606053 JGGFFBKBDZTDBO-UHFFFAOYSA-N 389.311 3.109 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 1080972 GQJFYGMCBNLWTN-LJQANCHMSA-N 395.415 3.351 5 50 GGBA COc1ccc(Nc2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1Cl 4807987 MOYBYRFGLXJLRQ-UHFFFAOYSA-N 396.190 3.473 5 50 GGBA Cc1cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)c(F)cc1[N+](=O)[O-] 4455996 QUPBUYYTRSJVTC-UHFFFAOYSA-N 379.338 3.283 5 50 GGBA Cc1cc(N2CCN(c3ccccc3O)CC2)nc(-c2cccc([N+](=O)[O-])c2)n1 301063383 CQADPQRDBWXYJL-UHFFFAOYSA-N 391.431 3.392 5 50 GGBA COC(=O)C1=CN(C2CCCC2)C=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1 4618948 AMWLPHIWONTGTH-UHFFFAOYSA-N 386.404 3.050 5 50 GGBA Cc1ccc(C2=NN(C(=O)CCC(=O)O)[C@@H](c3cccc([N+](=O)[O-])c3)C2)cc1 669919 WCKYYERUSYLGRB-GOSISDBHSA-N 381.388 3.446 5 50 GGBA COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2-c1cccc(F)c1 2302200 KCFLOOGROBZVLU-UHFFFAOYSA-N 389.390 3.069 5 50 GGBA O=C(CCC(=O)Nc1cccc([N+](=O)[O-])c1)CC(=O)c1ccc([N+](=O)[O-])cc1 104162469 DZTZDSAVOPKWBV-UHFFFAOYSA-N 385.332 3.064 5 50 GGBA O=C(Nc1ccc2c(c1)OCCO2)c1cc([N+](=O)[O-])ccc1Br 1216718 CSEKSRUYOXVRHT-UHFFFAOYSA-N 379.166 3.381 5 50 GGBA CC[C@H](C)NC(=O)c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1ccccc12 11692074 MPXOXOGFYWITGD-LBPRGKRZSA-N 385.427 3.406 5 50 GGBA O=C(N[C@@H](NCc1ccco1)C(Cl)(Cl)Cl)c1cccc([N+](=O)[O-])c1 19913076 RXVHTGVQZIGDDV-CYBMUJFWSA-N 392.626 3.404 5 50 GGBA CC(C)(C)NC(=O)c1ccc(Cn2cc(Br)c([N+](=O)[O-])n2)cc1 2776266 OWOBBUZZWZHGCE-UHFFFAOYSA-N 381.230 3.130 5 50 GGBA CC(C)N(Cc1nc(-c2ccccc2)no1)C(=O)COc1ccc([N+](=O)[O-])cc1 1057016 HQQMDNMOGYJNPQ-UHFFFAOYSA-N 396.403 3.461 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2cccc(OC)c2)cc1[N+](=O)[O-] 1171160 IIFIRATWEVKRLC-UHFFFAOYSA-N 375.406 3.129 5 50 GGBA Cc1ccccc1Cn1cc(NC(=O)CCCn2nc([N+](=O)[O-])cc2C)cn1 2890870 PXNXVUHFIDFHRI-UHFFFAOYSA-N 382.424 3.072 5 50 GGBA O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccn(Cc3cccc(Cl)c3)n2)c1 6373289 FAGYBAXKJAILFP-UHFFFAOYSA-N 392.824 3.294 5 50 GGBA O=C(CCc1nc2ccccc2[nH]c1=O)OCc1ccc([N+](=O)[O-])cc1Cl 16426354 FCNZJLPZMMEKQR-UHFFFAOYSA-N 387.779 3.161 5 50 GGBA COc1ccc(C(=O)Nc2ccc(N3CCOCC3)c(Cl)c2)cc1[N+](=O)[O-] 1172644 XVXNRCSYFQRERA-UHFFFAOYSA-N 391.811 3.346 5 50 GGBA COc1cc(CN2CCN(c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1OC 55542913 VFMHFALAVNDLGD-UHFFFAOYSA-N 375.400 3.073 5 50 GGBA CN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)Cn1ccc2c([N+](=O)[O-])cccc21 