smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(NCc1cn[nH]c1)c1cc([N+](=O)[O-])c[nH]c1=O 37986770 WGFCPJHYEGLARO-UHFFFAOYSA-N 263.213 -0.064 5 10 CBBE NC(=O)c1ccc(Cn2cc(CO)nn2)c([N+](=O)[O-])c1 52222753 RFNWMTYNKHTIIA-UHFFFAOYSA-N 277.240 -0.174 5 10 CBBE CNC(=O)CN(C)c1ncnc(NC)c1[N+](=O)[O-] 96466052 YBIRIRWQFGSOLJ-UHFFFAOYSA-N 254.250 -0.391 5 10 CBBE COCCOCCOc1ncnc(NN)c1[N+](=O)[O-] 127796936 XHMFJZBXTVGNOU-UHFFFAOYSA-N 273.249 -0.288 5 10 CBBE C[C@H](O)CNCCNc1ncc([N+](=O)[O-])cc1C(N)=O 132358399 ADOGTQKFJMCKGE-ZETCQYMHSA-N 283.288 -0.529 5 10 CBBE NC(=O)COCCNC(=O)c1ccc(F)c([N+](=O)[O-])c1 230048267 CXEDDGQDVOBQRQ-UHFFFAOYSA-N 285.231 -0.034 5 10 CBBE NNc1ncnc(N(CCO)CC(F)F)c1[N+](=O)[O-] 231621195 RUTQCBYTJRZLIL-UHFFFAOYSA-N 278.219 -0.266 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1NC(CO)(CO)CO 234206870 AWVWXWZCWNQQRS-UHFFFAOYSA-N 274.277 -0.753 5 10 CBBE Nc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@H]1COC[C@@H]1O 323205291 LUURPXMIYOETQK-XPUUQOCRSA-N 285.231 -0.194 5 10 CBBE O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1[C@H]2COC[C@H]21 597409199 BPSMHPVDQUNYPU-MYJAWHEDSA-N 266.257 -0.200 5 10 CBBE CN1CCOC[C@H]1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 600420081 IKWYGWYZOAGVFF-SSDOTTSWSA-N 269.261 -0.622 5 10 CBBE CN1CCOC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1O 600839335 SNRDTKIWKMXHRO-SECBINFHSA-N 296.283 -0.244 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N(CCO)CC2CC2)n1 690926703 JMFNJCIKHXXVKG-UHFFFAOYSA-N 268.277 -0.121 5 10 CBBE NC(=O)C(Nc1cc(C(=O)O)ccc1[N+](=O)[O-])C(N)=O 695279473 UEEBIUKEUPTFAQ-UHFFFAOYSA-N 282.212 -0.956 5 10 CBBE CC[C@@H](Nc1nc(NN)ncc1[N+](=O)[O-])C(=O)NC 697345858 WOWVAFHWOGOJTF-RXMQYKEDSA-N 269.265 -0.393 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H]2CCOC[C@H]2O)n1 707030919 SHVHKGYEPVUBDH-HTRCEHHLSA-N 269.261 -0.163 5 10 CBBE Cn1ccc(NC(=O)CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 834533674 NNBGAQIZMMWWBU-RNFRBKRXSA-N 267.245 -0.860 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCNC2=O)n1 1131650260 NTOQBHRSIBRJSY-QMMMGPOBSA-N 264.241 -0.083 5 10 CBBE COc1ncnc(NC[C@@]23CN[C@@H](CO2)C3)c1[N+](=O)[O-] 1155541809 QKRAHRCJVMHNPS-RDDDGLTNSA-N 281.272 -0.064 5 10 CBBE CN(CCNS(C)(=O)=O)c1ccncc1[N+](=O)[O-] 1261126209 HEXRWUOGIWQZCL-UHFFFAOYSA-N 274.302 -0.025 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)C[C@@H](C)O 1294474996 CKCIBRSKFFADFA-SSDOTTSWSA-N 256.262 -0.061 5 10 CBBE Nc1ccn(C[C@@H]2COCCO2)c(=O)c1[N+](=O)[O-] 1307369879 KRRNYCBMBLSRNQ-SSDOTTSWSA-N 255.230 -0.246 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCC2)n1 1320000452 FGRLEVJTLSKXKX-UHFFFAOYSA-N 268.229 -0.283 5 10 CBBE CN(CCOCCO)C(=O)c1nn(C)cc1[N+](=O)[O-] 1321256817 SVBVBYACIHKNHO-UHFFFAOYSA-N 272.261 -0.591 5 10 CBBE C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1C 1465102573 JZSXFHHEOWKLDC-QMMMGPOBSA-N 268.277 -0.651 5 10 CBBE CN1[C@H]2CC[C@H]1CC(NC(=O)Cn1cnc([N+](=O)[O-])n1)C2 1521762063 PTZPDSOLIPPDBI-UWVGGRQHSA-N 294.315 -0.072 5 10 CBBE Cn1nccc1CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1565502398 QUKPQCXGBQPDCA-VXGBXAGGSA-N 293.327 -0.271 5 10 CBBE NC(=O)CC1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1568013478 ILIOOJMCHSQTNQ-UHFFFAOYSA-N 253.218 -0.735 5 10 CBBE Nc1ccc(C(=O)NC[C@@H](O)CO)cc1[N+](=O)[O-] 1602994358 ATDAUBJLQPEZFB-SSDOTTSWSA-N 255.230 -0.740 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NCC1CC2(C1)OCCO2 1611396141 XGSJGXSATVPZQA-UHFFFAOYSA-N 297.271 -0.544 5 10 CBBE C[C@@H](C(=O)N1CCN=C1C[N+](=O)[O-])n1cccn1 1852550032 WITIZJUPFLCYKF-QMMMGPOBSA-N 251.246 -0.039 5 10 CBBE Cn1c(C(=O)NCC2(C)OCCO2)cnc1[N+](=O)[O-] 1852889828 JXBBKCJZGGMYQB-UHFFFAOYSA-N 270.245 -0.179 5 10 CBBE O=C(O)[C@@]1(n2cnc([N+](=O)[O-])n2)CCCS(=O)(=O)C1 1912236318 NMRUGSMYBQXSCE-MRVPVSSYSA-N 290.257 -0.825 5 10 CBBE Cc1nc([N+](=O)[O-])c(N(CCO)C2COC2)n1C 1915690808 XPCPYZGPSWYJKT-UHFFFAOYSA-N 256.262 -0.166 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H](O)CO1 1917246936 IEXIVOALBLGXBP-SSDOTTSWSA-N 253.214 -0.194 5 10 CBBE NOCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 1942359444 RTEXNUHSXOOUHL-UHFFFAOYSA-N 261.259 -0.237 5 10 CBBE N=c1cc(S(=O)(=O)N2CC([N+](=O)[O-])C2)cc[nH]1 2016887274 GGRVCHUKTBDWOB-UHFFFAOYSA-N 258.259 -0.856 5 10 CBBE NC[C@H]1COC[C@H]1N=c1ccc([N+](=O)[O-])c(N)[nH]1 2036605079 KPYPFOCAAQPSHN-NKWVEPMBSA-N 253.262 -0.621 5 10 CBBE C[C@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CN1 2037664687 KRWSDZKZMYANQW-YUMQZZPRSA-N 253.262 -0.342 5 10 CBBE CNC1CN(c2ncc([N+](=O)[O-])c(N(C)C)n2)C1 2039923163 PWKOLZGSXJVFFZ-UHFFFAOYSA-N 252.278 -0.141 5 10 CBBE CN(C)C[C@@H]1CCN1c1nc(=N)[nH]cc1[N+](=O)[O-] 2042722603 CAWQYAQTSQNPTG-ZETCQYMHSA-N 252.278 -0.062 5 10 CBBE Nc1cc(=NC[C@H]2COC[C@@H]2O)[nH]cc1[N+](=O)[O-] 2047198435 KAXPRZWHEFJCQH-RCOVLWMOSA-N 254.246 -0.587 5 10 CBBE CON(c1nc(=N)[nH]c(C)c1[N+](=O)[O-])C1CNC1 2053460615 IOFSUOFKZCVUKA-UHFFFAOYSA-N 254.250 -0.555 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N[C@@H]2COC[C@@H]2CN)[nH]1 2053717584 MNFCVUXRJXYFJQ-POYBYMJQSA-N 253.262 -0.212 5 10 CBBE N=c1[nH]c(N2C[C@H]3C[C@H](O)[C@H]2C3)ncc1[N+](=O)[O-] 2057024538 DYAWVKFLTJFBAB-JKMUOGBPSA-N 251.246 -0.243 5 10 CBBE NC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 2062351412 QVQXZMFWJMOPFC-ZETCQYMHSA-N 255.230 -0.650 5 10 CBBE CN[C@@H]1COC[C@H]1Oc1ccc(N)c([N+](=O)[O-])n1 2065003666 FGGGYSQPEVQBDP-HTQZYQBOSA-N 254.246 -0.062 5 10 CBBE NC1CN(S(=O)(=O)Nc2ccc([N+](=O)[O-])cn2)C1 2082428782 HSAHUIKKLICAKC-UHFFFAOYSA-N 273.274 -0.711 5 10 CBBE CS[C@@H]1CNC[C@@H]1Nc1ncc([N+](=O)[O-])c(=N)[nH]1 2084780868 WDASILARMRELOB-CAHLUQPWSA-N 270.318 -0.087 5 10 CBBE NC(=O)[C@@H]1CCN1c1cnc([N+](=O)[O-])cc1C(=O)O 2089357586 AROOPDHFZMBKFL-LURJTMIESA-N 266.213 -0.248 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)N1CC[C@H]1CO 2092548906 QHNSPVLEJSPHQY-LURJTMIESA-N 267.245 -0.518 5 10 CBBE CCN=c1nc(N2C[C@@](C)(O)CO2)c([N+](=O)[O-])c[nH]1 2093401003 HSHTURFHRHFHFX-SNVBAGLBSA-N 269.261 -0.259 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CCn2nccc2C1 2108918452 NKAPNRLNZSVFGH-ZETCQYMHSA-N 263.261 -0.231 5 10 CBBE C[C@]1(CO)COCCN1c1ncc([N+](=O)[O-])c(=N)[nH]1 2112758014 UPIDPQMHRYTWIN-JTQLQIEISA-N 269.261 -0.615 5 10 CBBE CCS(=O)(=O)C[C@@H](C)N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2114177347 OCLOGBJKEKFFQC-ZCFIWIBFSA-N 289.317 -0.546 5 10 CBBE COCCN(c1ncnc(N)c1[N+](=O)[O-])C1CNC1 2117211682 SRKMJOPCIJVARA-UHFFFAOYSA-N 268.277 -0.608 5 10 CBBE NC(=O)[C@]1(Oc2nccc(N)c2[N+](=O)[O-])CCNC1 2128255163 HIDQLKDICLMGSR-JTQLQIEISA-N 267.245 -0.832 5 10 CBBE CN(C[C@H]1CCN1C)c1nc(NN)ncc1[N+](=O)[O-] 2129901424 XPSOSYAJVNCCJH-SSDOTTSWSA-N 267.293 -0.189 5 10 CBBE C[C@@H](C(=O)N=c1cc[nH]cc1[N+](=O)[O-])N1CC(N)C1 2137714183 GCNRLIQNLGGEGS-ZETCQYMHSA-N 265.273 -0.618 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@](N)(CO)C1 2143558650 KNDNIJJURSCMFW-GFCCVEGCSA-N 282.300 -0.141 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N2C[C@@H](CO)C[C@H]2CO)n1 2146146929 AXAHEVYGFNBKFQ-CBAPKCEASA-N 283.288 -0.545 5 10 CBBE Nc1cc(N2CCOC[C@H]2[C@H](O)CO)cc([N+](=O)[O-])c1 2146332953 DSDIKAHYRHNILP-NWDGAFQWSA-N 283.284 -0.265 5 10 CBBE CCN=c1cc([N+](=O)[O-])cc(N[C@H]2CC(=O)NC2=O)[nH]1 2152383934 BSEXPOYHLXYTAK-ZETCQYMHSA-N 279.256 -0.330 5 10 CBBE COC1(CO)CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 2157303762 MAHBVQANWROPTA-UHFFFAOYSA-N 283.240 -0.471 5 10 CBBE CN=c1[nH]c(=NC[C@H]2CCN2C2CC2)[nH]cc1[N+](=O)[O-] 2157684752 ZJUMMOVWYMKRSZ-SECBINFHSA-N 278.316 -0.081 5 10 CBBE COc1ccc([N+](=O)[O-])c(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)n1 2160704472 QOVZCFLOIVDQKG-JGWOGQQGSA-N 281.268 -0.071 5 10 CBBE N=C(NO)c1cnc(N2CC(F)(CO)C2)c([N+](=O)[O-])c1 2172926738 QXNYOZJALAWYMQ-UHFFFAOYSA-N 285.235 -0.185 5 10 CBBE Nc1ncnc(N2C[C@H](N)C[C@@]23CCOC3)c1[N+](=O)[O-] 2173936734 WMZDNMQWIYHJLP-RDDDGLTNSA-N 280.288 -0.337 5 10 CBBE CN1C(=O)O[C@H]2CN(c3nc(=N)[nH]cc3[N+](=O)[O-])C[C@H]21 2176930111 GVXTZVGZXZCRDT-RQJHMYQMSA-N 280.244 -0.563 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCC2CC3(CNC3)C2)[nH]1 2177554122 NZDNDVSTHUVLSN-UHFFFAOYSA-N 278.316 -0.318 5 10 CBBE C[C@@H]1CN(c2ncnc(N)c2[N+](=O)[O-])C[C@@H](CCO)O1 2179371801 QTGIJQRGGZVTBS-HTQZYQBOSA-N 283.288 -0.057 5 10 CBBE O=C(O)c1nn(C[C@@]2(O)CCCNCC2)cc1[N+](=O)[O-] 2179685696 FGLUOIKNABTZTN-LLVKDONJSA-N 284.272 -0.006 5 10 CBBE O=C(O)c1nn(C[C@H](O)[C@H]2CCCNC2)cc1[N+](=O)[O-] 2179686265 MGEXUXSGCYNNGU-CBAPKCEASA-N 284.272 -0.150 5 10 CBBE O=[N+]([O-])c1ccc2cnn(CC(CO)(CO)CO)c2c1 2179743932 VZEYGIYEXPPJLU-UHFFFAOYSA-N 281.268 -0.092 5 10 CBBE C[C@H](O)C[C@H]1COCCN1c1nc(=N)[nH]cc1[N+](=O)[O-] 2185305717 PHXJDUPHRUDLJW-YUMQZZPRSA-N 283.288 -0.227 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)Nc2cnn(CCN)c2)n1 2186528118 HMMOLIOAGWHFRM-UHFFFAOYSA-N 279.260 -0.264 5 10 CBBE NNc1ccc([N+](=O)[O-])c(CN2CC[C@H](O)[C@H](O)C2)c1 2188632351 MQTUTRUBVIQEEZ-NWDGAFQWSA-N 282.300 -0.192 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](CCO)C(=O)O)c1 2193474490 UAYOMPRJMBAIRX-ZETCQYMHSA-N 283.240 -0.059 5 10 CBBE O=C(Cc1ccccc1)NC(=O)CN1CC([N+](=O)[O-])C1 2195380048 LODOVBOCTOBLQP-UHFFFAOYSA-N 277.280 -0.167 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@@H]2COC(C)(C)[C@H]2O)c1[N+](=O)[O-] 2199455713 CZZZGVZTOIFIEV-SVRRBLITSA-N 283.288 -0.522 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@]1(C)CCNC1=O 2200808460 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269.261 -0.956 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@]1(C)CNCCOC1 2135096249 DMYRKIBHDOBFDE-JTQLQIEISA-N 270.293 -0.817 5 10 CBBE O=C(O)[C@@H]1[C@H](O)[C@@H](O)CN1Cc1ccc([N+](=O)[O-])o1 2136097550 XISDLDORQKBZJN-CNUIFLNQSA-N 272.213 -0.822 5 10 CBBE O=[N+]([O-])c1cc(F)cc(N2C[C@H](O)[C@H](O)[C@H]2CO)c1 2136111471 DFQMZBUJMMNTET-OUAUKWLOSA-N 272.232 -0.363 5 10 CBBE Cc1c([N+](=O)[O-])c(N2C[C@H](CO)C[C@H]2CO)nn1C 2142481492 LDDMVBRVEANVNN-BDAKNGLRSA-N 270.289 -0.184 5 10 CBBE O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@]1(O)CCNC1 2144609060 CZRRJOWWMAZXDN-ZDUSSCGKSA-N 279.296 -0.022 5 10 CBBE CO[C@@H]1CNCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 2146728067 CZEJULUOQLYWQE-DTWKUNHWSA-N 283.288 -0.716 5 10 CBBE CN=c1nc(N(C)Cc2cnnn2C)c([N+](=O)[O-])c[nH]1 2156467682 IQPHJOZABVHKHX-UHFFFAOYSA-N 278.276 -0.387 5 10 CBBE COc1nc(=NC[C@H]2CN(C)CCN2)[nH]cc1[N+](=O)[O-] 2157679003 TXVIOIIEVFIXQR-QMMMGPOBSA-N 282.304 -0.869 5 10 CBBE COCC1(O)CN(c2ncc([N+](=O)[O-])c(N(C)C)n2)C1 2157680821 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CN=c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](O)[C@H]2CF)[nH]1 2205618718 SPIHKBHJUUKELD-WEDXCCLWSA-N 286.263 -0.667 5 10 CBBE CN(C)C[C@H]1COC[C@@H]1NCc1nn(C)cc1[N+](=O)[O-] 2206392130 KCPJILCLORPVAF-ONGXEEELSA-N 283.332 -0.006 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@@H]2C[C@@H]3OCC[C@@H]3N2)[nH]n1C 2207485786 OGCYWYSIQSJALS-GUBZILKMSA-N 281.316 -0.010 5 10 CBBE C[C@]1(CN=c2[nH]cncc2[N+](=O)[O-])CCNC1=O 2219818101 OHVSXVCKGWBFKL-SNVBAGLBSA-N 251.246 -0.255 5 10 CBBE CN1C(=O)CC[C@H](Nc2ncncc2[N+](=O)[O-])C1=O 2227002483 QRENMRJUOBGLAV-LURJTMIESA-N 265.229 -0.056 5 10 CBBE NS(=O)(=O)c1cn(C[C@@]2(F)CCOC2)nc1[N+](=O)[O-] 2229926790 PXPFJIDRIOJPKA-QMMMGPOBSA-N 294.264 -0.433 5 10 CBBE C[C@H]1CN(CCN=c2ncc([N+](=O)[O-])c[nH]2)C(=O)N1 2230815954 NSCMTYSLMJBXEE-ZETCQYMHSA-N 266.261 -0.368 5 10 CBBE CCn1ncc([N+](=O)[O-])c1O[C@H]1CS(=O)(=O)C[C@H]1N 2231870051 BOXSXNVVSOJNAH-SVRRBLITSA-N 290.301 -0.686 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2C[C@H](N)[C@@H]3C[C@@H]23)n1 2240642278 KVWUBQHBEJWPMU-BGZDPUMWSA-N 279.300 -0.072 5 10 CBBE Cc1c(NC(CN)(CO)CO)cccc1[N+](=O)[O-] 2254533881 VUGVKKPSRMFCCH-UHFFFAOYSA-N 255.274 -0.003 5 10 CBBE CCn1ncc([N+](=O)[O-])c1NC1CNCCNC1 2259427700 ALZDBQPRZKLITB-UHFFFAOYSA-N 254.294 -0.216 5 10 CBBE CC(C)C[C@@H](N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-])C(N)=O 2264445351 IRHLRYARIIYZOE-ZCFIWIBFSA-N 268.277 -0.469 5 10 CBBE Cc1nn(C(C)C)c(NCC(N)(CO)CO)c1[N+](=O)[O-] 2286193990 YCHCFBJGIKLPEP-UHFFFAOYSA-N 287.320 -0.225 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2C[C@H](O)[C@@H]2OC)[nH]1 2286723367 ZLEPZUZLJNPLDB-BKPPORCPSA-N 283.288 -0.861 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NC[C@@H]2NC[C@@H]3C[C@@H]32)[nH]1 2286723516 AYJDRDKKUYIUPZ-CIUDSAMLSA-N 279.300 -0.027 5 10 CBBE Cn1nc(O[C@]2(CN)CCSC2)nc1[N+](=O)[O-] 2304474347 PBJOOCIXWIVFJB-QMMMGPOBSA-N 259.291 -0.064 5 10 CBBE Cc1nsc(CN=c2nc([N+](=O)[O-])n(C)[nH]2)n1 2304509762 HCZDCYBYODXTEV-UHFFFAOYSA-N 255.263 -0.083 5 10 CBBE CN=c1[nH]c(N[C@@H]2[C@@H]3CN[C@H]2C3)ncc1[N+](=O)[O-] 2311830059 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COC[C@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593589983 WIABHZJCALHKCW-ZETCQYMHSA-N 291.285 -0.725 5 10 CBBE Nc1c(C(=O)N2CCOC3(CNC3)C2)cccc1[N+](=O)[O-] 596097869 IENLEQOKFDNHSV-UHFFFAOYSA-N 292.295 -0.009 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CCOC[C@H]1CCO 702192574 RNQFTFQLAMXROI-SECBINFHSA-N 284.272 -0.599 5 10 CBBE C[C@]1(CO)C[C@H](O)CN1c1nc(F)ncc1[N+](=O)[O-] 703898779 SASZJONLBUHRNC-QUBYGPBYSA-N 272.236 -0.154 5 10 CBBE Cc1cnc(NC2(C(N)=O)CNC2)cc1[N+](=O)[O-] 715577648 IBSFCIQNKYPNDR-UHFFFAOYSA-N 251.246 -0.463 5 10 CBBE CCCOCC(=O)N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1284079434 CNQDKTMAWYNQCX-LMLFDSFASA-N 299.327 -0.158 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1CC[C@H]2OCC(=O)N[C@@H]2C1 1307135463 LMUPIEPAIXNCQU-VXNVDRBHSA-N 281.272 -0.578 5 10 CBBE CN1CCC[C@@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1320009179 HEECYEVVTDFMRP-SNVBAGLBSA-N 294.311 -0.033 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC2(COC2)C1 1328431822 IALIHCRZFGTDTH-UHFFFAOYSA-N 267.245 -0.565 5 10 CBBE Cn1ncc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1=O 1439591075 RQFKIEBZFCHHBW-UHFFFAOYSA-N 278.228 -0.476 5 10 CBBE C[C@@H](O)[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 