409414773 ODSBWDUDWOIGJG-WMZOPIPTSA-N 384.480 3.272 5 50 GGBA CCn1ncc(Cl)c1C(=O)NC(=S)Nc1ccc(Cl)cc1[N+](=O)[O-] 5658819 SOUUDMBNZDVGGJ-UHFFFAOYSA-N 388.236 3.245 5 50 GGBA Cc1cc(Cl)ccc1OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4819591 OGOGRRFCUWUTOO-UHFFFAOYSA-N 389.839 3.284 5 50 GGBA NC(=O)c1ccccc1NC(=O)CCSc1c(Cl)cccc1[N+](=O)[O-] 1115872 PKYLPFBVJCCEAU-UHFFFAOYSA-N 379.825 3.468 5 50 GGBA COc1cccc([C@H]2C[C@H](c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 2914038 XJMGABAWHPNIEG-HZPDHXFCSA-N 381.392 3.350 5 50 GGBA Cc1ccccc1NC(=O)Cc1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)s1 2844460 QBTGCENAXFOKSK-UHFFFAOYSA-N 397.416 3.188 5 50 GGBA COc1ccc(CCN2C(=O)CS[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1OC 2940056 MVYHLVNPNPHADK-LJQANCHMSA-N 388.445 3.429 5 50 GGBA O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cccc(-c3cn4cccnc4n3)c2)cc1 4809249 AJTYIZPKXFHYDN-UHFFFAOYSA-N 395.400 3.105 5 50 GGBA O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCC[C@@H]1c1nc(-c2cccc(C(F)(F)F)c2)c[nH]1 225400991 ALIIUGKTORWBID-YUELXQCFSA-N 394.353 3.424 5 50 GGBA Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCCc3occc3C2)ccc1[N+](=O)[O-] 377507413 LBGSJJHTXINCJD-GOSISDBHSA-N 397.431 3.076 5 50 GGBA CC1=C(C(=O)Nc2ccc(C)cc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1 845677 JUQUKERQNHYTBJ-QGZVFWFLSA-N 382.445 3.335 5 50 GGBA Cc1ccc(OCC(=O)NC(=S)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 1186269 OOHZLJQLODPNET-UHFFFAOYSA-N 379.825 3.449 5 50 GGBA O=C(c1cccc([N+](=O)[O-])c1)N1N=C(c2ccccc2)C[C@]1(O)C(F)(F)F 1211762 WBDVRMIMBIHEOF-INIZCTEOSA-N 379.294 3.096 5 50 GGBA COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1I 5094720 PSFFSLKWBOMZKQ-UHFFFAOYSA-N 398.156 3.460 5 50 GGBA O=C(COc1cccc2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4562041 CTUDHHAGQYUTKW-UHFFFAOYSA-N 391.427 3.476 5 50 GGBA COC(=O)c1ccc(NC2CCN(C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1 74938152 XDYIBHFDBOISDH-UHFFFAOYSA-N 379.413 3.193 5 50 GGBA CCCN(C(=O)c1cccc([N+](=O)[O-])c1)c1c(C)n(C)n(-c2ccccc2)c1=O 1186501 YRDQLAJXDMEOED-UHFFFAOYSA-N 394.431 3.449 5 50 GGBA CCOC(=O)c1sc(NC(=O)c2ccccc2[N+](=O)[O-])c(C(=O)OC)c1C 2872900 HMUYDYOYWZSUBO-UHFFFAOYSA-N 392.389 3.180 5 50 GGBA COc1ccccc1C(=O)N1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 4998625 UCCADQDFFBLMGB-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA O=C(Nc1cc(OCC(F)(F)F)cc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C(=O)O 2763728 IHKSVVIOCCZBMR-QWHCGFSZSA-N 390.314 3.365 5 50 GGBA O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1 4687456 YKZAGSKOYDGSCY-UHFFFAOYSA-N 390.248 3.292 5 50 GGBA O=[N+]([O-])c1ccc2nc(N3CCN(Cc4ccc5c(c4)OCO5)CC3)sc2c1 20458838 DHSJKZXBHLJVGY-UHFFFAOYSA-N 398.444 3.255 5 50 GGBA C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 4459730 KYMRJMSQJYMUHH-AWEZNQCLSA-N 389.839 3.364 5 50 GGBA COC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)c1cccc2ccccc12 29222893 VMFGCGRAIBLAFY-IBGZPJMESA-N 378.384 3.262 5 50 GGBA in-vitro O=C(N=c1[nH]ccc2cc([N+](=O)[O-])ccc12)[C@@H](c1ccccc1)N1CCCC1 2325827774 QDOAECNXTSBIGT-LJQANCHMSA-N 376.416 3.341 5 50 GGBA O=C(Nc1ccccc1C(=O)NCc1cccnc1)c1cccc([N+](=O)[O-])c1 1127692 RVARNMCUXSEPPQ-UHFFFAOYSA-N 376.372 3.172 5 50 GGBA CCN(C(=O)c1ccc([N+](=O)[O-])cc1)c1c(C)n(C)n(-c2ccccc2)c1=O 1186451 AWMLKWMDUVAIHI-UHFFFAOYSA-N 380.404 3.059 5 50 GGBA O=[N+]([O-])c1ccccc1/C=C/CN1CCN(Cc2ccc3c(c2)OCO3)CC1 4987610 VQLQAWVTLLYPRG-HWKANZROSA-N 381.432 3.155 5 50 GGBA Cc1ccc(OC(C)(C)C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 6613732 JMTIIDYYCITNHI-UHFFFAOYSA-N 383.448 3.409 5 50 GGBA CC1=C(C(=O)OC2CCC(C)CC2)[C@@H](c2ccc(O)c([N+](=O)[O-])c2)NC(=O)N1 36075039 VRTDRDILIDKTKG-MOIAVMEXSA-N 389.408 3.050 5 50 GGBA CCOCCCn1c(-c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)n[nH]c1=S 8477673 FUVSZZDVVDIRRJ-UHFFFAOYSA-N 388.453 3.187 5 50 GGBA COc1ccc([C@H]2SCCN2S(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 705274 OJXKSEJUSGPALG-QGZVFWFLSA-N 394.474 3.348 5 50 GGBA in-vitro CCC(=O)N1CCN(c2cc(N3CCCCCC3)c(F)cc2[N+](=O)[O-])CC1 4163980 XKULUZRVUPFECN-UHFFFAOYSA-N 378.448 3.173 5 50 GGBA CC1(C)CC(=O)c2sc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)nc2C1 2488245 UAZUBTWDGSCKBX-UHFFFAOYSA-N 381.435 3.007 5 50 GGBA CCCOc1ccc(N2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1 2812321 PHKKBYHOGXJWFI-AWEZNQCLSA-N 383.404 3.375 5 50 GGBA Cc1ccc(Oc2cc(NC(=O)Cn3cc([N+](=O)[O-])cn3)cc([N+](=O)[O-])c2)cc1 2112615 RSRPWXDXBKOVQM-UHFFFAOYSA-N 397.347 3.439 5 50 GGBA CCCC(=O)N1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 4120579 YAPMDFABZNGLJV-UHFFFAOYSA-N 396.447 3.296 5 50 GGBA Cc1nn(C)c(NN2C(=O)c3cccc4c(Cl)ccc(c34)C2=O)c1[N+](=O)[O-] 4837518 ANUITJULPBPBHL-UHFFFAOYSA-N 385.767 3.066 5 50 GGBA Cc1noc([C@H](Nc2ccc(S(=O)(=O)C(F)F)cc2[N+](=O)[O-])C(C)C)n1 129046468 