1451330696 RQMODVHUGPPIDQ-KOLCDFICSA-N 298.299 -0.210 5 10 CBBE CONC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1458022137 GCANZBYKDHERBE-UHFFFAOYSA-N 271.233 -0.956 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C(N)=O)C(C)C 1534718715 ADAZUXCXNJDRJT-SNVBAGLBSA-N 283.288 -0.274 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)NCCc1nncn1C 1616681748 RNHLQQBZYAHHLW-UHFFFAOYSA-N 293.287 -0.413 5 10 CBBE O=C(CCn1cc([N+](=O)[O-])cn1)NCC[C@@H]1CNC(=O)C1 1625643406 LWVLSMVBSLLIKF-VIFPVBQESA-N 295.299 -0.176 5 10 CBBE Cc1nnc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])o1 1626082175 QMEBOYWATPZIOK-UHFFFAOYSA-N 252.190 -0.061 5 10 CBBE CC[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)NC 1642907717 QYYCTLJCQJGOEY-QMMMGPOBSA-N 296.283 -0.603 5 10 CBBE CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1csnn1 1713451334 GHRLOSOEMNSRTB-RKDXNWHRSA-N 285.329 -0.249 5 10 CBBE O=C(O)C1[C@H]2CC(NC(=O)N3CC([N+](=O)[O-])C3)C[C@H]12 1876136649 GBXBYPWXKHJLGB-UQEKASRSSA-N 269.257 -0.234 5 10 CBBE N[C@H](Cc1ccc(O)cc1)C(=O)N1CC([N+](=O)[O-])C1 1876149438 MQORALHCOSWPLV-LLVKDONJSA-N 265.269 -0.251 5 10 CBBE CCn1cc([N+](=O)[O-])c(=O)n(C[C@H](C)C(=O)OC)c1=O 1912218088 RIBLMOGHNPOUDQ-ZETCQYMHSA-N 285.256 -0.253 5 10 CBBE CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CC(O)C1 1914596004 MCYMQDYNDUZLGQ-UHFFFAOYSA-N 254.246 -0.227 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2CC[C@](F)(CO)C2)n1 1917113218 VNMQBSKPQLCBEL-SECBINFHSA-N 272.240 -0.419 5 10 CBBE COC[C@@H](CO)Nc1ncc([N+](=O)[O-])cc1C(N)=O 1917258178 NWJSXZSDMLRUJX-ZCFIWIBFSA-N 270.245 -0.492 5 10 CBBE CCOC[C@](CN)(C(=O)O)n1cc([N+](=O)[O-])cn1 1919763055 KDLCKBNJTMFAHD-SECBINFHSA-N 258.234 -0.434 5 10 CBBE CC1(C)CNC[C@@H](Cn2cc([N+](=O)[O-])cnc2=O)O1 1926465294 LALAQNAOXGKNRJ-VIFPVBQESA-N 268.273 -0.082 5 10 CBBE COc1ncnc(N2C[C@@H]3C[C@@]3(N)C2)c1[N+](=O)[O-] 2034065344 FHPQEQXKYPRJGS-QUBYGPBYSA-N 251.246 -0.069 5 10 CBBE 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CBBE O=C(Nc1ncccc1[N+](=O)[O-])[C@H]1CNCCO1 2082425921 WTTDOPRMENGMDP-MRVPVSSYSA-N 252.230 -0.083 5 10 CBBE Cc1c([N+](=O)[O-])c(O[C@H]2CN(C)C[C@@H]2N)nn1C 2086316949 NPKQBNNOAKQXQL-YUMQZZPRSA-N 255.278 -0.343 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1[C@H]2NCCC[C@H]21 2094632122 IVDQRODNPKZYQR-PPKCKEKNSA-N 265.273 -0.342 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1CCOC[C@H](CO)C1 2098206616 DGESJOKGQPNIQT-ZETCQYMHSA-N 272.236 -0.031 5 10 CBBE Nc1nc[nH]c(=NCCN2C[C@H]3C[C@H]3C2)c1[N+](=O)[O-] 2099620459 RBPWWHWKZZACLB-OCAPTIKFSA-N 264.289 -0.248 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCc1ocnc1C(=O)O 2102940793 HFMRKFDCZDQTDN-UHFFFAOYSA-N 268.189 -0.557 5 10 CBBE COC(=O)[C@@H]1C[C@@H](Oc2c([N+](=O)[O-])cnn2C)CN1 2110867032 QOMHNTABOKGXQX-RQJHMYQMSA-N 270.245 -0.389 5 10 CBBE CN=c1nc(N(OC)C2CNC2)c([N+](=O)[O-])c(C)[nH]1 2117115953 FHQYBABVWQITGR-UHFFFAOYSA-N 268.277 -0.504 5 10 CBBE N=c1nc(N2CC[C@H]3NCC[C@H]3C2)c([N+](=O)[O-])c[nH]1 2117224109 VGUICUFYIQXWTI-JGVFFNPUSA-N 264.289 -0.014 5 10 CBBE CN=c1nc(N2C[C@@H](F)C[C@H]2CN)c([N+](=O)[O-])c[nH]1 2117282654 ICNYPNZMVCQYPL-BQBZGAKWSA-N 270.268 -0.276 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CNC2[C@H]3COC[C@H]23)c1 2118013800 BQEBAWYZKOVRJC-UTLUCORTSA-N 268.273 -0.613 5 10 CBBE CN=c1nc(N2C[C@@H](CO)[C@@H](F)C2)c([N+](=O)[O-])c[nH]1 2120628458 KOWKVNRPBQATKK-BQBZGAKWSA-N 271.252 -0.385 5 10 CBBE CO[C@H]1COC[C@@H]1N(C)c1ncc([N+](=O)[O-])c(=N)[nH]1 2120772721 BQHDIYDTOPQLQV-YUMQZZPRSA-N 269.261 -0.353 5 10 CBBE O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](CO)[C@H](O)[C@@H]2O)cn1 2121471997 BVCMBBIYVSPYNE-WKNZSSQBSA-N 269.257 -0.496 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(F)(C(=O)O)C1 2121859181 OEHVEWCBARZSDK-UHFFFAOYSA-N 272.192 -0.574 5 10 CBBE O=C(N[C@H]1CNC[C@@H]1O)c1cccc([N+](=O)[O-])c1O 2126238669 HXJWQDLVPXSBMW-CBAPKCEASA-N 267.241 -0.637 5 10 CBBE Nc1nc(N2CCN[C@H]3COC[C@H]32)ccc1[N+](=O)[O-] 2132572983 XPQFEQVJFBJCTR-IONNQARKSA-N 265.273 -0.251 5 10 CBBE O=[N+]([O-])c1c(N2C[C@H](O)[C@@H](O)[C@@H]2CO)ccnc1Cl 2136340520 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CCn1cc([N+](=O)[O-])c(=N[C@@H]2CO[C@@H]3CNC[C@@H]23)[nH]1 2230795650 XENYQJWNFVWDHN-QXFUBDJGSA-N 267.289 -0.368 5 10 CBBE CO[C@@H](CN)CC(=O)NCc1nn(C)cc1[N+](=O)[O-] 2231917744 KRBNWNPTOQFIKW-SSDOTTSWSA-N 271.277 -0.692 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N2CC[C@H]2[C@@H](O)CO)n1 2270713957 ISJOYVBDFHRRHH-YUMQZZPRSA-N 269.261 -0.793 5 10 CBBE C[C@H](O)[C@H](O)CN=c1[nH]c(C2CC2)ncc1[N+](=O)[O-] 2271073952 RCEBKTOQIHUHQK-IMTBSYHQSA-N 268.273 -0.162 5 10 CBBE Cc1ncc([N+](=O)[O-])c(O[C@H]2CS(=O)(=O)C[C@@H]2N)n1 2271094254 MDYOYORWAHRCNN-XPUUQOCRSA-N 288.285 -0.804 5 10 CBBE N[C@@H](C(=O)N=c1cc[nH]cc1[N+](=O)[O-])[C@@H](O)C(F)(F)F 2280089020 GMAWQDZTSZUHLW-RNFRBKRXSA-N 294.189 -0.399 5 10 CBBE CN(C)C(=O)N1CC[C@H](N=c2nc([N+](=O)[O-])[nH]n2C)C1 2288826928 UFLSEJDXKFPXGA-ZETCQYMHSA-N 283.292 -0.687 5 10 CBBE N=c1[nH]c(=NCCO[C@@H]2CCCNC2)[nH]cc1[N+](=O)[O-] 2289932077 FUZFXDPFYRSRPA-MRVPVSSYSA-N 282.304 -0.600 5 10 CBBE Cc1nn(-c2nnn(CC(=O)O)n2)c(C)c1[N+](=O)[O-] 2295341825 BREUGKJXTXZHGN-UHFFFAOYSA-N 267.205 -0.532 5 10 CBBE Cn1[nH]c(=NCC(F)(F)CC(=O)O)nc1[N+](=O)[O-] 2321756062 ZKWPWRUZNNYJPR-UHFFFAOYSA-N 265.176 -0.333 5 10 CBBE CN1CC[C@@](C(=O)O)(N2CC([N+](=O)[O-])C2)C1(C)C 2323716328 DIGWOFHKWHKCNN-NSHDSACASA-N 257.290 -0.115 5 10 CBBE C[C@]1(N)CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)CC1(F)F 2336779201 VMTABVROKYPHOF-QMMMGPOBSA-N 274.231 -0.030 5 10 CBBE C[C@H](CN1CCNCC1)Oc1nc([N+](=O)[O-])n(C)n1 2344956077 WKZQLNWEFBTMRK-MRVPVSSYSA-N 270.293 -0.604 5 10 CBBE Cn1[nH]c(=N[C@H]2CC(=O)N3CCC[C@@H]23)nc1[N+](=O)[O-] 2344958694 VMRKINHMBKBQDW-BQBZGAKWSA-N 266.261 -0.680 5 10 CBBE Cc1nn(CC(=O)N[C@H](C)C(=O)O)c(C)c1[N+](=O)[O-] 37417978 FULQVUZWRFAXNR-ZCFIWIBFSA-N 270.245 -0.003 5 10 CBBE C[C@@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 85989452 COPVZEAQFUHALB-SCZZXKLOSA-N 258.278 -0.487 5 10 CBBE CCC(=O)Cn1c(=O)c([N+](=O)[O-])cn(CC)c1=O 111545211 LYISEYFXYSZJTF-UHFFFAOYSA-N 255.230 -0.083 5 10 CBBE CCCNC(=O)[C@@H](C)Nc1nc(NN)ncc1[N+](=O)[O-] 233078882 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COc1cccc(NC[C@@H]2NC[C@@H](O)[C@@H]2O)c1[N+](=O)[O-] 2233978324 UGAGOQVDCSGYPH-YGOYTEALSA-N 283.284 -0.291 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCC2(O)CSC2)[nH]1 2255969559 KFUZGCLEAWOBCZ-UHFFFAOYSA-N 271.302 -0.840 5 10 CBBE N=c1ccc([N+](=O)[O-])c(NC2CC(O)(CO)C2)[nH]1 2256992066 RBZGNWCNKPRCAT-UHFFFAOYSA-N 254.246 -0.300 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2C[C@@H](N)C[C@H](O)C2)n1 2258617602 DGQBTZVGOFSLIA-YUMQZZPRSA-N 253.262 -0.408 5 10 CBBE CCCc1ncc([N+](=O)[O-])c(=NCC[C@H](O)CO)[nH]1 2271110332 YBIFOYDWCJKXLS-QMMMGPOBSA-N 270.289 -0.086 5 10 CBBE O=C(NCC[C@@H](O)C(=O)O)c1ccc([N+](=O)[O-])cn1 2278228385 GBWWJFYJWRKLJC-MRVPVSSYSA-N 269.213 -0.445 5 10 CBBE O=[N+]([O-])c1ccnc(N2C[C@@H]3OC[C@@H](CO)O[C@H]3C2)c1 2279926380 VRWTZGKITZJVCF-VWYCJHECSA-N 281.268 -0.045 5 10 CBBE C[C@H]1COCCN1CCOc1ncc([N+](=O)[O-])c(=N)[nH]1 2285511805 VDAKODOVOSKDNN-QMMMGPOBSA-N 283.288 -0.103 5 10 CBBE Cn1nnc(CN=c2[nH]c(C3CC3)ncc2[N+](=O)[O-])n1 2286686997 HGSJBCKCGQAEPT-UHFFFAOYSA-N 276.260 -0.180 5 10 CBBE O=C(Cc1cccc([N+](=O)[O-])c1)NC1CNCCNC1 2287599228 NCCAZTVSKRUWFN-UHFFFAOYSA-N 278.312 -0.185 5 10 CBBE C[C@@H]1CN(C)CC[C@H]1N=c1nc([N+](=O)[O-])n(C)[nH]1 2321708704 YTPPZXJEOZLIES-HTQZYQBOSA-N 254.294 -0.103 5 10 CBBE CO[C@@H]1C[C@H](N)CN(Cc2nn(C)cc2[N+](=O)[O-])C1 2344691257 BBNRDYLHTODTPJ-DTWKUNHWSA-N 269.305 -0.124 5 10 CBBE Cn1nc(N2C[C@H]3CCO[C@]3(CO)C2)nc1[N+](=O)[O-] 2344966297 UDVIWIGSWAYCGL-XCBNKYQSSA-N 269.261 -0.689 5 10 CBBE NNc1cc(C(=O)N2CCNC(=O)C2)ccc1[N+](=O)[O-] 54415740 ULMATPMHYHTOOD-UHFFFAOYSA-N 279.256 -0.548 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)CO 90285884 UNBQAJZWASSGDX-JTQLQIEISA-N 257.246 -0.594 5 10 CBBE C[C@](O)(CNC(=O)Cn1ccc([N+](=O)[O-])n1)CC(=O)O 91522332 RCURIJNQARWHTJ-SNVBAGLBSA-N 286.244 -0.867 5 10 CBBE CNC[C@@H](O)CS(=O)(=O)c1ccccc1[N+](=O)[O-] 126518995 MAAZKPLPFTWGGU-MRVPVSSYSA-N 274.298 -0.051 5 10 CBBE NS(=O)(=O)CCNc1nc(C(=O)O)ccc1[N+](=O)[O-] 166680939 GHTUEKQKLDVKCB-UHFFFAOYSA-N 290.257 -0.612 5 10 CBBE C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCN1CCO 188785467 SQJXXIHOJLTDMY-SNVBAGLBSA-N 297.315 -0.684 5 10 CBBE NC(=O)[C@@H](O)CNCc1cc([N+](=O)[O-])c(F)cc1F 228614571 CIUIVUZQIFZLHV-VIFPVBQESA-N 275.211 -0.191 5 10 CBBE Cc1nc2n(n1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 377963089 NPSGVMWWUKJETI-HTQZYQBOSA-N 251.246 -0.406 5 10 CBBE CCn1cc(CN=c2[nH]c(=N)[nH]c(C)c2[N+](=O)[O-])nn1 404490235 RCXQLNGEFRDEFX-UHFFFAOYSA-N 278.276 -0.249 5 10 CBBE CC1(O)CN(S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1 593588110 IDNMILRFEVZVCH-UHFFFAOYSA-N 273.270 -0.255 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC12COC2 597730511 CYWFSASZHQVKGY-UHFFFAOYSA-N 252.230 -0.207 5 10 CBBE C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)C1=O 598112274 CDCMLBPCZIXWCX-HTQZYQBOSA-N 281.272 -0.130 5 10 CBBE CNc1nccc(C(=O)N[C@@H]2CCOC[C@H]2O)c1[N+](=O)[O-] 600585259 CSAOMMRBIUQJQI-RKDXNWHRSA-N 296.283 -0.089 5 10 CBBE NC(=O)C(Nc1ccc(Cl)cc1[N+](=O)[O-])C(N)=O 695353158 FOMKVVVNEKGEIY-UHFFFAOYSA-N 272.648 -0.001 5 10 CBBE O=C(O)c1ccnc(N[C@H]2CCNC2=O)c1[N+](=O)[O-] 822138698 CLGJTCOGXQEGIW-LURJTMIESA-N 266.213 -0.012 5 10 CBBE CC(C)(C)n1nnc(Cn2ncc([N+](=O)[O-])n2)n1 863371608 PXESHQPMJMBKMP-UHFFFAOYSA-N 252.238 -0.024 5 10 CBBE CN1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@H]1CO 931407302 HNPUUDVFGMLKNC-JTQLQIEISA-N 269.305 -0.600 5 10 CBBE CC[C@@H](CCO)NC(=O)Cn1cnc([N+](=O)[O-])n1 1116383883 HQUQSLVIDZLROC-ZETCQYMHSA-N 257.250 -0.537 5 10 CBBE C[C@H](O)CN(Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)CO 1193486119 XDPMPKKYNRICDM-BDAKNGLRSA-N 272.305 -0.108 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)[C@H]1CCCOC1 1299353291 ZNFZWYBUNHJZBL-GXSJLCMTSA-N 298.299 -0.305 5 10 CBBE O=[N+]([O-])c1c(N[C@H]2C[C@H](O)[C@H](O)C2)ccnc1O 1307211088 MBMITJWDQUXUJE-YDNVCLBTSA-N 255.230 -0.009 5 10 CBBE COC(=O)[C@H]1C[C@@H](OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CN1C 1350300362 IEOPNKDLAILXDY-FNCVBFRFSA-N 272.257 -0.560 5 10 CBBE COC[C@H](CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)OC 1466795948 GMMJFTJIZFMIDK-QMMMGPOBSA-N 284.272 -0.037 5 10 CBBE Cn1cc([N+](=O)[O-])c(NC2CC(NS(C)(=O)=O)C2)n1 1559173236 GOACSBZKRDYHHP-UHFFFAOYSA-N 289.317 -0.180 5 10 CBBE Cc1nc(C)c(CNC(=O)Cn2cnc([N+](=O)[O-])n2)[nH]1 1596952961 CFVDLNDGSCMHSZ-UHFFFAOYSA-N 279.260 -0.157 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)NCCn2ncnn2)n1 1635673079 IXVOHEWNPQWUNB-UHFFFAOYSA-N 277.244 -0.285 5 10 CBBE CN(CCOCCO)C(=O)c1c[nH]nc1[N+](=O)[O-] 1639526478 XNAFOMYLWPBBIU-UHFFFAOYSA-N 258.234 -0.601 5 10 CBBE Cn1cc([N+](=O)[O-])c(NCCCN2C(=O)CNC2=O)n1 1655120319 VESOTZPWPYOJBQ-UHFFFAOYSA-N 282.260 -0.318 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CC(C)(C(N)=O)C2)[nH]1 1914219961 AMUKNLYIZGHZSC-UHFFFAOYSA-N 265.273 -0.235 5 10 CBBE NC(=O)C1(O)CN(Cc2ccc([N+](=O)[O-])cc2)C1 1915214645 SOOZOMUSBHLCDV-UHFFFAOYSA-N 251.242 -0.373 5 10 CBBE CN(C)[C@@H]1COC[C@@H]1Nc1ncnc(N)c1[N+](=O)[O-] 1922025799 SJQSROPYWNRJDT-NKWVEPMBSA-N 268.277 -0.292 5 10 CBBE NCCNCC[S@](=O)Cc1ccc([N+](=O)[O-])cn1 1923466035 RRTZCYKJMSNKJI-SFHVURJKSA-N 272.330 -0.213 5 10 CBBE Nc1ncnc(N2CC3(CC(O)C3)C2)c1[N+](=O)[O-] 2029652555 RRWYRJGQKPHBSN-UHFFFAOYSA-N 251.246 -0.072 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC[C@H]2CNC[C@H]2C1 2041243509 RAPMZFAHLJCKGX-YUMQZZPRSA-N 252.278 -0.231 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2CCC23COC3)n1 2051859133 XCUGUNJSWPTAPE-UHFFFAOYSA-N 252.234 -0.351 5 10 CBBE CN=c1[nH]c(N2CC([S@@](C)=O)C2)ncc1[N+](=O)[O-] 2051901069 ZNLLQRGDMRGUOQ-GOSISDBHSA-N 271.302 -0.585 5 10 CBBE C[C@H]1CC[C@@H](N=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])CN1 2053590451 AAMWIKMUKGYXHI-NKWVEPMBSA-N 252.278 -0.228 5 10 CBBE O=[N+]([O-])c1ncccc1N1C[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2055820497 IPSCFNNDHLADJW-NEPJDUFXSA-N 251.242 -0.080 5 10 CBBE COC(=O)[C@@H](N)[C@@H](C)Oc1ncc([N+](=O)[O-])cn1 2056221769 GPIZHBMLBIRNCV-VDTYLAMSSA-N 256.218 -0.348 5 10 CBBE CO[C@H]1CN(c2nccc(N)c2[N+](=O)[O-])C[C@@H]1N 2058767091 IMJOTDAFKAEZTC-YUMQZZPRSA-N 253.262 -0.266 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])c2)CCC12CNC2 2059143343 XAZJWHSCAPNITM-SNVBAGLBSA-N 252.230 -0.045 5 10 CBBE 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Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2CCOC[C@@H]2N)n1 2240646757 BQATZFIBNWEVIA-SFYZADRCSA-N 283.288 -0.692 5 10 CBBE NCC(CO)(CO)NC(=O)c1csc([N+](=O)[O-])c1 2254528513 HDRGMCKLPSCQNJ-UHFFFAOYSA-N 275.286 -0.932 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NC[C@@H]2CNC[C@H]2O)[nH]1 2258625037 UXGBXJBMQNVNKA-IONNQARKSA-N 253.262 -0.893 5 10 CBBE NNc1cc(N2CC(O)(CCO)C2)ccc1[N+](=O)[O-] 2270659342 YLRSIYGUPDOKEX-UHFFFAOYSA-N 268.273 -0.186 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@@H](CCCCN)C(=O)O)[nH]1 2274067552 MQHZFPLXQWETQR-ZETCQYMHSA-N 271.277 -0.256 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=N[C@@H]3[C@@H]4C[C@@H]3CN4)[nH]c12 2278418827 CSIGRFKDJADFTO-FWWHASMVSA-N 260.257 -0.168 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2COC(=O)C2)[nH]1 2278759840 QWZDRTCNZUBBEK-ZCFIWIBFSA-N 267.245 -0.612 5 10 CBBE Nc1c(C(=O)N2CC[C@@H]2[C@@H](O)CO)cccc1[N+](=O)[O-] 2286215600 WIKOVIWAWMRFKX-SCZZXKLOSA-N 281.268 -0.255 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2C[C@H]3CO[C@H]2C3)c1[N+](=O)[O-] 2286255879 SMQHXHKXJYMMTQ-PRJMDXOYSA-N 280.288 -0.010 5 10 CBBE CN=c1[nH]c(N[C@H]2COC3(COC3)C2)ncc1[N+](=O)[O-] 2286279386 MPSDKXNRNWQHOK-SSDOTTSWSA-N 281.272 -0.182 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2COC[C@H]2OC)[nH]1 2286650851 ZTMGDFKIXNVKEW-VXNVDRBHSA-N 284.272 -0.221 