KYIBGKYWJXQZSK-GFCCVEGCSA-N 390.368 3.092 5 50 GGBA C[C@H](SCc1nc2ccccc2c2nc(=O)c(-c3ccccc3)nn12)C(=O)O 253429165 CBIORLVEYBBPPD-LBPRGKRZSA-N 392.440 3.011 5 50 GGBA Cn1c(CC(=O)Nc2ccccc2)nnc1SCc1ccc([N+](=O)[O-])cc1 1074973 XXMGHZNLMLPYMW-UHFFFAOYSA-N 383.433 3.197 5 50 GGBA Cc1ccc2c(c1)CCCN2C(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 913125597 UCQIVCPZMPTZRO-HNNXBMFYSA-N 397.406 3.375 5 50 GGBA CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)n1 4652216 WEWGGNKGXXXULQ-UHFFFAOYSA-N 384.440 3.185 5 50 GGBA COc1cccc(-c2nnc(SCC(=O)Nc3cccc([N+](=O)[O-])c3)n2C)c1 1108220 MTQZOKCZMSPWPX-UHFFFAOYSA-N 399.432 3.130 5 50 GGBA Cc1cccc(CSCCNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 4803562 ZWRDHBOAOFIEMR-UHFFFAOYSA-N 380.491 3.423 5 50 GGBA CN(C(=O)OC(C)(C)C)[C@@H](CNc1ncc([N+](=O)[O-])cn1)Cc1ccccc1 871073843 YUNQVPNFHIIXPQ-OAHLLOKOSA-N 387.440 3.275 5 50 GGBA O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc2nn(-c3ccccc3)nc2c1 1205650 ZEJXFOOABBXNRQ-UHFFFAOYSA-N 389.371 3.346 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2ccc(Cl)cn2)cc1[N+](=O)[O-] 1173729 XQGVCQHEBIOIDG-UHFFFAOYSA-N 380.813 3.169 5 50 GGBA O=C(NC12CC3CC(CC(C3)C1)C2)c1cc([N+](=O)[O-])ccc1N1CCOCC1 4852339 FCMYTJOHMDVUCN-UHFFFAOYSA-N 385.464 3.130 5 50 GGBA O=[N+]([O-])c1c([N+](=O)[O-])c(Br)c2nsnc2c1Br 34925670 XEVOZPRNEPMHAF-UHFFFAOYSA-N 383.965 3.033 5 50 GGBA COCN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)ccc21 170603883 JHJUGZWKHYRECI-UHFFFAOYSA-N 389.795 3.384 5 50 GGBA COc1cc(C(=O)c2nccc3cc(OC)c(OC)cc23)c([N+](=O)[O-])cc1OC 1067509 YQHPOSDABMOWAK-UHFFFAOYSA-N 398.371 3.408 5 50 GGBA biogenic,in-vitro COC(=O)c1cc(C(=O)Nc2nnc(CC(C)(C)C)s2)cc([N+](=O)[O-])c1 2821368 CJEMVAAEQWZJFG-UHFFFAOYSA-N 378.410 3.074 5 50 GGBA O=C(N[C@H]1CCCC[C@@H]1C(F)(F)F)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc12 117235156 WLQCCVLDICUAER-JSGCOSHPSA-N 383.326 3.287 5 50 GGBA C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])CCN1S(=O)(=O)c1ccccc1 4188660 GYZCCWZXUKPMBU-CYBMUJFWSA-N 395.868 3.148 5 50 GGBA Cc1ccc(-c2noc(CN3CCN(c4ccc([N+](=O)[O-])cc4)CC3)n2)cc1 55554991 HVUXSMKXWLUNAP-UHFFFAOYSA-N 379.420 3.275 5 50 GGBA O=C(N[C@H]1CNc2ccccc2C1)c1cc(F)cc([N+](=O)[O-])c1Br 2325862151 KTIVSUAOHDPSOF-LLVKDONJSA-N 394.200 3.263 5 50 GGBA Cc1ccc(NC(=O)CSc2nnc(-c3cccs3)n2C)cc1[N+](=O)[O-] 2863207 GMWVOYQUKYWYGM-UHFFFAOYSA-N 389.462 3.491 5 50 GGBA CCc1cccc(C)c1NC(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 850460 