5 10 CBBE CN(C)[C@H]1CNC[C@@H]1Oc1nc([N+](=O)[O-])n(C)n1 2321740519 AXBDLWJPAYNQJO-BQBZGAKWSA-N 256.266 -0.996 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@@H]3[C@H](N)C[C@@H]3C2)[nH]1 2333001721 VAQBYQINEQIOGM-FKSUSPILSA-N 264.289 -0.243 5 10 CBBE Cn1cc([N+](=O)[O-])c(N(CCCO)CCC(=O)O)n1 2342613809 CYCWVAKTILSDMB-UHFFFAOYSA-N 272.261 -0.008 5 10 CBBE Cn1[nH]c(=NC[C@]23COC[C@H]2C3(F)F)nc1[N+](=O)[O-] 2344959093 BFUOEBPLDHNOFT-XRGYYRRGSA-N 275.215 -0.161 5 10 CBBE O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@@H](O)CN1 52943238 AUKPQAZQGJWIJT-MNOVXSKESA-N 265.269 -0.066 5 10 CBBE O=C(O)c1nn(-c2ccc([N+](=O)[O-])cn2)c(=O)[nH]1 71445249 KMGJKHDOJWJAID-UHFFFAOYSA-N 251.158 -0.438 5 10 CBBE COC(=O)[C@@](C)(O)Cn1cccc([N+](=O)[O-])c1=O 80208703 RIEPDCVTHUEJNH-JTQLQIEISA-N 256.214 -0.320 5 10 CBBE C[C@@H]1C(=O)NC(=O)CN1c1nc(NN)ccc1[N+](=O)[O-] 161117991 JMLJZXBMHKTGLE-RXMQYKEDSA-N 280.244 -0.873 5 10 CBBE C[C@@H]1OCC[C@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 226442768 BZPVLQHJYQRZFN-JMJZKYOTSA-N 270.289 -0.081 5 10 CBBE CN(C)S(=O)(=O)CCNc1cc([N+](=O)[O-])cc(N)n1 231030638 JIMGWYWZSBUHKW-UHFFFAOYSA-N 289.317 -0.125 5 10 CBBE CNc1nc(C)c([N+](=O)[O-])c(N[C@H]2COC[C@@H]2O)n1 323434777 RHMFCRQLLSQENQ-BQBZGAKWSA-N 269.261 -0.093 5 10 CBBE Cc1[nH]nc(C(=O)N2C[C@H]3[C@@H](C2)OCCN3C)c1[N+](=O)[O-] 352197448 RUQFRNYSBAVTSV-DTWKUNHWSA-N 295.299 -0.219 5 10 CBBE COC(=O)[C@H](CF)NC(=O)Cn1cc([N+](=O)[O-])nc1C 360479184 NNZAQIQPMPTFFM-ZETCQYMHSA-N 288.235 -0.273 5 10 CBBE O=[N+]([O-])c1sc(CO)cc1N1C[C@H](O)[C@@H](O)C1 404312563 MFKBYURDICFSLJ-YUMQZZPRSA-N 260.271 -0.310 5 10 CBBE C[C@@](O)(CO)CNc1c(C(N)=O)cccc1[N+](=O)[O-] 420621035 FNSVVTPUIHUCDF-NSHDSACASA-N 269.257 -0.151 5 10 CBBE Cc1noc(CN2C[C@@H](O)C[C@@H](O)C2)c1[N+](=O)[O-] 595338759 SYHGYMMMFNLKGQ-OCAPTIKFSA-N 257.246 -0.181 5 10 CBBE Cc1nn(C)c(NCCc2nnnn2C)c1[N+](=O)[O-] 611306705 SCGSGAGHSICNSW-UHFFFAOYSA-N 266.265 -0.185 5 10 CBBE C[C@@H]1CN(C(=O)CCn2cnc([N+](=O)[O-])c2)C[C@@H]1N 701099066 CHZOGFRQWBNQEE-BDAKNGLRSA-N 267.289 -0.013 5 10 CBBE CN(c1nc(NN)ncc1[N+](=O)[O-])C1CC(C(N)=O)C1 704316161 MDHMJBRAZFNFTQ-UHFFFAOYSA-N 281.276 -0.630 5 10 CBBE COc1ncnc(N2C[C@H](CO)[C@@H](CO)C2)c1[N+](=O)[O-] 705350310 HNUJKBGOWGWWBN-HTQZYQBOSA-N 284.272 -0.570 5 10 CBBE NNc1cc(C(=O)Nc2nn[nH]n2)ccc1[N+](=O)[O-] 709952803 JGZYJUAKXXAEHZ-UHFFFAOYSA-N 264.205 -0.354 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NCCOc1cccnc1 733941611 XTQRKMFWACJQDT-UHFFFAOYSA-N 292.255 -0.224 5 10 CBBE Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1CCO 760002159 OBBWMEJRYJVQCL-QMMMGPOBSA-N 296.283 -0.205 5 10 CBBE C[C@@H]1[C@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)CC(=O)N1C 806070017 GQERGXVFKOKYCF-RNFRBKRXSA-N 283.244 -0.651 5 10 CBBE C[C@@H](COC(=O)CCC(=O)N1CCOCC1)[N+](=O)[O-] 813105651 RDUYEMBFFAASKN-VIFPVBQESA-N 274.273 -0.166 5 10 CBBE CCON(C)C(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 846503846 CXBSKEFGSQSPST-UHFFFAOYSA-N 299.287 -0.224 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H](O)COCC1CC1 1116321007 QHHWXNHGXMSNMF-SECBINFHSA-N 299.287 -0.910 5 10 CBBE NC(=O)N1CCN(c2cc(N)c([N+](=O)[O-])cn2)CC1 1166573367 YKSRCBDGPSSKIV-UHFFFAOYSA-N 266.261 -0.227 5 10 CBBE COC(=O)[C@@H]1[C@H](O)CCCN1Cc1cn(C)nc1[N+](=O)[O-] 1169291707 BVWRDWLZZXCRAG-ZJUUUORDSA-N 298.299 -0.173 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)[C@H]1CCCOC1 1299349646 GSXARZBSSPFQDG-VHSXEESVSA-N 298.299 -0.305 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCCC[C@@H]1CO 1300049423 MLERAEZOJGILQZ-SECBINFHSA-N 283.288 -0.050 5 10 CBBE NC(=O)c1cc(N[C@H]2CCNC2=O)ccc1[N+](=O)[O-] 1328071560 KTXXHTVRIKSCGM-QMMMGPOBSA-N 264.241 -0.006 5 10 CBBE C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CN(C)CCN1C 1565832892 DWCLAQUMVOBDOA-WCBMZHEXSA-N 296.331 -0.318 5 10 CBBE C[C@H](O)[C@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1566796378 PEVBDSSQCBJSCH-UWVGGRQHSA-N 295.295 -0.014 5 10 CBBE Cc1[nH]nc(C(=O)N2CC[C@@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 1587420333 ZUISOHNDBFTQEY-RQJHMYQMSA-N 270.245 -0.806 5 10 CBBE CC(=O)N[C@H]1CCN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)C1 1626931856 GMPAUJUHROGEPF-VIFPVBQESA-N 293.283 -0.077 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H](O)[C@@H](CO)C1 1642400656 FWAZBPAQBIFVAB-XCBNKYQSSA-N 267.241 -0.585 5 10 CBBE CCOCC(=O)NCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1688305073 MAOLETZJZAQRJQ-RKDXNWHRSA-N 273.289 -0.737 5 10 CBBE CCn1ncc([N+](=O)[O-])c1C(=O)O[C@@H]1CNOC1 1850623471 PDLWEPNPDXJLAA-ZCFIWIBFSA-N 256.218 -0.129 5 10 CBBE N=c1[nH]c(OCc2nnc(CN)s2)ncc1[N+](=O)[O-] 1877554769 SOSRYLXNYGSDDZ-UHFFFAOYSA-N 283.273 -0.313 5 10 CBBE Cc1nn(C)c(N2CC[C@](C)(O)[C@H](O)C2)c1[N+](=O)[O-] 1893326083 RZMOHQDYZTYKML-KCJUWKMLSA-N 270.289 -0.041 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1NC[C@@H]2C[C@H]21 1905994397 WGJRRRNBKILEJO-YIZRAAEISA-N 265.273 -0.485 5 10 CBBE COC(=O)CN(CC(=O)OC)c1c([N+](=O)[O-])cnn1C 1916398285 RBEVBWHJWZXGLF-UHFFFAOYSA-N 286.244 -0.519 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@@]1(CO)CCCNC1 1916404772 QICDBXMNUFXHAT-JTQLQIEISA-N 255.278 -0.145 5 10 CBBE CN(C)[C@H]1COC[C@H]1CN=c1ccc([N+](=O)[O-])c(N)[nH]1 1924659864 QBEPQDGXSFDHIJ-SCZZXKLOSA-N 281.316 -0.018 5 10 CBBE CN(C)[C@@H]1COC[C@@H]1CN=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 1924959144 UNATVNSCHJWTCM-IONNQARKSA-N 282.304 -0.792 5 10 CBBE CN=c1nc(N2C[C@@](C)(O)CO2)c([N+](=O)[O-])c[nH]1 2032462347 VONTWNUDDKZDSA-SECBINFHSA-N 255.234 -0.649 5 10 CBBE CN(CC(N)=O)Cc1cc(NN)ccc1[N+](=O)[O-] 2032987492 DTQXQBMMAZCWCC-UHFFFAOYSA-N 253.262 -0.203 5 10 CBBE N=c1cc([N+](=O)[O-])cc(NC[C@@H]2COC[C@@H]2O)[nH]1 2036571683 LASLSTUFRZKISW-SVRRBLITSA-N 254.246 -0.178 5 10 CBBE CN=c1[nH]c(=NC[C@@H](C)[S@](C)=O)[nH]cc1[N+](=O)[O-] 2039926800 TXPSOBJZUVZPMJ-DMWPKQFHSA-N 273.318 -0.551 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CCCCNC1=O 2041243273 OGVITHGNUYHPIH-LURJTMIESA-N 254.250 -0.774 5 10 CBBE O=[N+]([O-])c1c(F)nc[nH]c1=NC[C@@H]1COCCN1 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281.272 -0.694 5 10 CBBE O=C(O)[C@@]1(O)CCN(c2cccc([N+](=O)[O-])n2)C[C@H]1O 2197467471 HSMHXHGPAFGGRM-RDDDGLTNSA-N 283.240 -0.624 5 10 CBBE Cc1nc(NN)nc(N2C[C@H]3C[C@H]2[C@@H]3CO)c1[N+](=O)[O-] 2203129142 UJRKGTJZIDLTJL-PRJMDXOYSA-N 280.288 -0.204 5 10 CBBE O=C(O)[C@H]1CCC2(CN(C(=O)N3CC([N+](=O)[O-])C3)C2)O1 2205354129 CLSUXDWMQUWNSV-MRVPVSSYSA-N 285.256 -0.615 5 10 CBBE Cc1nc([N+](=O)[O-])c(N[C@H](CCC(N)=O)C(=O)O)n1C 2206107258 FKNNPYLCEFTHJN-ZCFIWIBFSA-N 285.260 -0.233 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@]23CNC[C@@H]2C3)n1 2222975321 LBQIJOWYFWOKON-QUBYGPBYSA-N 251.246 -0.580 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2CCNC2)n1 2223853758 OMYAIENZVJUZAE-SSDOTTSWSA-N 253.262 -0.446 5 10 CBBE O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@H]1C[C@@H](O)CN1 2227882307 WGSLYDRCDNAFDN-HTQZYQBOSA-N 267.241 -0.038 5 10 CBBE Nc1[nH]c(=NCC[C@]2(O)CCNC2)ccc1[N+](=O)[O-] 2230158440 UYDUKTVSAKYWSP-LLVKDONJSA-N 267.289 -0.480 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@H](N)CCOC)[nH]1 2233903611 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2345018414 DUKQRABYEFBDSU-NXEZZACHSA-N 271.277 -0.565 5 10 CBBE Cn1nc(N[C@@]2(CO)C[C@@H](O)C2(C)C)nc1[N+](=O)[O-] 2345019108 NATLWHKZEXGSSW-LHLIQPBNSA-N 271.277 -0.343 5 10 CBBE Cc1nn(C)cc1[C@](C)(C(=O)O)N1CC([N+](=O)[O-])C1 2347713931 GZLRLPBCWNRSJB-LLVKDONJSA-N 268.273 -0.011 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@H]2C[C@H]1[C@H](O)[C@H](O)C2 2355333462 BBODLQHRQBZAOO-ITFKJWCVSA-N 284.247 -0.156 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2CCN[C@@H]3C[C@H]23)[nH]1 2355653119 KASATWMIODNMCA-HRDYMLBCSA-N 278.316 -0.259 5 10 CBBE NCCNS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 20558480 NYXPMRXXYWXLNN-UHFFFAOYSA-N 263.250 -0.029 5 10 CBBE CCOC(=O)[C@@H]1CNCCN1c1c([N+](=O)[O-])ncn1C 88673291 PRAOUFWLENNXJQ-QMMMGPOBSA-N 283.288 -0.330 5 10 CBBE CCNC(=O)[C@H]1CNCCN1c1ncccc1[N+](=O)[O-] 89090459 IGZIAQGCTLHOMA-SNVBAGLBSA-N 279.300 -0.096 5 10 CBBE COC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])nc21 96552281 HJBDUELSYSBYSI-UHFFFAOYSA-N 267.197 -0.112 5 10 CBBE NC(=O)[C@@H]1CCCCN1c1ncnc(N)c1[N+](=O)[O-] 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O=C(O)C[C@H]1C(=O)NCCN1c1cc([N+](=O)[O-])ccn1 71241712 JCBCWWWAHBBXTO-QMMMGPOBSA-N 280.240 -0.231 5 10 CBBE CC1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)COC1 83521640 UYSMZQQSJXDHDI-UHFFFAOYSA-N 254.246 -0.056 5 10 CBBE O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@H](O)C1 93089676 OHPWWYFJGPAWOV-PHIMTYICSA-N 282.252 -0.462 5 10 CBBE O=C1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC(=O)N1 97269717 POWGZLCHBIBLIT-UHFFFAOYSA-N 252.186 -0.979 5 10 CBBE O=C1CC[C@H](Nc2nc(C(=O)O)ccc2[N+](=O)[O-])C(=O)N1 166798969 ACTIOOJFGZYBTK-YFKPBYRVSA-N 294.223 -0.095 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCOC[C@H]2C(=O)O)n1 231665131 KBTSBYKCJMQLSM-ZETCQYMHSA-N 256.218 -0.382 5 10 CBBE CC(C)c1nn(C)c(N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 232757221 GCGHNSYWIGKQBG-YUMQZZPRSA-N 270.289 -0.007 5 10 CBBE CNC(=O)CNc1cc(C(=O)O)c([N+](=O)[O-])cn1 234355724 ZBVPIXXQGXOFNJ-UHFFFAOYSA-N 254.202 -0.154 5 10 CBBE COC[C@H](CO)NC(=O)CCn1cnc([N+](=O)[O-])c1 234720459 WCAFLURLMCTBAU-QMMMGPOBSA-N 272.261 -0.695 5 10 CBBE 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IEXJRDIRLGEMFE-SSDOTTSWSA-N 271.277 -0.663 5 10 CBBE CN(C[C@@H]1CNCCO1)c1nccc(N)c1[N+](=O)[O-] 2117177291 SLGLMZNICFWZKP-QMMMGPOBSA-N 267.289 -0.003 5 10 CBBE CN=c1nc(N[C@@]2(CF)CCNC2)c([N+](=O)[O-])c[nH]1 2117354637 AMKWNHQCPLECLS-SNVBAGLBSA-N 270.268 -0.038 5 10 CBBE O=C1NC(=O)[C@H]2CN(Cc3ccc([N+](=O)[O-])o3)C[C@@H]12 2119292181 ZSPJXJOLDBQMDL-OCAPTIKFSA-N 265.225 -0.108 5 10 CBBE N=c1[nH]c(O[C@]2(CCN)CCOC2)ncc1[N+](=O)[O-] 2128253794 AHVRUCUQMYAWTC-SNVBAGLBSA-N 269.261 -0.316 5 10 CBBE C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1CN 2129972424 OEMGAFJVAWPLGH-HTQZYQBOSA-N 267.289 -0.005 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1COC[C@H]1O 2129990280 WMAAIUMWVRUTIL-POYBYMJQSA-N 270.245 -0.935 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@H]2NCC[C@@H]2C1 2132373261 WWHDFIFSLRKZMA-PSASIEDQSA-N 265.273 -0.388 5 10 CBBE Cc1cc(N2C[C@H](O)[C@@H](O)[C@@H]2CO)ccc1[N+](=O)[O-] 2136111102 AMLRBQGSNKDQAZ-SRVKXCTJSA-N 268.269 -0.194 5 10 CBBE Nc1cc(N2C[C@H](O)[C@H](O)[C@@H]2CO)ccc1[N+](=O)[O-] 2136341074 QEFVHXKXPHXXFZ-GARJFASQSA-N 269.257 -0.920 5 10 CBBE NC(=O)C1(N)CN(c2ccc([N+](=O)[O-])cc2CO)C1 2140388201 KXVCXWXNJRTZCA-UHFFFAOYSA-N 266.257 -0.910 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@H]2CO[C@H](CN)C2)[nH]n1C 2142482508 YYQFBKGDRXMWEG-IUCAKERBSA-N 269.305 -0.166 5 10 CBBE Nc1cc(N2CCOC[C@H]2[C@@H](O)CO)cc([N+](=O)[O-])c1 2146332955 DSDIKAHYRHNILP-RYUDHWBXSA-N 283.284 -0.265 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@H](CO)C(F)(F)F)c1[N+](=O)[O-] 2146611946 DPLGBLULGCEMIL-SCSAIBSYSA-N 296.209 -0.264 5 10 CBBE C[C@]1(O)CON(c2ncc(C(=N)NO)cc2[N+](=O)[O-])C1 2149819225 BJLJWAOXJWPKII-SNVBAGLBSA-N 283.244 -0.203 5 10 CBBE Cn1cc([N+](=O)[O-])c(=O)n(Cc2nccnc2Cl)c1=O 2151487742 GGYSVCLTUJFWAF-UHFFFAOYSA-N 297.658 -0.053 5 10 CBBE NS(=O)(=O)c1cn(CCc2cccnn2)nc1[N+](=O)[O-] 2156820873 NYJRBMANMNFINM-UHFFFAOYSA-N 298.284 -0.529 5 10 CBBE COc1nc(N2CCC[C@@](O)(CO)C2)ncc1[N+](=O)[O-] 2157678284 IQGGRXLOEIDSLV-NSHDSACASA-N 284.272 -0.283 5 10 CBBE CN=c1[nH]c(N2CC[C@H]3[C@H](C2)[C@@H]3CO)ncc1[N+](=O)[O-] 2157679486 AKBFGFWTKKSPJP-XHNCKOQMSA-N 279.300 -0.087 5 10 CBBE CN(C)c1nc(O[C@@H]2CCOC[C@H]2N)ncc1[N+](=O)[O-] 2157681442 CHAPSKFGJUPHRF-VXNVDRBHSA-N 283.288 -0.054 5 10 CBBE COc1nc(=NCc2cc(=O)n(C)[nH]2)[nH]cc1[N+](=O)[O-] 2157682797 XDRYILSIWGVAMS-UHFFFAOYSA-N 280.244 -0.546 5 10 CBBE CN(C)c1nc(OCCOC2CNC2)ncc1[N+](=O)[O-] 2157683145 BHWXBTMSMCUSSX-UHFFFAOYSA-N 283.288 -0.182 5 10 CBBE CO[C@@H]1C[C@H](O)CN(c2ncnc(NN)c2[N+](=O)[O-])C1 2165326915 PDLRGZHUKUOZNK-NKWVEPMBSA-N 284.276 -0.744 5 10 CBBE CO[C@]1(CN=c2[nH]cnc(N)c2[N+](=O)[O-])CCCOC1 2166165174 GCTGKOXWBLKPMB-NSHDSACASA-N 283.288 -0.004 5 10 CBBE N[C@@H]1C[C@H](O)CN(c2nccc(C(=O)O)c2[N+](=O)[O-])C1 2168122916 WPTXQHKKKNYKPP-RQJHMYQMSA-N 282.256 -0.414 5 10 CBBE CC(C)[C@H]1C(=O)NCCN1c1ncnc(N)c1[N+](=O)[O-] 2170033199 NFSDTOGYTYWEIZ-ZETCQYMHSA-N 280.288 -0.072 5 10 CBBE CN=c1nc(N2CCN[C@H](CCO)C2)c([N+](=O)[O-])c[nH]1 2173830757 COSXGBSOWNLFOW-MRVPVSSYSA-N 282.304 -0.991 5 10 CBBE CN(c1ncnc(N)c1[N+](=O)[O-])C1(CN)CCOCC1 2173831361 HBWMAZVFJTWXCG-UHFFFAOYSA-N 282.304 -0.089 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CN[C@@]3(CCOC3)C2)[nH]1 2174032231 BIRXHPKYBZTGKQ-HQJQHLMTSA-N 280.288 -0.848 5 10 CBBE COC[C@]1(CN=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])CCCN1 2174032729 IDFOKRRNKSHLTO-LLVKDONJSA-N 282.304 -0.600 5 10 CBBE C[C@H](O)[C@@H](N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 2175197719 YUSVPPAAOPRYPV-XUOSJQGZSA-N 283.240 -0.030 5 10 CBBE CNc1nc[nH]c(=NCCc2nnnn2C)c1[N+](=O)[O-] 2175883864 PHAIYTIYAMVVHY-UHFFFAOYSA-N 279.264 -0.974 5 10 CBBE COc1ncnc(N2CC[C@@H](CO)[C@H](N)C2)c1[N+](=O)[O-] 2178912720 XHCQXFJAYAYUBR-JGVFFNPUSA-N 283.288 -0.461 5 10 CBBE CN(C)S(=O)(=O)c1ncn(-c2ccncc2[N+](=O)[O-])n1 2179130268 OKFCMBDJCQUNSO-UHFFFAOYSA-N 298.284 -0.179 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=NC2CN(CC(F)F)C2)[nH]1 2182321656 OANOYGYDKUTCEY-UHFFFAOYSA-N 289.246 -0.547 5 10 CBBE CN=c1[nH]c(O[C@H]2CNC[C@@H](OC)C2)ncc1[N+](=O)[O-] 2184550107 FEBQNKSZAHMLRI-JGVFFNPUSA-N 283.288 -0.396 5 10 CBBE C[C@@H](O)C[C@H]1COCCN1c1ncnc(N)c1[N+](=O)[O-] 2185302672 HOGIQCBBUXLUOO-SFYZADRCSA-N 283.288 -0.057 5 10 CBBE NC[C@@H]1C[C@H](O)CN1c1ccc([N+](=O)[O-])cc1C(N)=O 2187585710 VOXPFFDRCUKKCF-IUCAKERBSA-N 280.284 -0.408 5 10 CBBE CN=c1[nH]c(NC[C@@]2(CO)CCCO2)ncc1[N+](=O)[O-] 2194013438 DFXFEOWBGLHFLJ-LLVKDONJSA-N 283.288 -0.198 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC2CC([C@H](F)CO)C2)[nH]1 2199128088 UVLDZXOQDZEKDM-KAVNDROISA-N 285.279 -0.209 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)Nc1nc(O)n[nH]1 2199528923 IOPHLGNPTUIYTA-UHFFFAOYSA-N 280.204 -0.649 5 10 CBBE O=C(O)[C@]1(n2ccnc2[N+](=O)[O-])CNCC12CC2 2220595679 FFFKHSVLONUICA-SNVBAGLBSA-N 252.230 -0.045 5 10 CBBE CC(C)n1cc([N+](=O)[O-])c(=N[C@H](CO)[C@@H](C)O)[nH]1 2223033714 XRCZBNLTZNMAPM-HTQZYQBOSA-N 258.278 -0.052 5 10 CBBE CCn1cc([N+](=O)[O-])c(N(C)CC(CO)CO)n1 2223035206 SAZYQICOAUJLBK-UHFFFAOYSA-N 258.278 -0.152 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2CCC[C@H](O)[C@@H]2O)[nH]n1C 2224335429 KMHZVIHCPPQDSP-KHQFGBGNSA-N 270.289 -0.255 5 10 CBBE CCOC(=O)[C@H](O)CNCc1nn(C)cc1[N+](=O)[O-] 2231916707 VLEWUTOSFXIWEA-SECBINFHSA-N 272.261 -0.658 5 10 CBBE CO[C@H]1[C@H](COc2ncc([N+](=O)[O-])cn2)NC[C@H]1OC 2233518477 WEHAIPSBFYZYIJ-AEJSXWLSSA-N 284.272 -0.235 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(ON2C[C@@H](N)CC2=O)c1 2241037626 SMXHPSLXYJMPQP-ZETCQYMHSA-N 280.240 -0.453 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1C[C@]12C[C@H]2C(=O)O 2256159431 CIEWVQHSYQPSFB-ZDEZVYLVSA-N 253.218 -0.580 5 10 CBBE CCn1cc([N+](=O)[O-])c(OC2(CN)CS(=O)(=O)C2)n1 2267843534 LLDHCHKDQLQTHQ-UHFFFAOYSA-N 290.301 -0.684 5 10 CBBE NC(=O)c1nc(CN=c2cccc([N+](=O)[O-])[nH]2)no1 2270193622 HIBJFWJWPMDRHU-UHFFFAOYSA-N 264.201 -0.494 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]1[C@@H](O)CO 2270711092 OQQJVLZICANFDH-WPRPVWTQSA-N 269.257 -0.499 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H](O)[C@@H](O)CC1 2284581706 AEMLMSDWZFCZRX-UWVGGRQHSA-N 284.272 -0.865 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=N[C@@H]3COCC[C@@H]3O)[nH]c12 2295919898 VEPZJCPXPZCAIH-APPZFPTMSA-N 279.256 -0.379 5 10 CBBE C[N+](C)(C)CCNC(=O)CCC(=O)NCC[N+](C)(C)C 3151461 STRCEPVKYIFIRY-UHFFFAOYSA-P 288.436 -0.589 5 10 CBBE C[C@@](O)(CNC(=O)Cn1ccc([N+](=O)[O-])n1)CC(=O)O 91522333 RCURIJNQARWHTJ-JTQLQIEISA-N 286.244 -0.867 5 10 CBBE CCCc1noc(Cn2cc([N+](=O)[O-])c(=O)[nH]c2=O)n1 113593422 UOSUYCQXUCRSMW-UHFFFAOYSA-N 281.228 -0.171 5 10 CBBE NNc1ncnc(N[C@H]2CCS(=O)(=O)C2)c1[N+](=O)[O-] 124950157 HILGGPNDAIXZFW-YFKPBYRVSA-N 288.289 -0.731 5 10 CBBE C[C@@H]([C@@H](C)O)S(=O)(=O)CCn1cc([N+](=O)[O-])cn1 178741506 GHPYAACVSMSPIP-SFYZADRCSA-N 277.302 -0.025 5 10 CBBE NS(=O)(=O)c1cn([C@@H]2CCCOC2)nc1[N+](=O)[O-] 225384528 ARJJTUORYMHGLY-ZCFIWIBFSA-N 276.274 -0.210 5 10 CBBE Cc1cc(C(=O)NC(CO)(CO)CO)ccc1[N+](=O)[O-] 235749256 VSVMMLHAVJNUGA-UHFFFAOYSA-N 284.268 -0.651 5 10 CBBE CNc1cnc([N+](=O)[O-])cc1C(=O)NCCNC(C)=O 312225361 HIOTXDNSOVPMIK-UHFFFAOYSA-N 281.272 -0.103 5 10 CBBE COC[C@@](C)(CO)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 611599939 SPOWVBOSCGKIMM-LLVKDONJSA-N 284.272 -0.069 5 10 CBBE C[C@@H]1[C@@H]2CNC[C@@H]2CN1C(=O)Cn1cc([N+](=O)[O-])cn1 702051445 JXTDQSFPJZRQKR-KKZNHRDASA-N 279.300 -0.142 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N[C@H]1COCC[C@@H]1O 710981323 BBKVGGZRIKRWOW-IUCAKERBSA-N 284.272 -0.553 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1C[C@@H]1C(=O)O 715294832 ILKHXKIXVPPADX-XPUUQOCRSA-N 268.229 -0.372 5 10 CBBE COC[C@@](C)(CO)Nc1ncnc(NN)c1[N+](=O)[O-] 716949323 LQQKCLQKKBDJHW-SECBINFHSA-N 272.265 -0.520 5 10 CBBE CNc1ncnc(N2CCN(C(N)=O)CC2)c1[N+](=O)[O-] 722193028 GOWKNOGGTUPLPZ-UHFFFAOYSA-N 281.276 -0.373 5 10 CBBE O=C(CO)N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O 725438630 UOGAAQWEBJJSAT-SECBINFHSA-N 268.225 -0.301 5 10 CBBE CN1C[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 764738938 ZYIOEUWKYFMPDB-SECBINFHSA-N 282.256 -0.045 5 10 CBBE CN1C(=O)CN=C1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 1149338956 DRYSSMJJTJBENK-UHFFFAOYSA-N 294.271 -0.529 5 10 CBBE CCn1ncc(Cn2ccc(N)c([N+](=O)[O-])c2=O)n1 1189719687 DHGBCGUIUPCJNY-UHFFFAOYSA-N 264.245 -0.002 5 10 CBBE O=C1C[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CN1 1598421296 OOSNSMXPQHRYKG-KWQFWETISA-N 279.252 -0.367 5 10 CBBE COC(=O)N1CC(C)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1634846173 FHARZERRXQEYMI-RNFRBKRXSA-N 257.246 -0.392 5 10 CBBE COC(=O)NCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1640711770 GRUSCQOAVQRNMO-UHFFFAOYSA-N 271.233 -0.288 5 10 CBBE Cc1nn(C)c(N2CC3(C[C@H](O)CNC3=O)C2)c1[N+](=O)[O-] 1643186880 HCBIDKJYTGZJAU-QMMMGPOBSA-N 295.299 -0.676 5 10 CBBE C[C@H]1CCNC(=O)[C@@H]1NCc1cn(C)nc1[N+](=O)[O-] 1645410033 USSCBHMYQXXWEP-IONNQARKSA-N 267.289 -0.058 5 10 CBBE O=C(N1CC([N+](=O)[O-])C1)N1CC[C@]2(C(=O)O)C[C@H]2C1 1876165862 TUFYAEGSABQJKM-CPCISQLKSA-N 269.257 -0.136 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NC[C@@H]2NC[C@H]3C[C@H]32)c1[N+](=O)[O-] 1905947532 RDWOYZBONYAINT-PRJMDXOYSA-N 264.289 -0.453 5 10 CBBE Nc1cccc(NCC(O)(CO)CO)c1[N+](=O)[O-] 1913793197 BKRMPGXBHOPBTQ-UHFFFAOYSA-N 257.246 -0.695 5 10 CBBE CO[C@]1(CO)CCN(c2c([N+](=O)[O-])cnn2C)C1 1916431505 SVXBSQJZNOPVOG-SNVBAGLBSA-N 256.262 -0.084 5 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267.289 -0.014 5 10 CBBE O=C1NCCN(c2ncnc(F)c2[N+](=O)[O-])C12CC2 2132027409 HMMUZKRKPKEOFR-UHFFFAOYSA-N 267.220 -0.007 5 10 CBBE Cc1cnc(N2C[C@H](O)[C@H](O)[C@@H]2CO)cc1[N+](=O)[O-] 2136112600 JBPFTWKPGZUUGE-ATZCPNFKSA-N 269.257 -0.799 5 10 CBBE O=[N+]([O-])c1ccnc(NS(=O)(=O)N2CC[C@@H](O)C2)c1 2137724356 ZFLBRRCUOILNNK-MRVPVSSYSA-N 288.285 -0.287 5 10 CBBE O=[N+]([O-])c1cnc(Cl)nc1N1C[C@H](O)[C@@H](O)[C@@H]1CF 2140697526 YLBYOYWGMMBTQV-QTSITTDLSA-N 292.654 -0.082 5 10 CBBE Cc1c([N+](=O)[O-])c(O[C@]2(C(N)=O)CCNC2)nn1C 2142487291 SUKZOIGAZGMOIP-SNVBAGLBSA-N 269.261 -0.767 5 10 CBBE COCCN1CC[C@](C(=O)O)(n2ccnc2[N+](=O)[O-])C1 2144978079 XQJNTNVJBUWJBR-NSHDSACASA-N 284.272 -0.077 5 10 CBBE CN(C)[C@H]1CN(c2cc(NN)cc([N+](=O)[O-])c2)C[C@@H]1O 2146153677 LXGRVKZRQCFJMF-RYUDHWBXSA-N 281.316 -0.009 5 10 CBBE CCN=c1nc(N(C)[C@H](C)CC(N)=O)c([N+](=O)[O-])c[nH]1 2151340892 RZHBFZKTFMTODE-SSDOTTSWSA-N 282.304 -0.061 5 10 CBBE CN=c1[nH]c(N(C)C[C@H](COC)OC)ncc1[N+](=O)[O-] 2157683239 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Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1CCC[C@H](C(=O)O)O1 2193751788 BQSPNVKSVCUVRW-NKWVEPMBSA-N 285.260 -0.421 5 10 CBBE NS(=O)(=O)CC1CN(C(=O)c2cccc([N+](=O)[O-])c2)C1 2194424023 KKWQMLQCXLZVGH-UHFFFAOYSA-N 299.308 -0.045 5 10 CBBE CCn1nnc(CN=c2[nH]cnc(NC)c2[N+](=O)[O-])n1 2197854443 ARFXNRQJWAUMBL-UHFFFAOYSA-N 279.264 -0.533 5 10 CBBE CC1(C)OC[C@H](N=c2[nH]c(NN)ncc2[N+](=O)[O-])[C@@H]1O 2199459023 AIUPFYMOTGTUTE-FSPLSTOPSA-N 284.276 -0.958 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H](O)C[C@H]1CO 2200819708 FANOPNQCTGPCKF-WDEREUQCSA-N 284.316 -0.083 5 10 CBBE Cc1ccc(CN2C[C@H](O)[C@H](O)[C@@H]2CO)cc1[N+](=O)[O-] 2200862962 XDZTXCJLDOEOOQ-RWMBFGLXSA-N 282.296 -0.198 5 10 CBBE Cc1c(NC(=O)[C@@H]2NC[C@@H](O)[C@H]2O)cccc1[N+](=O)[O-] 2201150303 SCLYAAQJOAZICT-GMTAPVOTSA-N 281.268 -0.465 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NC[C@@H]2[C@H]3CCNC[C@H]32)c1[N+](=O)[O-] 2203644001 LHCJCSXPONPLSO-DJLDLDEBSA-N 278.316 -0.205 5 10 CBBE C[C@@H](O)CN(C[C@@H](C)O)c1ncncc1[N+](=O)[O-] 2219806170 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CCCn1nc(C)c([N+](=O)[O-])c1NC(CN)(CO)CO 2280513726 INMVYTDDUQNXLE-UHFFFAOYSA-N 287.320 -0.396 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]2[C@H](O)CO)c1 2286224170 HGHYTTUGPQTMSS-MWLCHTKSSA-N 281.268 -0.374 5 10 CBBE Nc1ncnc(N2C[C@@H]3C[C@@H](O)[C@H]2C3)c1[N+](=O)[O-] 2309930997 OKZVMRUVSWIQQH-RRKCRQDMSA-N 251.246 -0.074 5 10 CBBE CCO[C@@H]1C[C@@H](N)[C@@H]1N=c1nc([N+](=O)[O-])n(C)[nH]1 2321746099 CMYARRZENVEGTD-QYNIQEEDSA-N 256.266 -0.938 5 10 CBBE C[C@@]1(N)CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)CC1(F)F 2336779200 VMTABVROKYPHOF-MRVPVSSYSA-N 274.231 -0.030 5 10 CBBE CCN1CC(CN=c2[nH]c(=NC)[nH]cc2[N+](=O)[O-])C1 2342690205 IBUGNJJMVNPXFJ-UHFFFAOYSA-N 266.305 -0.366 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]3NCCO[C@H]3C2)[nH]1 2342934213 VMTBQLJCDOCEBE-WEDXCCLWSA-N 267.289 -0.319 5 10 CBBE COC(=O)[C@H](N)CS(=O)(=O)c1ccccc1[N+](=O)[O-] 2343421875 ANAJRHMOVKYMCP-SSDOTTSWSA-N 288.281 -0.131 5 10 CBBE Cc1ccc([N+](=O)[O-])c(NC(CO)(CO)C(=O)O)n1 2344085124 UBAVVXMVXCSEKX-UHFFFAOYSA-N 271.229 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-0.343 5 10 CBBE COc1ccc(C(=O)NC[C@H]2CNC[C@@H]2O)cc1[N+](=O)[O-] 262320191 RFBKMLOMSMVWKT-KOLCDFICSA-N 295.295 -0.087 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](N)CO 311168915 RPXNZHNZEJSJMG-ZCFIWIBFSA-N 255.230 -0.608 5 10 CBBE CO[C@H]1C[C@@H](CO)N(c2nc(N)nc(C)c2[N+](=O)[O-])C1 312592152 XDIDENSBIJZBIT-YUMQZZPRSA-N 283.288 -0.139 5 10 CBBE CNc1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](CO)C2)n1 316658869 FGPILZYKXCTGFF-APPZFPTMSA-N 268.273 -0.179 5 10 CBBE CNc1cnc([N+](=O)[O-])cc1C(=O)N[C@H]1COC[C@@H]1O 323188689 GZAIMTCHJGEMCH-IUCAKERBSA-N 282.256 -0.479 5 10 CBBE N[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C1CC1)C(=O)O 323379359 HAFMEIPNBUNTTK-QMMMGPOBSA-N 282.256 -0.127 5 10 CBBE O=[N+]([O-])c1cnc2ccc(NCCCOCCO)nn12 355577003 QKLIVLFOIPWZIV-UHFFFAOYSA-N 281.272 0.448 5 10 CBBE CCOC(=O)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 597680485 DYWBPDIMOYIUSP-SSDOTTSWSA-N 285.256 -0.033 5 10 CBBE O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CNC[C@@H]1O 700007722 UPTDWOYYRMWTFL-QWRGUYRKSA-N 265.269 -0.414 5 10 CBBE CN(CC(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1COC[C@H]1O 708050576 JHWCOXOBBHBOMO-MWLCHTKSSA-N 269.257 -0.203 5 10 CBBE CN(C)C[C@@H](O)CNc1ncnc(F)c1[N+](=O)[O-] 717309541 CGXDYKQHECIANJ-LURJTMIESA-N 259.241 -0.142 5 10 CBBE C[C@@H](O)[C@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 717357525 WWOUIJGDROMZIB-LDYMZIIASA-N 284.268 -0.169 5 10 CBBE C[C@H](O)[C@H](O)CNC(=O)COc1cccc([N+](=O)[O-])c1 717363012 BZCXNVYDXBNVNU-GZMMTYOYSA-N 284.268 -0.169 5 10 CBBE C[C@H](O)C1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 719891095 POWBZAHWZSZOEC-ZETCQYMHSA-N 254.246 -0.370 5 10 CBBE CC1(C)CNC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 721903728 KZWBEXRUMGVHJO-QMMMGPOBSA-N 267.289 -0.095 5 10 CBBE CC(=O)N[C@@H](C)C(=O)Nc1c([N+](=O)[O-])cnn1C 1128222956 RRUIWOXMVCPXPK-YFKPBYRVSA-N 255.234 -0.209 5 10 CBBE O=C1NN=C[C@@H]1CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1149263772 XMVAZTXHRFFLEV-XLPZGREQSA-N 254.246 -0.720 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN[C@]1(C(N)=O)CCOC1 1195559472 UDADJNPAMFYQER-LLVKDONJSA-N 283.288 -0.666 5 10 CBBE Cn1nncc1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1307285178 SMTAOPYACPNGLT-UHFFFAOYSA-N 278.228 -0.968 5 10 CBBE CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H]1CCNC1=O 1321668737 RYZXYMMMTUHAGB-SSDOTTSWSA-N 281.272 -0.321 5 10 CBBE CC(C)(CCC(=O)NCCN1C(=O)CNC1=O)[N+](=O)[O-] 1360221183 IETVGNXRHFMAFR-UHFFFAOYSA-N 286.288 -0.510 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N[C@]2(C(N)=O)CCOC2)n1 1631309943 IPYYPCOHJVFNGA-GFCCVEGCSA-N 294.267 -0.328 5 10 CBBE Cc1nn(C)c(N2CC3(C[C@@H](O)CNC3=O)C2)c1[N+](=O)[O-] 1643186872 HCBIDKJYTGZJAU-MRVPVSSYSA-N 295.299 -0.676 5 10 CBBE O=C(CC1(O)CCC1)NCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1686996070 PJBPDFWQMRZBDK-NXEZZACHSA-N 299.327 -0.421 5 10 CBBE NCC(=O)NCC(=O)Nc1ccc([N+](=O)[O-])cc1N 1866015261 XGTCTYYETYFCGN-UHFFFAOYSA-N 267.245 -0.810 5 10 CBBE NC(=O)CC[C@H](N)C(=O)Nc1ncc([N+](=O)[O-])s1 1866104455 OQPJXJZCZJTKKK-BYPYZUCNSA-N 273.274 -0.417 5 10 CBBE N=c1[nH]c(N[C@@H]2CCOC[C@H]2CO)ncc1[N+](=O)[O-] 1878768127 BHNSJIVLHQGLPS-RNFRBKRXSA-N 269.261 -0.393 5 10 CBBE 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-0.497 5 10 CBBE COc1ncnc(N[C@@H]2COC[C@H]2C(=O)O)c1[N+](=O)[O-] 94738504 JLYQQAPVLZVUCD-PHDIDXHHSA-N 284.228 -0.095 5 10 CBBE NNc1cccc(N2CCN(CCO)CC2)c1[N+](=O)[O-] 159126905 LJPRFXXAFRANKD-UHFFFAOYSA-N 281.316 -0.005 5 10 CBBE NNc1ncnc(N2CCCC[C@H]2C(N)=O)c1[N+](=O)[O-] 159611679 KVFUPHFQESALJI-LURJTMIESA-N 281.276 -0.485 5 10 CBBE COC[C@@H](O)CCNc1nc(NN)nc(C)c1[N+](=O)[O-] 230194017 SMQBSSDXCKVJAA-ZETCQYMHSA-N 286.292 -0.212 5 10 CBBE C[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])C[C@@H](CO)O1 231673080 GBLVLHYUBYLHIK-SFYZADRCSA-N 256.262 -0.086 5 10 CBBE C[C@@H](NC(=O)c1cc(N)ncc1[N+](=O)[O-])c1nn[nH]n1 235203984 NOGIPYPYYWFXMU-SCSAIBSYSA-N 278.232 -0.424 5 10 CBBE CCCc1[nH]nc(C(=O)NC[C@@H]2CNC[C@@H]2O)c1[N+](=O)[O-] 262133226 GRCBGSXRMXTAJK-CBAPKCEASA-N 297.315 -0.420 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC(=O)N(CC3CC3)C2)n1 279563839 UHFGTCCPNTWZMR-UHFFFAOYSA-N 293.283 -0.020 5 10 CBBE O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](n2cncn2)C1 372472601 IWHRJDHXCHFUEM-DJLDLDEBSA-N 251.246 -0.283 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)NC2(CO)CC2)nc1 595317907 GJGCGNCAOTXWSF-UHFFFAOYSA-N 273.270 -0.207 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@]2(O)C[C@H]2C1 598227494 XYPUXPNKBMYGHB-GZMMTYOYSA-N 266.257 -0.225 5 10 CBBE Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC2(CO)CC2)n1 599281627 GTBQNWQMKSPMCB-UHFFFAOYSA-N 276.274 -0.869 5 10 CBBE O=C1NCC[C@@H]1NS(=O)(=O)c1cncc([N+](=O)[O-])c1 699069876 ZYCGYPNRJONCEU-QMMMGPOBSA-N 286.269 -0.843 5 10 CBBE O=C(O)c1nn(CCn2cnnn2)cc1[N+](=O)[O-] 712567864 ADRIRHFCGZHOGR-UHFFFAOYSA-N 253.178 -0.824 5 10 CBBE COC(=O)[C@H](CN)Oc1ccnc(O)c1[N+](=O)[O-] 715449465 UAXGHGOSJMWMDX-LURJTMIESA-N 257.202 -0.426 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)OC[C@H]1COCCO1 766631576 HTZHIAVXUSHERG-SSDOTTSWSA-N 271.229 -0.100 5 10 CBBE CON(C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 849409760 DRSXACBPYVDUTO-UHFFFAOYSA-N 290.301 -0.239 5 10 CBBE NC(=O)C12CCC(CC1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1134425062 YMVJELOXXQFDME-YFHNAJJPSA-N 253.258 -0.340 5 10 CBBE CNC(=O)[C@@H]1CCCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 1319658609 XHMSZWKIGGJHNZ-MRVPVSSYSA-N 295.299 -0.074 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)O[C@H]1CNOC1 1323326791 GDKVKOQDXLZGDP-ZETCQYMHSA-N 269.213 -0.797 5 10 CBBE