TZSVLVXGLNDILQ-UHFFFAOYSA-N 381.388 3.090 5 50 GGBA CC(C)c1ccc(N(CC(=O)Nc2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 1126080 FHERWLOAISNPBU-UHFFFAOYSA-N 391.449 3.123 5 50 GGBA COc1ccc(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2Cl)cc1OC 2982023 HAAISAIGCVOVPO-UHFFFAOYSA-N 395.824 3.392 5 50 GGBA COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2c3c(C)cc(C)nc3nn12 13645207 CPTJQZVEWLAPMJ-UHFFFAOYSA-N 377.360 3.256 5 50 GGBA CCCCNC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccc([N+](=O)[O-])cc1 5309181 PDGVIYNMJASFLN-QGOAFFKASA-N 385.395 3.421 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)CC(=O)N1 1213546 WYTPICAPFFEGOR-GOSISDBHSA-N 380.400 3.258 5 50 GGBA O=C(c1ccccc1O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 4406169 FFUOOCPVRYQXNL-UHFFFAOYSA-N 395.337 3.282 5 50 GGBA O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 4414439 GNVNZADYUQNMQX-UHFFFAOYSA-N 390.248 3.292 5 50 GGBA CC(C)(C)C(=O)Nc1cccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 1127103 OOVFTGHDCZSYJK-UHFFFAOYSA-N 377.422 3.380 5 50 GGBA O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1ccc(CN2CCOC2=O)cc1 253426466 IMDFUCHIAIHDIS-UHFFFAOYSA-N 391.330 3.006 5 50 GGBA CC1=C(C(=O)OCCc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])NC(=O)N1C 1080973 GQJFYGMCBNLWTN-IBGZPJMESA-N 395.415 3.351 5 50 GGBA COc1cc(Cl)c(C)cc1Nc1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-] 4825892 GTLQMLVIYHFRAC-UHFFFAOYSA-N 375.772 3.128 5 50 GGBA CCOC(=O)c1cc(N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)ccc1[N+](=O)[O-] 129275435 ZDSHFQGGQPPOLA-SCLBCKFNSA-N 392.358 3.362 5 50 GGBA O=C(NC(=S)Nc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 1172792 WZEASKDVLDEFCW-UHFFFAOYSA-N 380.223 3.484 5 50 GGBA CN1c2cc(Br)ccc2N(Cc2c([N+](=O)[O-])ncn2C)CC1(C)C 253430562 MRYZLYNKQLIUGN-UHFFFAOYSA-N 394.273 3.326 5 50 GGBA O=c1cc[nH]c2cc(CNc3ncc([N+](=O)[O-])cc3Br)ccc12 225386697 DNXGNEXGMSIPMI-UHFFFAOYSA-N 375.182 3.206 5 50 GGBA Cc1cccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])c(NC4CC4)c3)CC2)c1 4409208 PCEZSUQBLYNCFJ-UHFFFAOYSA-N 380.448 3.440 5 50 GGBA CCOc1ccc(C(=O)NC(=S)Nc2cccc(C(C)=O)c2)cc1[N+](=O)[O-] 1174273 LQTINJSAPGURID-UHFFFAOYSA-N 387.417 3.323 5 50 GGBA CC(C)(C)N[S@@](=NS(=O)(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 4530221 ZENNPEGQGWGSNA-XMMPIXPASA-N 381.479 3.448 5 50 GGBA COc1cccc(CCNC(=O)c2c[nH]cc2-c2ccc([N+](=O)[O-])cc2)c1O 1875262479 