C[C@@H]1OC(=O)N[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 1545542903 IATDVQHYQYPUIK-POYBYMJQSA-N 283.244 -0.596 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NCC(=O)N1CCCO1 1640071513 LTTOHKZXAJLRTP-UHFFFAOYSA-N 255.234 -0.096 5 10 CBBE O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(Cc2ncccn2)CC1 1642855983 JODCMEZTLLPJLV-GHMZBOCLSA-N 291.311 -0.214 5 10 CBBE CCN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC(=O)N1CCC1 1713484311 CLVTVESYMSCLJW-GHMZBOCLSA-N 298.343 -0.678 5 10 CBBE Nc1cccc(N2CC(CO)(CO)C2)c1[N+](=O)[O-] 1914981585 GNJNBAGYRRDCAV-UHFFFAOYSA-N 253.258 -0.032 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1COC[C@@H]1O 1917267488 ZNLLAIPKAQPITE-UWVGGRQHSA-N 267.241 -0.135 5 10 CBBE C[C@H](Nc1ccc([N+](=O)[O-])cc1C(N)=O)[C@H](O)CO 1917268476 LGBCFEIUPRFUEM-QUBYGPBYSA-N 269.257 -0.153 5 10 CBBE C[C@H](O)[C@@H]1CN(Cc2nn(C)cc2[N+](=O)[O-])CCO1 1964167393 SUMHWRJXYTWABU-KWQFWETISA-N 270.289 -0.090 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@H](N)[C@@H]2COC[C@H]21 1968114872 NOYVIUMGQPIROO-BIIVOSGPSA-N 253.262 -0.509 5 10 CBBE O=[N+]([O-])c1c(N2C[C@H](O)C[C@@H](O)C2)ccnc1O 2043182679 SRMSQQWUBWTJBZ-RNFRBKRXSA-N 255.230 -0.373 5 10 CBBE O=C1CNCCN1CCOc1ncc([N+](=O)[O-])s1 2051435571 KOOCZAQKETXELW-UHFFFAOYSA-N 272.286 -0.138 5 10 CBBE CN(c1ncnc(N)c1[N+](=O)[O-])C1[C@@H]2CNC[C@@H]12 2053499241 KEYXQGXRNFTMGD-PHDIDXHHSA-N 250.262 -0.379 5 10 CBBE N=c1ccc([N+](=O)[O-])c(NC[C@@H]2COCCN2)[nH]1 2053685040 HVVBCCORYDQBID-SSDOTTSWSA-N 253.262 -0.197 5 10 CBBE CN(C)CCNCCOc1c([N+](=O)[O-])cnn1C 2056222410 OQMPMMRYPKKAEH-UHFFFAOYSA-N 257.294 -0.142 5 10 CBBE Cc1[nH]ccc(=NC[C@H](C)S(N)(=O)=O)c1[N+](=O)[O-] 2063423277 JHCALORUOIWNHT-LURJTMIESA-N 274.302 -0.191 5 10 CBBE COC(=O)[C@H]1CC[C@@H](Cn2cnc([N+](=O)[O-])n2)O1 2064954728 IYAGZNOINMCUDA-NKWVEPMBSA-N 256.218 -0.093 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCCn2cnnc2)[nH]n1C 2086313754 XXLFHZUPQUYWFX-UHFFFAOYSA-N 251.250 -0.238 5 10 CBBE C[C@@H](N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-])C1CS(=O)(=O)C1 2089872841 RHMMCGBZGJLZKH-RXMQYKEDSA-N 287.301 -0.936 5 10 CBBE NNc1ncnc(N[C@H]2COC[C@H]2CO)c1[N+](=O)[O-] 2090328972 SCDJQQQWDDVVAJ-RITPCOANSA-N 270.249 -0.910 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1C[C@@H](O)[C@@H]1CCCNC1 2096027602 WWUKGNBLURUDHR-PSASIEDQSA-N 268.273 -0.488 5 10 CBBE COC[C@@H](Nc1nc(OC)ccc1[N+](=O)[O-])C(N)=O 2096063133 QIUHRASAPQETNK-ZCFIWIBFSA-N 270.245 -0.089 5 10 CBBE Nc1ccnc(N2C[C@H](O)[C@H]3COC[C@@H]32)c1[N+](=O)[O-] 2102181913 SHPQERGAEWNEQE-XVYDVKMFSA-N 266.257 -0.232 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1CNC(C)(C)CO1 2109337612 MFWADBDWAUPHSG-SSDOTTSWSA-N 270.293 -0.676 5 10 CBBE N=c1nc(N2CC(=O)N[C@H]3CC[C@H]32)c([N+](=O)[O-])c[nH]1 2112060179 CQJCFGTYRZYBFP-NTSWFWBYSA-N 264.245 -0.735 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OCCCN1CCNCC1 2113620173 RSMUPOICLYMAHT-UHFFFAOYSA-N 270.293 -0.603 5 10 CBBE CN=c1[nH]c(N2C[C@H](C)[C@H](CN)C2)ncc1[N+](=O)[O-] 2117181374 SGOIITJENDOOFB-JGVFFNPUSA-N 266.305 -0.121 5 10 CBBE N=c1nc(N2CCCN(C=O)CC2)c([N+](=O)[O-])c[nH]1 2117210632 CGBNERRKUGZEAW-UHFFFAOYSA-N 266.261 -0.534 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@H](C)CNC)[nH]1 2117361758 UIAXPSFAEGCPCO-ZETCQYMHSA-N 268.321 -0.154 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2CN[C@@H](C)C2)[nH]1 2117365820 PUMSAEJMKHBHPV-JGVFFNPUSA-N 266.305 -0.320 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN[C@H]2CCO[C@H]2C(N)=O)n1 2117475934 RVOROFLWWXBGMG-IMTBSYHQSA-N 269.261 -0.939 5 10 CBBE O=[N+]([O-])c1cc(CN[C@@H]2C[C@H](CO)[C@H](O)[C@@H]2O)cs1 2121469126 SHJFPYVEDIWRSL-DEKFOEGESA-N 288.325 -0.152 5 10 CBBE O=[N+]([O-])c1ccc(N2CC3(C2)OC[C@H](O)[C@@H]3O)cn1 2127331398 VPLLDVIKDKYPNV-WPRPVWTQSA-N 267.241 -0.699 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@@H](O)C[C@H]2CN)c1[N+](=O)[O-] 2131038323 VWGPYVNSSHBWDC-BQBZGAKWSA-N 268.277 -0.996 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H]2CNC[C@@H]21 2132375126 NIBDVCQNLWDGGT-IUCAKERBSA-N 265.273 -0.388 5 10 CBBE Cn1c(C(=O)NC2([C@H](O)CO)CC2)ccc1[N+](=O)[O-] 2133593789 HUSJSUWFOWQITO-MRVPVSSYSA-N 269.257 -0.451 5 10 CBBE C[C@@H]1OCCN[C@H]1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2137716193 LLPVNFSCFWLOBS-OIBJUYFYSA-N 266.257 -0.273 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1NCC1[C@H]2CNC[C@H]12 2143625475 KIJNIBXBTIHIGO-IUCAKERBSA-N 277.284 -0.034 5 10 CBBE CCN=c1nc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2146871659 IXRNJJAYZFXDJV-BRPSZJMVSA-N 279.300 -0.087 5 10 CBBE CCN=c1nc(N=c2nc(C)n(C)[nH]2)c([N+](=O)[O-])c[nH]1 2146938309 VIIOBICOVBPTTK-UHFFFAOYSA-N 278.276 -0.159 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2CC[C@H]3[C@H](C2)[C@@H]3CO)n1 2149507136 WWOBGTAPRXMIHY-BIIVOSGPSA-N 280.288 -0.265 5 10 CBBE N[C@@H]1COC[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 2149988390 NUWKFCXBUNLTOL-GHMZBOCLSA-N 281.268 -0.184 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)n1 2159111342 NARZRLQOURDZDO-OIBJUYFYSA-N 284.272 -0.404 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@@H]2CCO[C@@]2(C(=O)O)C1 2159186126 XNJPLECNJGAJEV-WKEGUHRASA-N 283.244 -0.597 5 10 CBBE O=C(O)[C@H]1C=CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 2159773001 WJCNBEJEQMYTSV-QMMMGPOBSA-N 280.240 -0.110 5 10 CBBE Nc1ccnc(N2CC(N3CCNCC3)C2)c1[N+](=O)[O-] 2173820233 JUNOZZWHUKJIAX-UHFFFAOYSA-N 278.316 -0.334 5 10 CBBE COc1ncnc(N2CCO[C@H]([C@@H](C)O)C2)c1[N+](=O)[O-] 2174148217 CLKVUQJJECCUNV-SFYZADRCSA-N 284.272 -0.021 5 10 CBBE CC1(C)CNC(=O)CN1c1cc([N+](=O)[O-])cc(NN)n1 2175707339 UAQOGWPNPXECRM-UHFFFAOYSA-N 280.288 -0.010 5 10 CBBE COc1cc(NCC(CO)(CO)CO)ccc1[N+](=O)[O-] 2179738350 PYCWVQNNBOKFAF-UHFFFAOYSA-N 286.284 -0.021 5 10 CBBE COc1ncnc(N2CCC[C@H]2[C@@H](O)CO)c1[N+](=O)[O-] 2179742138 GIYWSFLSLQNHRZ-YUMQZZPRSA-N 284.272 -0.285 5 10 CBBE COC(=O)[C@H]1C[C@@H](Oc2nccc(N)c2[N+](=O)[O-])CN1 2184552359 OOMGXCHOPRZSSH-HTRCEHHLSA-N 282.256 -0.146 5 10 CBBE NC(=O)c1ccc(N2CC[C@H](O)[C@H](O)C2)cc1[N+](=O)[O-] 2188671015 CGMYHJCGKYPULW-WDEREUQCSA-N 281.268 -0.374 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC[C@@H]1CCNC1=O 2200820075 GVHCZDJESBMGDZ-QMMMGPOBSA-N 281.272 -0.566 5 10 CBBE Cc1cc(F)c(CNC(C(N)=O)C(N)=O)cc1[N+](=O)[O-] 2202066965 CPWHVGTZKKDRSW-UHFFFAOYSA-N 284.247 -0.529 5 10 CBBE O=C(O)C1(c2ncncc2[N+](=O)[O-])CS(=O)(=O)C1 2219801088 APDSMJFFTSTVCF-UHFFFAOYSA-N 273.226 -0.864 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N[C@H](CO)C(=O)OC 2223799297 HWAOJPRZCPRGND-ZCFIWIBFSA-N 258.234 -0.243 5 10 CBBE CNC1(C(=O)NCc2nn(C)cc2[N+](=O)[O-])CC1 2223851803 CFLAHAZZJOVIKU-UHFFFAOYSA-N 253.262 -0.304 5 10 CBBE COC(=O)[C@@H]1COCCN1c1ncncc1[N+](=O)[O-] 2226998288 HILYVPLRZZFFSP-QMMMGPOBSA-N 268.229 -0.237 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N[C@@H]1CS(=O)(=O)C[C@@H]1O 2231882046 QACFWMNEBJNVJE-SVRRBLITSA-N 290.301 -0.619 5 10 CBBE NCCOCCOCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 2233850052 JVFZDMCDLXCILL-UHFFFAOYSA-N 286.288 -0.355 5 10 CBBE NCCCN1CCN(c2nc(F)ncc2[N+](=O)[O-])CC1 2234459199 MJEYAIVPZCGOBN-UHFFFAOYSA-N 284.295 -0.005 5 10 CBBE O=c1cc[nH]c(CN=c2[nH]cnc(F)c2[N+](=O)[O-])c1O 2239307879 CJAUHISGKWGBSN-UHFFFAOYSA-N 281.203 -0.048 5 10 CBBE N=c1nc(N2C[C@@H]3CCO[C@@]3(CO)C2)c([N+](=O)[O-])c[nH]1 2239832417 TXHJRBRJVZTZSU-WRWORJQWSA-N 281.272 -0.615 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1C[C@@H](N)C[C@@H](C(N)=O)C1 2240562741 CDLLARTZNXCVDH-SFYZADRCSA-N 282.304 -0.550 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)C2=NNC(=O)CC2)n1 2240633022 CHRUEXZWRROJLM-UHFFFAOYSA-N 280.244 -0.790 5 10 CBBE O=C(O)[C@@H]1C[C@@]12C[C@@H]2NC(=O)N1CC([N+](=O)[O-])C1 2256149840 NTERFQMAPDFYNX-MHYGZLNHSA-N 255.230 -0.480 5 10 CBBE CN=c1[nH]c(N(C)CC2COC2)ncc1[N+](=O)[O-] 2257528181 OQGRWXQMEOEGFC-UHFFFAOYSA-N 253.262 -0.069 5 10 CBBE Cc1[nH]c(=NCC(N)(CO)CO)c(Cl)cc1[N+](=O)[O-] 2270655592 WVXOKASOUPXKRC-UHFFFAOYSA-N 290.707 -0.532 5 10 CBBE Nc1ncnc(N[C@H]2COC3(COC3)C2)c1[N+](=O)[O-] 2270782964 FGXDSRARNYAGTF-ZCFIWIBFSA-N 267.245 -0.063 5 10 CBBE CCOC(=O)CN=c1[nH]c(COC)ncc1[N+](=O)[O-] 2271091610 QOBDXRRNACFSBT-UHFFFAOYSA-N 270.245 -0.072 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2CCOC3(CNC3)C2)n1 2272929405 HUDRTCPILJTTFI-UHFFFAOYSA-N 265.273 -0.128 5 10 CBBE COC(=O)N[C@@H](C)CN=c1[nH]cc([N+](=O)[O-])c(=N)[nH]1 2274613233 SEGLOUWWLSHYPP-YFKPBYRVSA-N 270.249 -0.624 5 10 CBBE CN(C)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cn1 2278160903 CJCDRYZDVGYKLZ-VIFPVBQESA-N 268.273 -0.358 5 10 CBBE C[C@H](O)CN(CCN)c1nc(C(=O)O)ccc1[N+](=O)[O-] 2285357292 OIOGRXRVFCCSQU-ZETCQYMHSA-N 284.272 -0.166 5 10 CBBE O=C(O)C(N=c1[nH]c(C2CC2)ncc1[N+](=O)[O-])C(=O)O 2286636135 KEFYMLSJMBFOMU-UHFFFAOYSA-N 282.212 -0.366 5 10 CBBE CCc1nn[nH]c1CN=c1[nH]c(=N)[nH]c(C)c1[N+](=O)[O-] 2290364058 WZONUKOLSFABOM-UHFFFAOYSA-N 278.276 -0.180 5 10 CBBE C[C@@H](O)[C@@H]1C[C@@H]1N=c1[nH]c(NN)ncc1[N+](=O)[O-] 2310399043 OBSHNTYUSVSBTO-SRQIZXRXSA-N 254.250 -0.727 5 10 CBBE Cn1[nH]c(=N[C@@H]2CC[C@@H]3CNC[C@H]32)nc1[N+](=O)[O-] 2321760237 CLHQOKRJWHGAOL-BWZBUEFSSA-N 252.278 -0.445 5 10 CBBE O=[N+]([O-])c1ccc(CN2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)nc1 2329325383 FENRAPLZFJOTBZ-CWPPHPDTSA-N 265.269 -0.084 5 10 CBBE Nc1cc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)ncc1[N+](=O)[O-] 2329701849 OHWUGGCPGOMYKP-ICERDWBASA-N 266.257 -0.498 5 10 CBBE NC[C@H](O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O 35328683 DAABPKXMCGKRAN-QMMMGPOBSA-N 264.241 -0.376 5 10 CBBE NC(=O)[C@@H]1CNCCN1Cc1csc([N+](=O)[O-])c1 88659677 HXBUOEBEDWFALS-QMMMGPOBSA-N 270.314 -0.085 5 10 CBBE NNc1c(C(=O)NCC(N)=O)cccc1[N+](=O)[O-] 156673434 MWTGVHSLFOHYHQ-UHFFFAOYSA-N 253.218 -0.905 5 10 CBBE C[C@H](CC(N)=O)NC(=O)c1ccc(NN)c([N+](=O)[O-])c1 157133467 PCQKTHUTWWYABS-ZCFIWIBFSA-N 281.272 -0.126 5 10 CBBE CC[C@H]1C(=O)NC(=O)CN1c1nc(NN)ccc1[N+](=O)[O-] 161134882 CQQROPYTSMDZSY-LURJTMIESA-N 294.271 -0.483 5 10 CBBE Cc1cc(=O)n(C[C@@H](O)CC(=O)O)cc1[N+](=O)[O-] 166915340 OEHREEMORRKGIM-ZETCQYMHSA-N 256.214 -0.099 5 10 CBBE Cc1nn(CC(=O)N2CCOC[C@H]2CO)c(C)c1[N+](=O)[O-] 168528236 CYSJZMDBDAYZIY-SNVBAGLBSA-N 298.299 -0.372 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N1CCOC[C@@H]1CO 168546106 AAHPMKAFUMVVIN-VIFPVBQESA-N 284.272 -0.599 5 10 CBBE Cn1cnc(CCNc2nc(NN)ncc2[N+](=O)[O-])n1 236116632 GUSRUUIGIZUDEK-UHFFFAOYSA-N 279.264 -0.547 5 10 CBBE COC[C@@H](CO)NS(=O)(=O)c1cncc([N+](=O)[O-])c1 311497502 DJZJYURADZAZPU-SSDOTTSWSA-N 291.285 -0.725 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@](O)(CO)C1 313620876 BUHDYFZEFFVQNT-JTQLQIEISA-N 255.230 -0.508 5 10 CBBE C[C@@H](O)[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 574291804 IYYHOIBUISRRBM-APPZFPTMSA-N 296.283 -0.206 5 10 CBBE CCn1cc(S(=O)(=O)NCC2COC2)c([N+](=O)[O-])n1 599490459 VLANPNQVWLHVPN-UHFFFAOYSA-N 290.301 -0.264 5 10 CBBE CC(C)(C(=O)N[C@@H]1CCOC[C@H]1O)n1cc([N+](=O)[O-])cn1 600586260 NKOORXHGTVXSOP-NXEZZACHSA-N 298.299 -0.208 5 10 CBBE CN1CCN(c2ncc([N+](=O)[O-])cn2)C[C@H]1C(=O)O 686102144 CLWPHKKOPAEDCB-QMMMGPOBSA-N 267.245 -0.410 5 10 CBBE CN(CC(C)(CO)CO)c1nc(F)ncc1[N+](=O)[O-] 689757920 QKQJDDTXDBKSDS-UHFFFAOYSA-N 274.252 -0.049 5 10 CBBE CN(CCO)CCN(C)c1cc([N+](=O)[O-])cc(NN)n1 691357542 OPEXOGAWQPNFJX-UHFFFAOYSA-N 284.320 -0.364 5 10 CBBE 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CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@H]2NC[C@@H]3C[C@H]23)n1 2333961760 PHPIIHJBQUOWSP-BYULHYEWSA-N 265.273 -0.448 5 10 CBBE CO[C@@H]1CNC[C@](C(=O)O)(n2ccc([N+](=O)[O-])n2)C1 2344389858 CNDQFWCRKVHGQI-OIBJUYFYSA-N 270.245 -0.421 5 10 CBBE Cn1nc(N2CCn3ncc(O)c3C2)nc1[N+](=O)[O-] 2344953995 BDGXHAXLAJFIFK-UHFFFAOYSA-N 265.233 -0.354 5 10 CBBE Cn1nc(N2[C@H]3CC[C@H]2[C@@H](O)[C@@H](O)C3)nc1[N+](=O)[O-] 2344960514 NFJTWSIRQMHJJX-DKXJUACHSA-N 269.261 -0.814 5 10 CBBE O=[N+]([O-])c1cccnc1S(=O)(=O)N[C@H]1CCNC1 95091860 VWGPETJFWRPZNY-ZETCQYMHSA-N 272.286 -0.370 5 10 CBBE CNc1ncccc1Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O 111545437 YPQRQRHCHRRYCX-UHFFFAOYSA-N 277.240 -0.070 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CNC2(CO)CCC2)c1 122843052 LRNBRTAQYUUFKY-SNVBAGLBSA-N 270.289 -0.343 5 10 CBBE Cn1ccnc1S(=O)(=O)CCn1cc([N+](=O)[O-])cn1 158192374 JPQKOKDCMUATQE-UHFFFAOYSA-N 285.285 -0.001 5 10 CBBE CC(C)NC(=O)[C@H](C)Nc1ncnc(NN)c1[N+](=O)[O-] 228067010 ZJJCKEMBBUVBKP-LURJTMIESA-N 283.292 -0.005 5 10 CBBE NC(=O)[C@@H]1CNCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 228393331 GXEUTGUUEGMVDL-NSHDSACASA-N 292.295 -0.577 5 10 CBBE CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CNC[C@@H]1O 234307573 URHLFCYNENUXPF-RYUDHWBXSA-N 279.296 -0.072 5 10 CBBE C[C@](O)(CO)CNc1ncc([N+](=O)[O-])cc1C(=O)O 235721936 RGLGZTGHEWVYLE-SNVBAGLBSA-N 271.229 -0.157 5 10 CBBE NC(=O)C[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1O 236308157 RICNRZALNIQZMX-ZCFIWIBFSA-N 268.229 -0.558 5 10 CBBE Nc1c(C(=O)N2C[C@H](O)[C@H](O)C2)cccc1[N+](=O)[O-] 236358652 FDMBTGVUMSPYDQ-DTORHVGOSA-N 267.241 -0.645 5 10 CBBE CCOCCn1nc([N+](=O)[O-])c(S(N)(=O)=O)c1C 300830397 CHPGIQJYOWWSGH-UHFFFAOYSA-N 278.290 -0.216 5 10 CBBE CN(CCOCCO)C(=O)CCn1cnc([N+](=O)[O-])c1 312429554 PBAKNZDKOMCYQO-UHFFFAOYSA-N 286.288 -0.351 5 10 CBBE COC(=O)c1ccc([N+](=O)[O-])c(NCC(=O)NCCO)c1 360128558 PXLFIDLRHYYIOZ-UHFFFAOYSA-N 297.267 -0.098 5 10 CBBE C[C@]1(F)CNCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 566250246 CBXJQPRSIPAONK-NSHDSACASA-N 285.279 -0.049 5 10 CBBE CN1CC(CN(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C1 598161996 FSRGGOZNLFLYRQ-UHFFFAOYSA-N 267.289 -0.189 5 10 CBBE Nc1ccc(N[C@H]2C[C@H](C(N)=O)C2)nc1[N+](=O)[O-] 599143528 DKEJFJQZBVFTJC-OLQVQODUSA-N 251.246 0.248 5 10 CBBE CN1CCN(c2ncnc(N)c2[N+](=O)[O-])C[C@H]1CO 687617298 QZCYQFITZUJDBE-ZETCQYMHSA-N 268.277 -0.920 5 10 CBBE CN1C[C@@H](Nc2ccnc(O)c2[N+](=O)[O-])C(=O)N1 695475999 WLZBPGXXERQMFR-ZCFIWIBFSA-N 253.218 -0.548 5 10 CBBE Cc1nc([N+](=O)[O-])c(N2C[C@H](O)C[C@H]2CO)n1C 698157143 OEPVAANQAYYTJG-JGVFFNPUSA-N 256.262 -0.431 5 10 CBBE O=C1CC[C@@H](NCc2ccc([N+](=O)[O-])cn2)C(=O)N1 699043147 NWYWQKFUDCFCNY-SECBINFHSA-N 264.241 -0.115 5 10 CBBE O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@H](O)C[C@H]1CO 699218578 WMMHSHFIAAHMAY-IONNQARKSA-N 282.252 -0.132 5 10 CBBE O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CNC[C@H]1O 699956735 QWJXFIFXAMZSED-MWLCHTKSSA-N 265.269 -0.414 5 10 CBBE COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H](O)CN 700931245 LYEKOGGVCVGTFA-SECBINFHSA-N 283.284 -0.005 5 10 CBBE Cc1ccc(C(=O)N[C@@H]2CNC[C@@H]2O)cc1[N+](=O)[O-] 704157264 BQNIRPBNDDMJHD-KOLCDFICSA-N 265.269 -0.034 5 10 CBBE Nc1cc([N+](=O)[O-])cc(N2C[C@@H](CO)[C@H](CO)C2)n1 704786839 FOSQPPQIONQMDG-YUMQZZPRSA-N 268.273 -0.391 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](CO)[C@@H]1CO 709883730 WOUDFQNIPFYDGC-BDAKNGLRSA-N 270.289 -0.102 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N=S1(=O)CCNCC1 712194106 RWWVGFWOADYXJL-UHFFFAOYSA-N 287.301 -0.611 5 10 CBBE C[C@H](Nc1ncnc(NN)c1[N+](=O)[O-])c1cn(C)nn1 720579879 MKWGEDAACKDGAA-YFKPBYRVSA-N 279.264 -0.028 5 10 CBBE NOCCS(=O)(=O)NCc1cccc([N+](=O)[O-])c1 722209326 RVWJKBMTVFLIAM-UHFFFAOYSA-N 275.286 -0.096 5 10 CBBE COC[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)C(N)=O 760043706 RYMQLDVGJSTUFM-VIFPVBQESA-N 282.256 -0.472 5 10 CBBE CCN(C)C(=O)COC(=O)c1nn(C)cc1[N+](=O)[O-] 772061130 UOKZKQHIIVQHMY-UHFFFAOYSA-N 270.245 -0.037 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCNC1=O 822133884 WOQVAHVSRSOYKC-SECBINFHSA-N 279.256 -0.501 5 10 CBBE 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CBBE Cc1c([N+](=O)[O-])c(N(CCO)CC(=O)O)nn1C 2086307341 HOQAGLXCSQLTRY-UHFFFAOYSA-N 258.234 -0.480 5 10 CBBE Cc1cc([N+](=O)[O-])nn1C1(C(=O)O)COCCOC1 2088729652 KCRRDSKDKAVLQN-UHFFFAOYSA-N 271.229 -0.074 5 10 CBBE NC(=O)c1ccc(N2CCNNCC2)c([N+](=O)[O-])c1 2095840091 SXFMXPSKAPYUEW-UHFFFAOYSA-N 265.273 -0.392 5 10 CBBE Cn1c(C(=O)NC2(C(=O)O)CNC2)ccc1[N+](=O)[O-] 2096007300 FPHXKAZLZFMMEP-UHFFFAOYSA-N 268.229 -0.910 5 10 CBBE NNc1ncnc(NC[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 2097823347 FULFXNCPPWIONL-RITPCOANSA-N 270.249 -0.910 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC2(C1)OCCC[C@H]2O 2103409660 WVFXKPJAUBXCNZ-SSDOTTSWSA-N 269.261 -0.547 5 10 CBBE C[C@@]1(CO)CNCCN1c1ccnc(O)c1[N+](=O)[O-] 2106563030 IADGELJTAJIIID-NSHDSACASA-N 268.273 -0.144 5 10 CBBE Nc1[nH]c(=NCC[C@@H]2COC[C@@H]2O)ccc1[N+](=O)[O-] 2111294312 ZHSABZXDARTLBS-APPZFPTMSA-N 268.273 -0.197 5 10 CBBE CN=c1[nH]c(=NCC2CC(CO)C2)[nH]cc1[N+](=O)[O-] 2112378191 ANCINFNFRUFMBE-UHFFFAOYSA-N 267.289 -0.299 5 10 CBBE O=C(NCc1ccccc1[N+](=O)[O-])C1(CO)CNC1 2114515812 LUSQVVURXTXTMQ-UHFFFAOYSA-N 265.269 -0.207 5 10 CBBE CNC1(C(N)=O)CN(c2cccc(N)c2[N+](=O)[O-])C1 2117108139 DIFAILVMEJENJW-UHFFFAOYSA-N 265.273 -0.560 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CCOC[C@H]2CN)[nH]1 2117297216 ZEPUXTRKBNVBLS-MRVPVSSYSA-N 267.289 -0.383 5 10 CBBE C[C@H](O)[C@@H](CO)Nc1nccc(C(=O)O)c1[N+](=O)[O-] 2117480884 PIAXCQYQGRGUSL-CAHLUQPWSA-N 271.229 -0.158 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN[C@H]2[C@H]3CS(=O)(=O)C[C@H]32)n1 2118021500 UQANTAQUBFAWFQ-LYIWLLOFSA-N 286.313 -0.539 5 10 CBBE N=c1[nH]c(N2CCO[C@H](CCN)C2)ncc1[N+](=O)[O-] 2119426324 CYVGXQANMAGICB-SSDOTTSWSA-N 268.277 -0.649 5 10 CBBE Cc1ccc([N+](=O)[O-])c(O[C@@H]2CS(=O)(=O)C[C@H]2N)n1 2121464964 NAWMQOIROHBJLR-VXNVDRBHSA-N 287.297 -0.199 5 10 CBBE COc1ccc(C(=O)N[C@H](CN)CO)cc1[N+](=O)[O-] 2126186688 VMKANHCSSJKWRM-MRVPVSSYSA-N 269.257 -0.347 5 10 CBBE Cc1nn(CC(=O)N(C)OCC(=O)O)c(C)c1[N+](=O)[O-] 2145976489 CVBMTXMUPVIWJK-UHFFFAOYSA-N 286.244 -0.117 5 10 CBBE COC(=O)C1(N)CC(COc2nn(C)cc2[N+](=O)[O-])C1 2150087433 FBIVRUNYALNUDK-UHFFFAOYSA-N 284.272 -0.012 5 10 CBBE CN=c1[nH]c(=NC[C@@H]2CCCNC2=O)[nH]cc1[N+](=O)[O-] 2157680316 MKVWIUYSBYLSTD-ZETCQYMHSA-N 280.288 -0.792 5 10 CBBE CN=c1[nH]c(=NCCOC(=O)N(C)C)[nH]cc1[N+](=O)[O-] 2157680453 OECIIKDTFRIZJA-UHFFFAOYSA-N 284.276 -0.620 5 10 CBBE NC[C@@H]1CN(c2nccc(C(=O)O)c2[N+](=O)[O-])CCO1 2162805593 IPGZVCRXBYBZNP-SSDOTTSWSA-N 282.256 -0.148 5 10 CBBE C[C@]12CNC[C@@H]1C[C@](C(=O)O)(n1cnc([N+](=O)[O-])n1)C2 2172828475 RIUYZRWYMAJVDV-SWPVVBRQSA-N 281.272 -0.014 5 10 CBBE NNc1cc([N+](=O)[O-])cc(=N[C@H]2CCC[C@H]2C(N)=O)[nH]1 2174111243 UQRIOMUNANZFCE-SFYZADRCSA-N 280.288 -0.237 5 10 CBBE Nc1cccc(N[C@@H]2C[C@H](CO)[C@H](O)[C@@H]2O)c1[N+](=O)[O-] 2177947368 FFIJECKXCZQXBL-URHLEADWSA-N 283.284 -0.309 5 10 CBBE NCCc1nc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n[nH]1 2183126399 SFLWTCWOKDBYJD-UHFFFAOYSA-N 280.248 -0.951 5 10 CBBE COC(=O)[C@@H](CN)Oc1cnc([N+](=O)[O-])cc1C(=O)O 2184553947 BLEPICVWGJDBOO-ZCFIWIBFSA-N 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CCO[C@@H]1CNC[C@@H]1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2202430649 SYDIWIOMLDBSDY-GZMMTYOYSA-N 280.284 -0.025 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H](O)[C@@H](O)[C@H]2O)c1 2206805614 AKYXKKVTPBIUJR-GRLWKWRFSA-N 284.272 -0.853 5 10 CBBE CCn1ncc([N+](=O)[O-])c1NC1(CCO)CNC1 2223792816 BBLFYQLLPYTNEZ-UHFFFAOYSA-N 255.278 -0.053 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1CC[C@H](O)[C@@H](CO)C1 2231881057 SHRNCFLTCMTKDH-SCZZXKLOSA-N 270.289 -0.009 5 10 CBBE N=c1cc([N+](=O)[O-])cc(NCCOCCOCCN)[nH]1 2233912693 KHTQZAMYSUHGGY-UHFFFAOYSA-N 285.304 -0.194 5 10 CBBE CNc1cc(NC[C@@H]2NC[C@H](O)[C@H]2O)ccc1[N+](=O)[O-] 2234274115 BRVJNOKQERUOPZ-DLOVCJGASA-N 282.300 -0.258 5 10 CBBE O=C1CN[C@@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CN1 2236174680 MLUUWYPLNBQNJR-SSDOTTSWSA-N 280.240 -0.673 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N(CCO)CC(=O)O)n1 2258627602 HFPNFHOSLVTWHR-UHFFFAOYSA-N 256.218 -0.423 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N(CCN)OC)n1 2258680806 GLBLRSAXHFXACS-UHFFFAOYSA-N 257.250 -0.142 5 10 CBBE Nc1ccnc(NC2CNCCNC2)c1[N+](=O)[O-] 2259427733 BAIZQGFSUNDXSP-UHFFFAOYSA-N 252.278 -0.455 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1CCOC[C@@H](O)C1 2278192012 MIVDWOOTJAFNOJ-VIFPVBQESA-N 267.241 -0.177 5 10 CBBE N=c1[nH]c(N2CC(F)(F)C[C@H]2CN)ncc1[N+](=O)[O-] 2278914548 UZJSIJZTUBXFIB-YFKPBYRVSA-N 274.231 -0.030 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2CC[C@H](O)CN2)n1 2279241966 PZVVUBGMSXPWQQ-YUMQZZPRSA-N 283.288 -0.943 5 10 CBBE Cc1cc(C(=O)NCC(N)(CO)CO)ccc1[N+](=O)[O-] 2286178626 KZQILYDYCAUQIH-UHFFFAOYSA-N 283.284 -0.685 5 10 CBBE CN(CC(F)(F)C(=O)O)C(=O)Cn1cc([N+](=O)[O-])cn1 2295332608 ZBCLTEAZWJIGJN-UHFFFAOYSA-N 292.198 -0.030 5 10 CBBE O=C(O)[C@@]1(N2CC([N+](=O)[O-])C2)COCCC1(F)F 2321852162 ZCORVHRFOSQAJH-QMMMGPOBSA-N 266.200 -0.174 5 10 CBBE C[C@H]1CNCC[C@](C(=O)O)(N2CC([N+](=O)[O-])C2)C1 2323716023 ASOQANYVVKQBJP-KCJUWKMLSA-N 257.290 -0.210 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2C[C@@H](O)[C@@H](O)[C@@H]2CF)[nH]1 2333241668 KRCFNMOATUDSRT-PJKMHFRUSA-N 272.236 -0.718 5 10 CBBE NCCS(=O)(=O)CCOc1ncnc(F)c1[N+](=O)[O-] 2335859635 CVBUGPKEDQQQHX-UHFFFAOYSA-N 294.264 -0.724 5 10 CBBE N=c1[nH]c(N2[C@H]3CC[C@@H]2C[C@@H](O)[C@@H]3O)ncc1[N+](=O)[O-] 2357055900 AVDUOHGAATYVIM-HSLWUYEYSA-N 281.272 -0.740 5 10 CBBE CN(c1nc(N)ncc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 5445968 XCZNIGRUIVOQBK-LURJTMIESA-N 287.301 -0.410 5 10 CBBE O=[N+]([O-])c1cc(S(=O)(=O)NC2[C@@H]3CNC[C@H]23)ccc1O 36265358 OLCAHBKXUWLBDW-OQJHAAMPSA-N 299.308 -0.204 5 10 CBBE NC(=O)CCNC(=O)c1cc(N)ccc1[N+](=O)[O-] 50702851 BVSAIPFTZVTVCP-UHFFFAOYSA-N 252.230 -0.218 5 10 CBBE O=C(O)CN1CCCN(c2ncc([N+](=O)[O-])cn2)CC1 61145905 YOQUTCAQAFBFBA-UHFFFAOYSA-N 281.272 -0.019 5 10 CBBE NC(=O)CN(CC(N)=O)C(=O)c1ccc(F)c([N+](=O)[O-])c1 61808637 HLILELFMFZSXDC-UHFFFAOYSA-N 298.230 -0.853 5 10 CBBE NNc1ccc(C(=O)NN2CCOCC2)cc1[N+](=O)[O-] 150291044 XLZHVEGWENKRKE-UHFFFAOYSA-N 281.272 -0.143 5 10 CBBE C[C@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])ccc1NN 157133095 YICNAEKRHNHYNG-ZCFIWIBFSA-N 281.272 -0.126 5 10 CBBE NNc1c(C(=O)NN2CCOCC2)cccc1[N+](=O)[O-] 161586836 XULKENASKTZBKB-UHFFFAOYSA-N 281.272 -0.143 5 10 CBBE Cc1nn(CCC(=O)NC2=NCC(=O)N2)c(C)c1[N+](=O)[O-] 524353446 AVMGDUXQIBEWQY-UHFFFAOYSA-N 294.271 -0.600 5 10 CBBE O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1CCC(CO)(CO)C1 596817093 KYDUVFVKLQPUDW-UHFFFAOYSA-N 296.283 -0.380 5 10 CBBE C[C@@H]1NCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 704651491 RVDVADYPKHPTAS-YUMQZZPRSA-N 253.262 -0.342 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H]2CNC[C@@H]21 706525783 NIBDVCQNLWDGGT-BDAKNGLRSA-N 265.273 -0.388 5 10 CBBE Nc1ncnc(N[C@@H]2COCC[C@@H]2O)c1[N+](=O)[O-] 711039737 SXOMDXUUPPAENM-RITPCOANSA-N 255.234 -0.471 5 10 CBBE COC(=O)C1(O)CN(c2nc(Cl)ncc2[N+](=O)[O-])C1 714517551 GQHVEBSJSMNTRD-UHFFFAOYSA-N 288.647 -0.238 5 10 CBBE C[C@H](O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 717278814 IUXQEPMVIPKXBI-XNCJUZBTSA-N 271.229 -0.833 5 10 CBBE Nc1ncc(C(=O)N2CCn3ncnc3C2)cc1[N+](=O)[O-] 1154871785 HLORTQSNHLVJCB-UHFFFAOYSA-N 289.255 -0.181 5 10 CBBE C[C@H](Cc1cnn(C)c1)NC(=O)Cn1cnc([N+](=O)[O-])n1 1544966250 PVTGXHHFPHJMBO-MRVPVSSYSA-N 293.287 -0.333 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NC[C@H]1CC[C@@H](C(N)=O)O1 1651636424 NHVDKJHVWIUWKH-SVRRBLITSA-N 269.261 -0.227 5 10 CBBE Nc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1C[C@@H](O)CN1 1866039856 GDELKFXMCRMQSL-XCBNKYQSSA-N 266.257 -0.162 5 10 CBBE N[C@@H](CS(=O)(=O)Cc1ccc([N+](=O)[O-])cn1)C(=O)O 1882751055 OQFAKCIHOPBIFM-QMMMGPOBSA-N 289.269 -0.684 5 10 CBBE COc1cc([C@H](N)[C@H](O)C(=O)O)cc([N+](=O)[O-])c1O 1952156322 WRNAOFKNOYJTTD-CBAPKCEASA-N 272.213 -0.246 5 10 CBBE O=[N+]([O-])c1cnc(N2C[C@@H](O)CC23CNC3)s1 2013640325 JUJYPGIQGUOIIU-LURJTMIESA-N 256.287 -0.036 5 10 CBBE COC[C@@]1(Oc2nc([N+](=O)[O-])nn2C)CCNC1 2041251795 ZWRLZCZXHFJAOX-SECBINFHSA-N 257.250 -0.519 5 10 CBBE NCC(CN)Nc1c(C(=O)O)cccc1[N+](=O)[O-] 2043930552 HELQRXJWAOCGEC-UHFFFAOYSA-N 254.246 -0.009 5 10 CBBE C[C@@H]1C[C@@H](CN=c2nc([N+](=O)[O-])[nH]n2C)CCN1 2052366139 BEBDURJQUVDMRS-SFYZADRCSA-N 254.294 -0.055 5 10 CBBE N[C@H](CO)COc1nccc(C(=O)O)c1[N+](=O)[O-] 2064799846 OTNDELWELSAYAC-RXMQYKEDSA-N 257.202 -0.614 5 10 CBBE Nc1cc(N2CC[C@H](O)[C@@H](O)C2)ncc1[N+](=O)[O-] 2068368601 FESVWQRNNSCNDK-IUCAKERBSA-N 254.246 -0.496 5 10 CBBE CN(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](N)CO 2071565977 ACXIPMLRYSIZJK-SNVBAGLBSA-N 253.258 -0.127 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1CNC(C)(C)C1 2073058085 OSBWXAACMZTWFJ-SSDOTTSWSA-N 254.294 -0.055 5 10 CBBE O=[N+]([O-])c1ccccc1N1C[C@H](O)[C@@H](O)[C@H]1CO 2080589151 YUIUMVHLABMWHJ-VWYCJHECSA-N 254.242 -0.503 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@@H](CO)C[C@@H]1CO 2089865892 KUYZYUPRNIQYBU-NKWVEPMBSA-N 272.236 -0.297 5 10 CBBE COc1ncnc(N[C@H](CO)CCCO)c1[N+](=O)[O-] 2090377516 SOUYKYKREBOEQO-ZETCQYMHSA-N 272.261 -0.061 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CNCCSC1 2097299641 RDVWAUHZPPXROI-QMMMGPOBSA-N 285.329 -0.388 5 10 CBBE CN=c1[nH]c(N2CC[C@H](C(N)=O)C2)ncc1[N+](=O)[O-] 2101468612 KCFUKVIFMXQKOB-LURJTMIESA-N 266.261 -0.840 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1C[C@H](O)[C@H]2COC[C@H]21 2102157386 PDIQSBFPZIPHAU-XVMARJQXSA-N 270.220 -0.280 5 10 CBBE CN1CCO[C@H](CNCc2nn(C)cc2[N+](=O)[O-])C1 2102862827 FZNYXIJPKUILFH-SECBINFHSA-N 269.305 -0.252 5 10 CBBE O=[N+]([O-])c1c(Cl)ncnc1N1C[C@H]2C[C@H]1[C@@H](O)[C@H]2O 2104392247 GJLJEICKSKYHSM-HETMPLHPSA-N 286.675 -0.032 5 10 CBBE CN1C(=O)C[C@@H](Nc2cc(N)c([N+](=O)[O-])cn2)C1=O 2109588800 JXRABZPXNUNPEU-ZCFIWIBFSA-N 265.229 -0.259 5 10 CBBE N=c1[nH]c(N2C[C@H](C(F)F)[C@@H](N)C2)ncc1[N+](=O)[O-] 2117178259 FRJDULQAFJQNAB-WHFBIAKZSA-N 274.231 -0.174 5 10 CBBE C[C@@H]1[C@@H]2CNC[C@H]2CN1c1nc(=N)[nH]cc1[N+](=O)[O-] 2117230775 WFSXLSSYODJHDC-CSMHCCOUSA-N 264.289 -0.159 5 10 CBBE CCN=c1nc(N2CC3(CCN3)C2)c([N+](=O)[O-])c[nH]1 2117308684 SRVZUHXXOLPEAO-UHFFFAOYSA-N 264.289 -0.209 5 10 CBBE C[C@@H]1CNC(=O)CN1CC(=O)c1cc([N+](=O)[O-])c[nH]1 2124762296 QCIHGGNUPQTCJE-SSDOTTSWSA-N 266.257 -0.074 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@H]2COCC2(F)F)c1[N+](=O)[O-] 2131100751 QTNCSSQGTWCTOB-YFKPBYRVSA-N 275.215 -0.026 5 10 CBBE NCCCC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 2134812040 FEIJRNKXXIXVMA-UHFFFAOYSA-N 267.289 -0.011 5 10 CBBE N=c1nc(N2CC[C@@H](O)C[C@@H]2CO)c([N+](=O)[O-])c[nH]1 2136085690 TXUWNBKYEMKBGY-RNFRBKRXSA-N 269.261 -0.881 5 10 CBBE CN1C[C@H](O)[C@H](Nc2cc(C(N)=O)ccc2[N+](=O)[O-])C1 2146512236 AINYQWQNQBJFSS-KOLCDFICSA-N 280.284 -0.220 5 10 CBBE CN1C[C@H](O)[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 2146513023 HAXBBKDVKXYWKZ-KCJUWKMLSA-N 281.268 -0.295 5 10 CBBE CN(C)CC1(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 2146533032 LBIDHUMLSWYCJE-NSHDSACASA-N 283.332 -0.164 5 10 CBBE CO[C@@H]1C[C@@H](CN)N(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 2146878628 FDBAPNBSXLNCII-WCBMZHEXSA-N 283.288 -0.634 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N2CC(OC(=O)NC)C2)[nH]1 2146878779 HDPLONWTXRIBDW-UHFFFAOYSA-N 281.272 -0.002 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H]2[C@H](C1)[C@@H]2CO 2149564224 PTNXSSOFULCNPH-GARJFASQSA-N 280.284 -0.122 5 10 CBBE CN=c1nc(N(C)CC(CO)CO)c([N+](=O)[O-])c(C)[nH]1 2150420345 XWXIWKZMEHDTIX-UHFFFAOYSA-N 285.304 -0.806 5 10 CBBE CNc1nc[nH]c(=NC[C@H]2C[C@H](O)CCO2)c1[N+](=O)[O-] 2154241032 HZXVZNHIZWEKAE-HTQZYQBOSA-N 283.288 -0.200 5 10 CBBE COc1ccc(C(=O)N2CC(O)(CN)C2)cc1[N+](=O)[O-] 2154733106 FABZAMPCVHSMDO-UHFFFAOYSA-N 281.268 -0.251 5 10 CBBE CNC(=O)NCCN=c1nc(N(C)C)c([N+](=O)[O-])c[nH]1 2157674397 ZOILOHIYDSYLNA-UHFFFAOYSA-N 283.292 -0.786 5 10 CBBE CN=c1[nH]c(N2C3COCC2COC3)ncc1[N+](=O)[O-] 2157683365 FNOXEXUHIBZLJS-UHFFFAOYSA-N 281.272 -0.548 5 10 CBBE C[C@H](O)CN(C[C@@H](C)O)C(=O)Cn1cc([N+](=O)[O-])cn1 2159729830 OSSDMNKHMOGYBY-DTORHVGOSA-N 286.288 -0.619 5 10 CBBE O=C(O)c1ccc([N+](=O)[O-])c(NC[C@@]2(O)CCNC2)n1 2162254237 JXLZBVXJCYOTTF-LLVKDONJSA-N 282.256 -0.176 5 