ZGNVWNXUNUMEFR-UHFFFAOYSA-N 381.388 3.277 5 50 GGBA CCOC(=O)c1ccc(NC(=S)NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 1182521 VTDZTUYDZLLHEQ-IZZDOVSWSA-N 399.428 3.298 5 50 GGBA CCNc1ccc(S(=O)(=O)C(F)(F)[C@H](F)C(F)(F)F)cc1[N+](=O)[O-] 5101860 AXOOGHCZRZPZLW-SECBINFHSA-N 380.266 3.294 5 50 GGBA CCCCn1c(=O)c(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c(O)c2ccccc21 2285841 UZFUXOGVJIDRSJ-UHFFFAOYSA-N 397.387 3.373 5 50 GGBA Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)N1CCCc2ccccc21 2884315 LLKGMVMTRNLTOL-NSHDSACASA-N 393.241 3.403 5 50 GGBA O=C(c1ccccc1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCOCC1 2952358 BIWZKNGBTFIPQG-UHFFFAOYSA-N 389.389 3.127 5 50 GGBA Cc1ccc(OCCOc2ccc([N+](=O)[O-])cc2/C=C2\SC(=N)NC2=O)cc1 15800289 LRUISANKWIUQTC-BOPFTXTBSA-N 399.428 3.500 5 50 GGBA O=C(c1cc(Br)cs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 6615297 YDQJREULIZEVRA-UHFFFAOYSA-N 396.266 3.381 5 50 GGBA CCn1c(COc2ccc(Cl)cc2)nnc1SCn1cc([N+](=O)[O-])cn1 17080722 ZWOTZVPPYBBFRZ-UHFFFAOYSA-N 394.844 3.385 5 50 GGBA COc1ccc(CCN(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC 19607251 CYAOQMNQLJSHQA-UHFFFAOYSA-N 390.436 3.304 5 50 GGBA O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1NCc1ccccc1 4058898 RXRFNQUMBBPQQL-UHFFFAOYSA-N 375.450 3.382 5 50 GGBA CC(C)C(=O)N1CCN(c2ccccc2NC(=O)c2ccccc2[N+](=O)[O-])CC1 4739345 ZTIKFZIPYRTLHD-UHFFFAOYSA-N 396.447 3.152 5 50 GGBA COc1cc(C(=O)NC[C@@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC(F)F 225481330 KSWAPXXCWVXGNN-MRVPVSSYSA-N 380.294 3.370 5 50 GGBA CC(C)c1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 5944998 FYEPARNFLRMEDM-UHFFFAOYSA-N 389.477 3.229 5 50 GGBA Cc1cc([N+](=O)[O-])nn1Cc1ccc(-c2nc3c4ccccc4ncn3n2)cc1 2805427 LYQIHCQZWHGTTR-UHFFFAOYSA-N 385.387 3.406 5 50 GGBA O=C(CN1CCN(C23CC4CC(CC(C4)C2)C3)CC1)Nc1cccc([N+](=O)[O-])c1 17081540 WEFPPEWLURLOSB-UHFFFAOYSA-N 398.507 3.120 5 50 GGBA CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3C)C2)ccn1 856643675 UCZPWUJNOVILML-GOSISDBHSA-N 398.463 3.043 5 50 GGBA COc1ccccc1-n1ccc2nc3ccn(Cc4ccco4)c(=O)c3cc2c1=O 32101395 ZWXZNPAKHANLNL-UHFFFAOYSA-N 399.406 3.351 5 50 GGBA O=C(O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(Br)cc1 5061686 RYXDAONIUBVZAG-NTEUORMPSA-N 391.177 3.213 5 50 GGBA COc1ccc(/C=C(\NC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)NC(C)(C)C)cc1 2824910 ZHGFDHIFRZURAJ-AQTBWJFISA-N 397.431 3.289 5 50 GGBA