10 CBBE Cc1nc(NN)nc(N2CC[C@@H]3C[C@]3(O)C2)c1[N+](=O)[O-] 2171029829 VVOGBHRNMSBGQM-HQJQHLMTSA-N 280.288 -0.060 5 10 CBBE CC(C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H](O)C(=O)O 2176876804 SZDNDKGCMLKBCV-QMMMGPOBSA-N 286.244 -0.868 5 10 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DPKXNYRDMJQVAH-UHFFFAOYSA-N 252.234 -0.788 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NCCCOCCO 227552017 DOQWKGUMKQRHJA-UHFFFAOYSA-N 286.288 -0.303 5 10 CBBE Cc1nc(NN)nc(N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 229396133 RCNJUHNCHRCODB-YFKPBYRVSA-N 267.249 -0.721 5 10 CBBE CNC(=O)[C@@H](C)Nc1nc(NN)ncc1[N+](=O)[O-] 234343499 OEDCUNAIQCEXCI-SCSAIBSYSA-N 255.238 -0.783 5 10 CBBE CNc1cc([N+](=O)[O-])cc(N2CCOC[C@H]2C(N)=O)n1 234516176 CYYKAIKCEHGHQO-QMMMGPOBSA-N 281.272 -0.278 5 10 CBBE O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CNC[C@H]1O 262346660 UEDXXHJFICZMHZ-BXKDBHETSA-N 295.295 -0.330 5 10 CBBE O=C(CCn1cc([N+](=O)[O-])cn1)NCCCn1ccnn1 343853127 VFYATTXBKIYXLG-UHFFFAOYSA-N 293.287 -0.021 5 10 CBBE O=[N+]([O-])c1ccn(CCN2CCn3c(O)nnc3C2)n1 354975179 FCAQESGWAUIFCR-UHFFFAOYSA-N 279.260 -0.396 5 10 CBBE O=C(N[C@@H]1CC[C@H]1O)c1cc([N+](=O)[O-])cnc1O 425322658 KBBJMKNDRJSOTQ-HTQZYQBOSA-N 253.214 -0.052 5 10 CBBE O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])cn1 532143251 OSMVGRTXHRXQOO-ZETCQYMHSA-N 285.281 -0.093 5 10 CBBE CCNC(=O)CN(C)c1ncc([N+](=O)[O-])cc1C(N)=O 604124179 VYGNDBCTUZSPBG-UHFFFAOYSA-N 281.272 -0.339 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(N)CCOC1 688536998 LGMZKKIBRIXFMM-NSHDSACASA-N 268.273 -0.219 5 10 CBBE NC(=O)[C@@]1(O)CCN(c2ccnc(O)c2[N+](=O)[O-])C1 695449132 KMZHRAUFVXZWRW-SNVBAGLBSA-N 268.229 -0.878 5 10 CBBE N[C@@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1 702077320 WSIHKKIHFZSVRC-SNVBAGLBSA-N 269.261 -0.975 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCO[C@H]1C(=O)O 702984936 ZUGLEBLQGPIRIX-VXNVDRBHSA-N 284.228 -0.850 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](NCCO)C1 708582550 OCNCMYIWRZPETC-VIFPVBQESA-N 269.305 -0.121 5 10 CBBE O=C(O)c1cc([N+](=O)[O-])cnc1N[C@H]1CCNC1=O 710410561 FLDCKVRDXZMWJT-ZETCQYMHSA-N 266.213 -0.012 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@H]2COCC[C@@H]2O)n1 710921000 JNBRQMLWRSAREU-XPUUQOCRSA-N 269.261 -0.163 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CNC/C=C/CO)c1 717445136 AHHLKPXEJKANOO-YOLVWIGZSA-N 256.262 -0.710 5 10 CBBE Cc1ncc([N+](=O)[O-])cc1C(=O)Nn1cnnc1O 777767920 MRXVTEMCWFJOSH-UHFFFAOYSA-N 264.201 -0.021 5 10 CBBE O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H](CO)[C@@H](CCO)C1 1305755539 YNQDSOXUMMCKSQ-AXTSPUMRSA-N 258.274 -0.899 5 10 CBBE O=[N+]([O-])c1ncccc1N1CCN2[C@H](CNS2(=O)=O)C1 1307215539 MXBXMXNLGCQDFG-MRVPVSSYSA-N 299.312 -0.672 5 10 CBBE Cn1ccc(=O)n(Cc2cccnc2[N+](=O)[O-])c1=O 1472976312 XVMHHSQLJLMIHE-UHFFFAOYSA-N 262.225 -0.102 5 10 CBBE Cn1cnc(C(=O)Nc2c([N+](=O)[O-])ncn2C)n1 1525719318 LPNRRGNZDKIESL-UHFFFAOYSA-N 251.206 -0.291 5 10 CBBE COCCC(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1582172781 RBFCCRHSHZGGLW-NXEZZACHSA-N 285.300 -0.737 5 10 CBBE CCCOCC(=O)N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1688013025 CNQDKTMAWYNQCX-GWOFURMSSA-N 299.327 -0.158 5 10 CBBE CC1(C)[C@@H]2OCC[C@@H]2[C@@]1(N)C(=O)N1CC([N+](=O)[O-])C1 1876147880 BFEKIPXOPGBOHC-YGOYTEALSA-N 269.301 -0.384 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@@H]1CNC[C@@H]1S(C)(=O)=O 1877643546 MLMGRDGCMFJBJR-SVRRBLITSA-N 289.317 -0.875 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CCC(O)(C(=O)O)CC1 1890423885 WENFZMBYFHXHEK-UHFFFAOYSA-N 271.233 -0.861 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCCC23OCCO3)nc1[N+](=O)[O-] 1903473871 SPTAOERPPLCFSZ-SSDOTTSWSA-N 269.261 -0.147 5 10 CBBE O=C(O)c1cccc([N+](=O)[O-])c1NCC(O)(CO)CO 1913800367 HBMVIFPNWUNEHO-UHFFFAOYSA-N 286.240 -0.579 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1C[C@H](O)C[C@H]1C(=O)O 1916387823 DLDJJZWULSNPNH-RITPCOANSA-N 256.218 -0.648 5 10 CBBE CC(C)[C@@H](N)[C@](C)(C(=O)O)n1cnc([N+](=O)[O-])n1 1919717162 CRZQWNSHZRXWCL-HZGVNTEJSA-N 257.250 -0.031 5 10 CBBE O=[N+]([O-])c1ccc([C@H]2CS(=O)(=O)NCCN2)cc1O 1952460685 YTBNRKNDYWWGET-MRVPVSSYSA-N 287.297 -0.136 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CCC([C@@H](O)CO)CC1 1963363746 TWRAOIXKZJQHMX-VIFPVBQESA-N 270.289 -0.102 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CC[C@@H](OCCO)C2)n1 1974243183 KAMJFDIIGWUCRW-MRVPVSSYSA-N 256.262 -0.084 5 10 CBBE N=[S@@](=O)(N1CCOCC1)N1CC([N+](=O)[O-])C1 1989300138 JIKMIATVPDDMBT-MRXNPFEDSA-N 250.280 -0.844 5 10 CBBE NS(=O)(=O)NCCNc1cc([N+](=O)[O-])ccn1 1995957476 LLMGNQZPYMRWOZ-UHFFFAOYSA-N 261.263 -0.805 5 10 CBBE CCO[C@@H]1CS(=O)(=O)C[C@@H]1N1CC([N+](=O)[O-])C1 2016889344 RCKULDYGSOCFPG-DTWKUNHWSA-N 264.303 -0.851 5 10 CBBE CCOC(=O)[C@H](O)Cn1cccc([N+](=O)[O-])c1=O 2026879703 DIMKBAIBTLRISH-MRVPVSSYSA-N 256.214 -0.320 5 10 CBBE CO[C@@H]1CN[C@@H](COc2nc([N+](=O)[O-])nn2C)C1 2041247280 KNQAFWFSHORNCY-RQJHMYQMSA-N 257.250 -0.521 5 10 CBBE C[C@H]1CN(c2nc(=N)[nH]cc2[N+](=O)[O-])C[C@@H]1CN 2053558875 DILKDVOQRBUXMU-BQBZGAKWSA-N 252.278 -0.172 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NC2(CN)COC2)[nH]1 2053594825 JYVDRMUCTKNPSE-UHFFFAOYSA-N 253.262 -0.407 5 10 CBBE N[C@@H]1CS(=O)(=O)C[C@H]1Oc1cccc([N+](=O)[O-])n1 2057797206 PYXBBNKVZXFPQT-RNFRBKRXSA-N 273.270 -0.507 5 10 CBBE O=C(O)c1nn(CC2[C@H]3CNC[C@H]23)cc1[N+](=O)[O-] 2059130547 HBMRCARBCQXBQV-WDSKDSINSA-N 252.230 -0.045 5 10 CBBE N[C@@H](CO)COc1cc(C(=O)O)ccc1[N+](=O)[O-] 2064795593 PQILYMJALKOVHR-ZETCQYMHSA-N 256.214 -0.009 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CCNCC12CC2 2065972205 CDDXQWYXMQJKTL-ZETCQYMHSA-N 252.278 -0.301 5 10 CBBE O=C(O)C[C@H]1C[C@@H](NC(=O)N2CC([N+](=O)[O-])C2)C1 2071563572 KVHSOMGORMOPNY-KNVOCYPGSA-N 257.246 -0.090 5 10 CBBE C[C@@H]1OCCO[C@H]1CN=c1[nH]cnc(N)c1[N+](=O)[O-] 2087414580 UCCLWRCVCIZYBG-BQBZGAKWSA-N 269.261 -0.395 5 10 CBBE CN=c1nc(N2C[C@@H]3C[C@]3(CO)C2)c([N+](=O)[O-])c[nH]1 2090124765 PALIPEAUZULAMV-WRWORJQWSA-N 265.273 -0.333 5 10 CBBE NC(=O)[C@@H]1C[C@@H](N)CN(c2ccc([N+](=O)[O-])cn2)C1 2094658411 HEPLQZNRNDJITF-HTQZYQBOSA-N 265.273 -0.371 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N(C)C2CS(=O)(=O)C2)[nH]1 2095910888 PRAVGUORMCJAQV-UHFFFAOYSA-N 286.313 -0.313 5 10 CBBE NCC1(O)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 2098499783 REZRFXVNLFPAQU-UHFFFAOYSA-N 265.269 -0.331 5 10 CBBE CNC[C@H](O)CN(C)c1ncc([N+](=O)[O-])c(OC)n1 2101474504 SQVXHMXXRNGOQP-ZETCQYMHSA-N 271.277 -0.590 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CC[C@@](O)(C(=O)O)C2)n1 2102866414 MJZNUURLBUMLKF-JTQLQIEISA-N 270.245 -0.650 5 10 CBBE NCCN1CCN(c2nc(F)ncc2[N+](=O)[O-])CC1 2106502497 XOTACTGGZVEHSV-UHFFFAOYSA-N 270.268 -0.395 5 10 CBBE Cc1nc(CN2CC(N)(C(N)=O)C2)ccc1[N+](=O)[O-] 2111170112 OCIVPUGVKWRWFF-UHFFFAOYSA-N 265.273 -0.703 5 10 CBBE N[C@@H]1C[C@H](CN=c2[nH]cnc(Cl)c2[N+](=O)[O-])C[C@H]1O 2116204749 FCQOBDUUEWQFNK-RRKCRQDMSA-N 287.707 -0.030 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@H]2CCNC[C@H]2O)[nH]1 2117110515 JHBUPEBSHUJGDK-DTWKUNHWSA-N 267.289 -0.412 5 10 CBBE CCO[C@@H]1C[C@@H](N)[C@@H]1Nc1ncc([N+](=O)[O-])c(=N)[nH]1 2117184418 FUNLORJJVDSLNP-NJUXHZRNSA-N 268.277 -0.286 5 10 CBBE CO[C@H]1CNCC[C@H]1N=c1ccc(N)c([N+](=O)[O-])[nH]1 2117202135 DIAWSJPODWNYJE-BDAKNGLRSA-N 267.289 -0.217 5 10 CBBE CCCN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCNC2)[nH]1 2117262552 YSLXGIBLIVCQHA-MRVPVSSYSA-N 266.305 -0.176 5 10 CBBE N=c1[nH]c(N2CCO[C@@H](CCN)C2)ncc1[N+](=O)[O-] 2119426325 CYVGXQANMAGICB-ZETCQYMHSA-N 268.277 -0.649 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@H]1COC(C)(C)CO1 2120127355 JURMVNRHKYICES-ZETCQYMHSA-N 271.277 -0.249 5 10 CBBE Cc1cc([N+](=O)[O-])cnc1NCC(CO)(CO)CO 2123161961 OMWHOHOUYSQIBX-UHFFFAOYSA-N 271.273 -0.327 5 10 CBBE N=c1cc([N+](=O)[O-])cc(NC[C@@]2(O)CCCNC2)[nH]1 2136614764 PWBXKESROSYNMB-LLVKDONJSA-N 267.289 -0.071 5 10 CBBE CCOCCOCCN=c1[nH]c(NN)ncc1[N+](=O)[O-] 2143868596 PVPLXJKAAXPREF-UHFFFAOYSA-N 286.292 -0.443 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2C[C@@H]3OCC[C@H]32)c1[N+](=O)[O-] 2151826215 PVGPDYKHHVTSMS-RNJXMRFFSA-N 280.288 -0.010 5 10 CBBE N=c1[nH]c(=NC[C@H]2CCCCNC2=O)[nH]cc1[N+](=O)[O-] 2157646394 AQXMTTNRQKAQKU-SSDOTTSWSA-N 280.288 -0.453 5 10 CBBE CN1C[C@H](Nc2ncc([N+](=O)[O-])c(N(C)C)n2)[C@H](O)C1 2157683267 DMPCCSBVVHVOKN-IONNQARKSA-N 282.304 -0.462 5 10 CBBE Cn1cc([N+](=O)[O-])c(COC2CN([C@@H]3CCNC3)C2)n1 2159111970 XEQZLCGQGOIYLD-SECBINFHSA-N 281.316 -0.109 5 10 CBBE COCCN(C(=O)Cn1ccc([N+](=O)[O-])n1)C1CNC1 2160203561 NZCKSORSJXBWLS-UHFFFAOYSA-N 283.288 -0.762 5 10 CBBE O=C(N[C@@H]1C[C@@H](O)C[C@H]1O)c1cc(O)ccc1[N+](=O)[O-] 2164985001 OEVRKGMZGQMNFB-BCMRRPTOSA-N 282.252 -0.086 5 10 CBBE Cc1nc(NN)nc(N2CC[C@H]3C[C@]3(O)C2)c1[N+](=O)[O-] 2171029828 VVOGBHRNMSBGQM-CPCISQLKSA-N 280.288 -0.060 5 10 CBBE CN(C1COC1)C1CN(c2ncnc(N)c2[N+](=O)[O-])C1 2173116739 YZXDMHCUPREOKW-UHFFFAOYSA-N 280.288 -0.514 5 10 CBBE NC(=O)[C@H]1CNCCN1c1ccc([N+](=O)[O-])c(N)c1F 2173809946 GZQJIYAFVYRLHY-MRVPVSSYSA-N 283.263 -0.420 5 10 CBBE Nc1ccc(=N[C@H]2[C@H]3OCCC[C@H]3[C@H]2N)[nH]c1[N+](=O)[O-] 2173818878 RVSMXQIRDFGLAM-HCPDIIQCSA-N 279.300 -0.090 5 10 CBBE CN(c1nc(=N)[nH]cc1[N+](=O)[O-])C1(CN)CCOCC1 2173832003 MAPIVYBCESOLQQ-UHFFFAOYSA-N 282.304 -0.259 5 10 CBBE C[C@H](Nc1ncnc(N)c1[N+](=O)[O-])C1(O)CCNCC1 2174046285 PCVNFLNBGKDCDC-ZETCQYMHSA-N 282.304 -0.118 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2[C@H]3CNC[C@@H]23)[nH]1 2175699173 CVXZPCCYWMXBPO-AYMMMOKOSA-N 278.316 -0.462 5 10 CBBE N=c1nc(N2CC(N3CCCC3=O)C2)c([N+](=O)[O-])c[nH]1 2182233736 OOGGTMBOROPCGH-UHFFFAOYSA-N 278.272 -0.392 5 10 CBBE NC(=O)c1ccc(N[C@H]2CNCC[C@@H]2O)c([N+](=O)[O-])c1 2183270810 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O=C1CN[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccn2)CN1 2137727704 SANBOJFXBDQZIU-SSDOTTSWSA-N 265.229 -0.984 5 10 CBBE CS[C@@H]1COC[C@@H]1N=c1[nH]c(NN)ncc1[N+](=O)[O-] 2142534644 YJTIZJJNYFCGFI-CAHLUQPWSA-N 286.317 -0.365 5 10 CBBE Nc1cc(N2CCOC[C@H]2[C@@H](O)CO)ccc1[N+](=O)[O-] 2146329000 KQNZPDYQUYWHMJ-RYUDHWBXSA-N 283.284 -0.265 5 10 CBBE COC[C@H](CC(=O)O)NC(=O)Cn1cc([N+](=O)[O-])cn1 2149267134 XEDLSTKOAXMSFI-ZETCQYMHSA-N 286.244 -0.603 5 10 CBBE N=c1[nH]c(N2CC[C@@H]3OCCO[C@H]3C2)ncc1[N+](=O)[O-] 2157650211 NDLPWJIQLWFLTL-IUCAKERBSA-N 281.272 -0.209 5 10 CBBE CN(C)c1nc(N2CCO[C@@H](CO)C2)ncc1[N+](=O)[O-] 2157678181 HCZFILXEDNBDMU-MRVPVSSYSA-N 283.288 -0.352 5 10 CBBE COCCN1CC[C@@H](N=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])C1 2160025794 FJOHEWRLWGOUBM-MRVPVSSYSA-N 282.304 -0.648 5 10 CBBE CN1CCN(CCNCc2nn(C)cc2[N+](=O)[O-])CC1 2160392502 REWHWDRMZKFKKM-UHFFFAOYSA-N 282.348 -0.335 5 10 CBBE N=c1[nH]c(NC2CN([C@H]3CCOC3)C2)ncc1[N+](=O)[O-] 2169339814 MUIMBESBRJFFBR-QMMMGPOBSA-N 280.288 -0.318 5 10 CBBE O=C(O)C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H]1O 2174352173 QNZDZJYIDAMHBD-HZGVNTEJSA-N 283.240 -0.170 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC1(c2ccccn2)CNC1 2177735170 DFNGWDPAXYUVBJ-UHFFFAOYSA-N 276.256 -0.004 5 10 CBBE CN1C[C@H](N)[C@H](Oc2ncc(C(=O)O)cc2[N+](=O)[O-])C1 2184588733 RFMKPZAYAVAVFU-IONNQARKSA-N 282.256 -0.292 5 10 CBBE CCC[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 2186498236 BWSCJMDJJCXMFE-ZJUUUORDSA-N 285.304 -0.604 5 10 CBBE CN=c1[nH]c(N2CCn3nncc3C2)ncc1[N+](=O)[O-] 2186617528 ZMZULKKWNIVWMD-UHFFFAOYSA-N 276.260 -0.540 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCC2COCCOC2)c1[N+](=O)[O-] 2188058072 JRRVXWQZZXVBFV-UHFFFAOYSA-N 283.288 -0.397 5 10 CBBE O=[N+]([O-])c1ccc(CN2C[C@H](O)[C@@H](O)[C@@H]2CO)c(F)c1 2200878029 WBOYPDJWJOUEMR-SRVKXCTJSA-N 286.259 -0.368 5 10 CBBE O=C(O)[C@]1(n2ccnc2[N+](=O)[O-])CO[C@@]2(CCNC2)C1 2201747242 VJKAYYNAZBHCBT-WDEREUQCSA-N 282.256 -0.276 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCC2(CO)CNC2)[nH]1 2223051991 NBVHJICLPWNZAS-UHFFFAOYSA-N 255.278 -0.773 5 10 CBBE CC(=O)N(C)CCNCc1nn(C)cc1[N+](=O)[O-] 2223842938 YVGDNVIQRCOUAO-UHFFFAOYSA-N 255.278 -0.104 5 10 CBBE COCc1ncc([N+](=O)[O-])c(NOCC(=O)O)n1 2258628448 SGVSUVGKWHOVFR-UHFFFAOYSA-N 258.190 -0.041 5 10 CBBE CO[C@@H]1CCN(CCN=c2[nH]cncc2[N+](=O)[O-])C1 2267854781 YBZQMGJZWDPCEA-SECBINFHSA-N 267.289 -0.061 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N2CC[C@@H]2[C@@H](O)CO)n1 2270713956 ISJOYVBDFHRRHH-SFYZADRCSA-N 269.261 -0.793 5 10 CBBE CCc1ncc([N+](=O)[O-])c(N2C[C@H](O)C[C@H]2CN)n1 2271102460 OPUNHYQUKXGTPG-JGVFFNPUSA-N 267.289 -0.155 5 10 CBBE COCCN(C[C@@H](C)O)c1nc(=N)[nH]cc1[N+](=O)[O-] 2272485146 NURCYGWIYHLFMU-SSDOTTSWSA-N 271.277 -0.369 5 10 CBBE N=c1[nH]c(N2CCC[C@H]3CNC(=O)[C@@H]32)ncc1[N+](=O)[O-] 2279280205 JIHQHQUYKYLLPJ-POYBYMJQSA-N 278.272 -0.488 5 10 CBBE O=[N+]([O-])c1cnc(OC[C@@H]2CO[C@@H]3CNC[C@@H]3O2)nc1 2279758050 BRXIZTSKHXAFBU-AEJSXWLSSA-N 282.256 -0.481 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCCC2(O)CNC2)[nH]1 2286736404 VZHWWFOTYUWGAE-UHFFFAOYSA-N 283.288 -0.911 5 10 CBBE O=[N+]([O-])C1CN(Cc2ncnc3c2OCCO3)C1 2319797701 MYFLKFKQAPXQQN-UHFFFAOYSA-N 252.230 -0.291 5 10 CBBE NC(=O)C[C@@H]1CNCCN1c1cc([N+](=O)[O-])ccn1 2343298388 VEKJKHIMGLCSQO-SECBINFHSA-N 265.273 -0.357 5 10 CBBE Cc1nn(C)c(N2CC(O)(CN(C)C)C2)c1[N+](=O)[O-] 2343643897 OIAZIVURWSZXOD-UHFFFAOYSA-N 269.305 -0.251 5 10 CBBE C[C@@H]1CN(C)C[C@@H](CN=c2nc([N+](=O)[O-])n(C)[nH]2)O1 2344963498 QTAOZHRZAVDGED-HTQZYQBOSA-N 270.293 -0.724 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H](O)C3)[nH]1 2355335900 IVIDMWAHZRUWFH-DYUFWOLASA-N 280.284 -0.277 5 10 CBBE COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@H](O)C1 93088824 OCDDWSKMKNQIFO-AOOOYVTPSA-N 282.252 -0.219 5 10 CBBE CCC(CC)NC(=O)Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O 113593487 OUGGTONGXYFVCK-UHFFFAOYSA-N 284.272 -0.250 5 10 CBBE CNc1ccc([N+](=O)[O-])c(N(CCO)CCO)n1 130147812 SEZIEWOIDLBBKC-UHFFFAOYSA-N 256.262 -0.178 5 10 CBBE NNc1cccc(N2CCOC[C@H]2C(N)=O)c1[N+](=O)[O-] 