COc1cccc([C@@H]2C[C@H](c3cccc([N+](=O)[O-])c3)Nc3ncnn32)c1OC 2914040 XJMGABAWHPNIEG-CVEARBPZSA-N 381.392 3.350 5 50 GGBA COc1ccccc1N1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 994466 GIFJIUKSOOVLIZ-UHFFFAOYSA-N 375.812 3.219 5 50 GGBA CC(C)c1ccc(C(=O)N(C)Cc2ccc(OCC(=O)O)cc2)cc1[N+](=O)[O-] 263509035 BWFGXXFRNPRQOG-UHFFFAOYSA-N 386.404 3.454 5 50 GGBA O=C(Nc1ncc(Cc2cccc([N+](=O)[O-])c2)s1)[C@@H]1COc2ccccc2O1 5016775 IVMZINMYKORYAH-KRWDZBQOSA-N 397.412 3.421 5 50 GGBA CCCCNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1OC 2818174 AVNJITPNGDUDRE-JXAWBTAJSA-N 397.431 3.291 5 50 GGBA Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 248097169 YLRZWWHPSAQKQT-SJLPKXTDSA-N 396.403 3.260 5 50 GGBA Cc1ccc(C2=NN(C(=O)CCC(=O)O)[C@H](c3cccc([N+](=O)[O-])c3)C2)cc1 3864944 WCKYYERUSYLGRB-SFHVURJKSA-N 381.388 3.446 5 50 GGBA CC1(c2c(F)c(F)c([N+](=O)[O-])c(F)c2F)C(=O)OC2(CCCCC2)OC1=O 526058674 SZFIPJYAZVRMFV-UHFFFAOYSA-N 391.273 3.169 5 50 GGBA COc1cc(CN2CCN(Cc3cccc(C)c3)CC2)c([N+](=O)[O-])cc1OC 865174 NUMJNKJLWDOYJD-UHFFFAOYSA-N 385.464 3.238 5 50 GGBA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 4578606 NEARBDRQBFDZSR-UHFFFAOYSA-N 392.751 3.074 5 50 GGBA C[C@H](NC(=O)c1cc([N+](=O)[O-])c(O)cc1N)c1ccccc1Br 170597743 MOFZSGGGVLSHAP-QMMMGPOBSA-N 380.198 3.136 5 50 GGBA COc1ccc(OC)c(-c2nc(NC(C)=O)c3c(=O)oc4ccccc4c3n2)c1 904606 NOAIPOSXCQYHBJ-UHFFFAOYSA-N 391.383 3.379 5 50 GGBA COc1cc(/C=C/C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc(OC)c1OC 2993224 AZTZLEXSJQBTAI-QPJJXVBHSA-N 376.340 3.412 5 50 GGBA O=C(O)c1ccc(Cl)c(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c1 2829124 UZHBSGQZSSBTLR-UHFFFAOYSA-N 379.781 3.073 5 50 GGBA O=C(Oc1ccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1)c1cccc([N+](=O)[O-])c1 17976107 FOKCWSHBXXVJLD-ROUUACIJSA-N 394.383 3.494 5 50 GGBA Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCOC2(CCCCC2)C1 134664095 DLPRDGHFNCYQOO-OAHLLOKOSA-N 382.482 3.372 5 50 GGBA CC(C)(C)c1ccc(OCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 2989635 WRBQZQPNJGODDE-UHFFFAOYSA-N 378.450 3.250 5 50 GGBA Cc1ccc(C(=O)O)cc1NC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 2828520 IRTWRGMPOGJWEP-UHFFFAOYSA-N 393.808 3.382 5 50 GGBA CC1=C(C(=O)Nc2ccc(F)c(F)c2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1 4647400 UTTYSEQVGDIPIS-MRXNPFEDSA-N 388.330 3.140 5 50 GGBA C[C@H](c1cccc(F)c1)N1CCN(c2cc3ncnc(O)c3cc2[N+](=O)[O-])CC1 302770058 BRZJGFUGNPKAHS-CYBMUJFWSA-N 397.410 3.266 5 50 GGBA