159157110 IIEJWNZXOVNUHR-VIFPVBQESA-N 281.272 -0.429 5 10 CBBE NC(=O)[C@H](O)CNC(=O)c1c(F)ccc([N+](=O)[O-])c1F 228521480 XVFRHTAJWQLJKW-ZCFIWIBFSA-N 289.194 -0.551 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1CCNC[C@@H]1CCCO1 228596991 PCFZGTQTPZEXPT-JTQLQIEISA-N 268.273 -0.080 5 10 CBBE COc1cc(CNC[C@H](O)C(N)=O)cc([N+](=O)[O-])c1 228694629 PUEWTGMBSCONAG-JTQLQIEISA-N 269.257 -0.461 5 10 CBBE NNc1c(CN2C(=O)CNC2=O)cccc1[N+](=O)[O-] 229835947 PVCMRBRMSQLUEL-UHFFFAOYSA-N 265.229 -0.068 5 10 CBBE O=[N+]([O-])c1cc(CNC(CO)(CO)CO)c(F)cc1F 236496369 PDRSMVGOJJWTGI-UHFFFAOYSA-N 292.238 -0.322 5 10 CBBE NC(=O)C1(O)CCN(c2ccc([N+](=O)[O-])c(N)n2)CC1 312299999 NNFNVJIOHQVJRS-UHFFFAOYSA-N 281.272 -0.611 5 10 CBBE O=[N+]([O-])c1cnc2ccc(N(CCO)CCCO)nn12 347885938 IRFRRYHKUIKYEA-UHFFFAOYSA-N 281.272 -0.181 5 10 CBBE CN(Cc1nnnn1C)C(=O)c1cc([N+](=O)[O-])cn1C 532322687 YBVOMKWKURTYQF-UHFFFAOYSA-N 279.260 -0.271 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H](CO)CCF)nc1 593658515 QNNFXJRAHWSDTO-ZETCQYMHSA-N 293.276 -0.011 5 10 CBBE CN1C[C@H]2CN(c3nc(NN)ncc3[N+](=O)[O-])C[C@@H]2C1 706285175 NXPSESXQCXDFRQ-YUMQZZPRSA-N 279.304 -0.332 5 10 CBBE O=C(N[C@H]1COCC[C@H]1O)c1ccc([N+](=O)[O-])[nH]1 710867864 URUQAZKLVRBXMZ-JGVFFNPUSA-N 255.230 -0.198 5 10 CBBE NC(=O)N1CCN(c2nc(F)ncc2[N+](=O)[O-])CC1 722188319 JALSGUVXRQVCHA-UHFFFAOYSA-N 270.224 -0.275 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2COCCO2)n1 780350123 DWYMWKMPEQJWKA-ZETCQYMHSA-N 271.229 -0.100 5 10 CBBE CCOCCOCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1165482115 OXYOGJCVBPHWDL-UHFFFAOYSA-N 299.283 -0.092 5 10 CBBE CN(CC(N)=O)S(=O)(=O)c1ncccc1[N+](=O)[O-] 1327078360 CYPAEOYVOVSTBY-UHFFFAOYSA-N 274.258 -0.904 5 10 CBBE COC(=O)NCCNC(=O)c1nn(C)cc1[N+](=O)[O-] 1449542217 MYXXDFFRDJGKJR-UHFFFAOYSA-N 271.233 -0.586 5 10 CBBE Cc1nonc1CNCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1493544894 JQKKQAYDDOWXEW-PSASIEDQSA-N 283.288 -0.409 5 10 CBBE CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1[C@@H]2CNC[C@@H]21 1515554914 OYKDTNIOGZZZEV-JZYVYDRUSA-N 265.273 -0.533 5 10 CBBE NC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccn1 1523059325 DMDLDYCGKKNECJ-FTLITQJKSA-N 264.241 -0.611 5 10 CBBE CC(=O)N1CC(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)C1 1645305307 KQDQASPISMJDFE-UHFFFAOYSA-N 253.218 -0.265 5 10 CBBE C[C@@]1(NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)CCNC1=O 1647764819 WOBWCWUPBDZHKC-SECBINFHSA-N 287.663 -0.020 5 10 CBBE Cc1nn(C)c(C(=O)N[C@H]2CCNC2=O)c1[N+](=O)[O-] 1648938844 KLTYQUJFXDGLCO-LURJTMIESA-N 267.245 -0.745 5 10 CBBE CN1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1CO 1655748566 RZYHKRZRELOZSU-QMMMGPOBSA-N 295.299 -0.799 5 10 CBBE Cn1c(C(=O)NCCN2CCOCC2)cnc1[N+](=O)[O-] 1850198083 GBGOEGUYFSGNGT-UHFFFAOYSA-N 283.288 -0.610 5 10 CBBE N[C@@H](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(O)O 1865960053 FRSJFNJXBCKGAB-VIFPVBQESA-N 269.257 -0.049 5 10 CBBE N=c1nc(N2CC[C@@](F)(CO)C2)c([N+](=O)[O-])c[nH]1 1917107860 BUUDCATYZFYZJC-VIFPVBQESA-N 257.225 -0.292 5 10 CBBE NC[C@H]1C[C@@H](F)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 1923590261 AORHXHGSNYCBJW-HTQZYQBOSA-N 271.252 -0.311 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCNC12CC2 1925548063 JEMIZKNUOULLGA-QMMMGPOBSA-N 265.273 -0.198 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)CN[C@@H]2CCC[C@H]21 1926111547 IKIDBNCKKCMTRJ-XSSZXYGBSA-N 267.245 -0.262 5 10 CBBE COC[C@](C)(CO)CN=c1[nH]c(=N)[nH]c(C)c1[N+](=O)[O-] 1926981152 BEMLOGGQPYEWSH-NSHDSACASA-N 285.304 -0.415 5 10 CBBE N=c1[nH]c(N2C[C@@H]3C[C@@H](O)[C@H]3C2)ncc1[N+](=O)[O-] 1965581211 OGQXNMKGUXRIEY-VMHSAVOQSA-N 251.246 -0.386 5 10 CBBE O=[N+]([O-])C1CN(S(=O)(=O)[C@H]2CCCC[C@@H]2O)C1 2016887678 ODHISGCQARJWIR-IUCAKERBSA-N 264.303 -0.419 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCC[C@](N)(CO)C2)n1 2027055049 RROKLBDSBIHQQQ-SNVBAGLBSA-N 255.278 -0.382 5 10 CBBE N[C@H]1COCC[C@@H]1N=c1[nH]c(Cl)ncc1[N+](=O)[O-] 2044047539 UOZGOTVAOYRKEJ-WDSKDSINSA-N 273.680 -0.012 5 10 CBBE O=C(O)[C@H]1C[C@@H](Oc2ncc([N+](=O)[O-])cn2)CN1 2048287950 HNUYQWQCIFDXID-RNFRBKRXSA-N 254.202 -0.421 5 10 CBBE CN(c1ncc([N+](=O)[O-])c(=N)[nH]1)[C@@H]1[C@@H]2CNC[C@@H]21 2053534363 AMUHQQNAGYIVCE-UQWHLADISA-N 250.262 -0.549 5 10 CBBE Nc1ccnc(NC2(CCO)CNC2)c1[N+](=O)[O-] 2053553583 NYEHXCVFWQJLHW-UHFFFAOYSA-N 253.262 -0.292 5 10 CBBE C[C@@H]1C[C@H](N=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])CCN1 2053690174 SMMXDUNASQLVNL-RNFRBKRXSA-N 252.278 -0.228 5 10 CBBE C[C@H](CC1CNC1)N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2053711045 BAVDIGNAEXKIFH-ZCFIWIBFSA-N 252.278 -0.371 5 10 CBBE C[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])C1CNC1 2066471882 MXYIXACKJAVUOK-ZCFIWIBFSA-N 253.262 -0.334 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@@H](O)CC12CNC2 2066534109 NCFLKISIQPCABA-ZETCQYMHSA-N 253.262 -0.759 5 10 CBBE O=[N+]([O-])c1c(NC2([C@H](O)CO)CC2)ccnc1O 2069745136 VJWSNUZKRQUTOJ-SSDOTTSWSA-N 255.230 -0.007 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@]23CCOC3)[nH]1 2077600227 WKPBXBQMYPOILD-GMSGAONNSA-N 251.246 -0.190 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)N2C[C@H](F)[C@H](O)C2)c1 2092768369 PRLLGSBDXLEBIQ-DTWKUNHWSA-N 291.260 -0.307 5 10 CBBE NNc1ncnc(N2CC(N3CCC3)C2)c1[N+](=O)[O-] 2095922621 ODHVOFQYGMLQGV-UHFFFAOYSA-N 265.277 -0.435 5 10 CBBE 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Cc1c([N+](=O)[O-])c(=N[C@H](CCC(N)=O)C(=O)O)[nH]n1C 2207478692 RLURKBUOEPCKSD-ZCFIWIBFSA-N 285.260 -0.811 5 10 CBBE CC1CC(Nc2ncc([N+](=O)[O-])c(=N)[nH]2)(C(N)=O)C1 2231886827 BFDUOBZSFAVMOS-UHFFFAOYSA-N 266.261 -0.137 5 10 CBBE Cn1c(C(=O)N[C@@H]2CCC[C@@H](O)[C@H]2O)ccc1[N+](=O)[O-] 2232550753 ZGHSOPOVLYGWNW-ZOFUNIGCSA-N 283.284 -0.063 5 10 CBBE O=[N+]([O-])c1cccc(CN2CC[C@](O)(CO)[C@H](O)C2)c1 2234102793 AOEVKTRVGQHFRN-OLZOCXBDSA-N 282.296 -0.115 5 10 CBBE N[C@@H](CO)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 2249495586 DZPRGGDWJRYDRY-ZETCQYMHSA-N 260.271 -0.312 5 10 CBBE C[C@@H](O)[C@@H](CO)N=c1[nH]c(C2CC2)ncc1[N+](=O)[O-] 2271076998 VVSHZEUBLXPRFE-HTRCEHHLSA-N 268.273 -0.162 5 10 CBBE O=C(NCCC(CO)CO)c1ccc([N+](=O)[O-])cn1 2278145736 FNCFLCYDBANKBH-UHFFFAOYSA-N 269.257 -0.290 5 10 CBBE CC1(C)C(=O)NC[C@@H]1N=c1[nH]c(NN)ncc1[N+](=O)[O-] 2281270140 IBFWEJDFHBVNCL-LURJTMIESA-N 281.276 -0.971 5 10 CBBE COC(=O)[C@H](CO)N=c1[nH]c(C2CC2)ncc1[N+](=O)[O-] 2286678994 XVZOPTQJNCIAQT-ZETCQYMHSA-N 282.256 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5 10 CBBE COC[C@H](O)CNc1ncnc(NN)c1[N+](=O)[O-] 87879977 KNFUGKOABROAJZ-RXMQYKEDSA-N 258.238 -0.910 5 10 CBBE O=C(c1cc([N+](=O)[O-])ccc1F)N1C[C@H](O)[C@H](O)C1 93089482 XFCZSNIVMNPSMD-AOOOYVTPSA-N 270.216 -0.089 5 10 CBBE COc1c(-n2cc([N+](=O)[O-])c(C(=O)O)n2)nc[nH]c1=O 229750321 BBMUMMGFZAESRS-UHFFFAOYSA-N 281.184 -0.429 5 10 CBBE CO[C@@H]1C[C@@H](CO)N(c2ncc([N+](=O)[O-])c(N)n2)C1 284601720 RCAOKVHPBUJBMK-NKWVEPMBSA-N 269.261 -0.447 5 10 CBBE O=[N+]([O-])c1cnc2ccc(N3CCN(CCO)CC3)nn12 301848565 VMTCARGHLCXSII-UHFFFAOYSA-N 292.299 -0.248 5 10 CBBE Nc1ccc([N+](=O)[O-])c(N2CCC(O)(CO)CC2)n1 314186041 NLFRSYZTRRIACH-UHFFFAOYSA-N 268.273 -0.104 5 10 CBBE Nc1c(CN2C[C@@H](O)[C@H](CO)C2)cccc1[N+](=O)[O-] 316489288 XKCCUCFCZKRTSG-GXSJLCMTSA-N 267.285 -0.038 5 10 CBBE Nc1ncnc(NCCN2CCC(O)CC2)c1[N+](=O)[O-] 321383752 PWWVZZMHGNTCEE-UHFFFAOYSA-N 282.304 -0.164 5 10 CBBE Cn1c(C(=O)NC[C@H](N)C(=O)O)ccc1[N+](=O)[O-] 322976029 YBRFGDNVJOUKCQ-YFKPBYRVSA-N 256.218 -0.925 5 10 CBBE COC(=O)[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 339734393 SSNCXOWKVYFHEB-MRVPVSSYSA-N 297.271 -0.402 5 10 CBBE C[C@H]1CN(CCO)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 416309485 NGALURTYSHWTIN-BDAKNGLRSA-N 297.315 -0.155 5 10 CBBE O=C1CN(S(=O)(=O)c2ncccc2[N+](=O)[O-])CCN1 594743973 DFKQFEUNQYPPGL-UHFFFAOYSA-N 286.269 -0.890 5 10 CBBE O=C(N[C@H]1CCNC1=O)c1cc(O)ccc1[N+](=O)[O-] 597858017 XERPYHMPIJZHAF-QMMMGPOBSA-N 265.225 -0.081 5 10 CBBE CN(C)C[C@H](O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 690325803 CIFVIEXZJIULBC-VIFPVBQESA-N 285.304 -0.828 5 10 CBBE CNc1nc(C)c([N+](=O)[O-])c(N[C@@H](C)[C@@H](O)CO)n1 698948484 DUDMZGHUDOYYEG-FSPLSTOPSA-N 271.277 -0.111 5 10 CBBE O=[N+]([O-])c1c(N2C[C@H](CO)[C@@H](CO)C2)ccnc1O 705357688 HWGIEXSSZBDGEB-HTQZYQBOSA-N 269.257 -0.268 5 10 CBBE NCc1cn(C2CN(c3ncc([N+](=O)[O-])cn3)C2)nn1 713296962 ZZKOBHDCGKGGIZ-UHFFFAOYSA-N 276.260 -0.504 5 10 CBBE COC[C@@H]1CNCCN1c1c([N+](=O)[O-])ncn1C 900450334 MMTRRGGBJDYFIG-QMMMGPOBSA-N 255.278 -0.247 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H](O)[C@@H]2CCCO2)n1 1118946776 KHOSPKDKURHFHX-IUCAKERBSA-N 284.272 -0.402 5 10 CBBE CC(F)(F)C(=O)NCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1283163342 AKLCEFRPNBQHRM-RNFRBKRXSA-N 279.243 -0.071 5 10 CBBE C[C@H]1CN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)CC(=O)N1C 1296893454 ZUTLDNNEPLGHCD-ZETCQYMHSA-N 293.283 -0.125 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CC=C[C@@H]1CO 1558108227 XQTGPQZUMGMSIY-SECBINFHSA-N 279.252 -0.484 5 10 CBBE CCc1nn(C)c(N2C[C@H]3C(=O)NC(=O)[C@H]3C2)c1[N+](=O)[O-] 1559195776 VJFJSLUSVSRNAS-KNVOCYPGSA-N 293.283 -0.401 5 10 CBBE COC[C@H](CO)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1568452288 JDSDNOHCXXGSMF-ONGXEEELSA-N 284.268 -0.248 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCn2nncc2C1 1616584624 ZPOAQCOWLTWXDV-UHFFFAOYSA-N 291.271 -0.185 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)NC(C)(C)CO 1633344371 OFYVYTFKRORPAU-UHFFFAOYSA-N 256.262 -0.013 5 10 CBBE Cc1nc(N2CCCN(CC(N)=O)CC2)ncc1[N+](=O)[O-] 1639312538 XVJWQKYJWILSHP-UHFFFAOYSA-N 294.315 -0.309 5 10 CBBE O=C(N[C@@H]1COC[C@@H]1O)c1cc(O)cc([N+](=O)[O-])c1 1642291127 NPBKMSBISHNJGM-ZJUUUORDSA-N 268.225 -0.210 5 10 CBBE CO[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1O 1642690055 UIQIVZXTAXUDQV-RKDXNWHRSA-N 254.246 -0.111 5 10 CBBE COC(=O)N1CC(C)(NC(=O)c2nn(C)cc2[N+](=O)[O-])C1 1644802906 WNTXZEVKSJGWCE-UHFFFAOYSA-N 297.271 -0.101 5 10 CBBE Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](CO)[C@@H](CO)C1 1650618099 AUPXOUQDGVNBCG-DTORHVGOSA-N 295.295 -0.150 5 10 CBBE CS(=O)(=O)[C@H]1CNC[C@@H]1Nc1cncc([N+](=O)[O-])c1 1877648596 RMMHOXZJJKOGIS-UWVGGRQHSA-N 286.313 -0.213 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@]2(CO)C[C@H](O)C2)[nH]1 1889016385 AYDFGBXLRZANFT-DKTWLAJQSA-N 268.273 -0.249 5 10 CBBE Cc1cc(=N[C@@H]2CCNC[C@@H]2O)c([N+](=O)[O-])c[nH]1 1917818975 FXGAROGHWNMTRL-KCJUWKMLSA-N 252.274 -0.145 5 10 CBBE C[C@@H](CCN=c1nc([N+](=O)[O-])[nH]n1C)[S@](C)=O 1997004481 QFXOBIVDCWKIRU-HQRLLJBISA-N 261.307 -0.286 5 10 CBBE CO[C@H]1CN(c2nc(=N)[nH]cc2[N+](=O)[O-])C[C@H]1F 2029808854 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VLMHBNJVWOHUPS-ZETCQYMHSA-N 256.262 -0.534 5 10 CBBE Nc1ncnc(N[C@@H]2CCNC(=O)C2)c1[N+](=O)[O-] 2066252067 JIZPALGVGRVSBY-RXMQYKEDSA-N 252.234 -0.343 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[C@H]2N)n1 2066471531 HXWIREFQHPSAIU-RNFRBKRXSA-N 253.262 -0.062 5 10 CBBE CNC1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 2068538525 ZKWNRHPHOBPHAD-UHFFFAOYSA-N 253.262 -0.341 5 10 CBBE Cc1[nH]c(=N)nc(NC2(CO)COC2)c1[N+](=O)[O-] 2068962244 RLBZBVJNZXHQGR-UHFFFAOYSA-N 255.234 -0.721 5 10 CBBE COCC1(Nc2ncnc(N)c2[N+](=O)[O-])CNC1 2070573496 SHMDGASGPXWEOY-UHFFFAOYSA-N 254.250 -0.633 5 10 CBBE C[C@](NC(=O)N1CC([N+](=O)[O-])C1)(C(=O)O)C1CC1 2071558505 NVCBWBZWBGROSB-SNVBAGLBSA-N 257.246 -0.090 5 10 CBBE NC(=O)C[C@@H](N)C(=O)Nc1cc([N+](=O)[O-])ccn1 2082427698 QPXOXGKLYHVRMO-ZCFIWIBFSA-N 253.218 -0.869 5 10 CBBE Cc1cc([N+](=O)[O-])cn(C[C@H](O)CN(C)C)c1=O 2083039618 XGBLCLAJKWYSCO-SNVBAGLBSA-N 255.274 -0.013 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H](CO)CCCO)n1 2090374681 OYCPRJAGIPVGMU-SSDOTTSWSA-N 271.277 -0.179 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@H]3[C@H](O)C[C@H]3C2)n1 2095043534 VQKXTBNGUSOREB-SHYZEUOFSA-N 266.261 -0.513 5 10 CBBE CC1(CNS(=O)(=O)c2cncc([N+](=O)[O-])c2)CNC1 2112148427 YILXBIKMMMGTNE-UHFFFAOYSA-N 286.313 -0.122 5 10 CBBE COCC1(C(=O)O)CN(c2c([N+](=O)[O-])cnn2C)C1 2112834683 NFWNBWPZSKIZAK-UHFFFAOYSA-N 270.245 -0.134 5 10 CBBE N[C@@H]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H]1O 2116188709 MSJXDCXPCWJKDO-ZXFLCMHBSA-N 268.273 -0.249 5 10 CBBE CCNc1ncnc(N(CCN)CCN)c1[N+](=O)[O-] 2117291283 VBIKWPKWWQXGHF-UHFFFAOYSA-N 269.309 -0.460 5 10 CBBE CN(C)[C@@H]1CNC[C@H]1Oc1ccc([N+](=O)[O-])c(N)n1 2119768823 ZCBRDWIRFGFSNS-RKDXNWHRSA-N 267.289 -0.147 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC2(CC[C@H]2O)C1 2123111725 MURMARNMMVDHEO-SECBINFHSA-N 266.257 -0.225 5 10 CBBE Cn1[nH]c(=Nc2nc(NN)ncc2[N+](=O)[O-])cc1F 2126434777 DTLDTFFZOVJIKW-UHFFFAOYSA-N 268.212 -0.292 5 10 CBBE CN1CC[C@](CN)(Oc2nccc(N)c2[N+](=O)[O-])C1 2128257461 CAVJKPGRXDOYJY-LLVKDONJSA-N 267.289 -0.016 5 10 CBBE 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HFXMJNRFXQTZNK-RKDXNWHRSA-N 267.289 -0.105 5 10 CBBE Nc1nc[nH]c(=NCC[C@]2(O)CCOC2)c1[N+](=O)[O-] 404213744 XQMUPVMVGGUTOA-JTQLQIEISA-N 269.261 -0.658 5 10 CBBE CC[C@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)C(=O)OC 591973575 IPOGRABZLDPQIH-ZCFIWIBFSA-N 269.261 0.000 5 10 CBBE Nc1ccc(NC[C@@]2(OCCO)CCOC2)nc1[N+](=O)[O-] 596427960 GGVOZVCZXRKAKI-LBPRGKRZSA-N 298.299 0.152 5 10 CBBE COc1cc([N+](=O)[O-])ccc1C(=O)N1CC(O)(CO)C1 597702979 QSPCOXNYEPAHCP-UHFFFAOYSA-N 282.252 -0.217 5 10 CBBE O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCO[C@H]2CNC[C@H]21 686545563 UIENOKGRVCLIHI-ZJUUUORDSA-N 266.257 -0.264 5 10 CBBE NNc1cc(S(=O)(=O)NN2CCC2)ccc1[N+](=O)[O-] 686789312 FZUODYWBQXKXIL-UHFFFAOYSA-N 287.301 -0.221 5 10 CBBE CCn1nnnc1Sc1ncnc(NN)c1[N+](=O)[O-] 706585745 FGZDLANLVKVRNJ-UHFFFAOYSA-N 283.277 -0.172 5 10 CBBE NCC1CN(S(=O)(=O)c2cncc([N+](=O)[O-])c2)C1 712559054 GZLNKVUNGFIJQW-UHFFFAOYSA-N 272.286 -0.431 5 10 CBBE NS(=O)(=O)C1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 713963119 HIRWUFAZKDUGTR-UHFFFAOYSA-N 288.285 -0.526 5 10 CBBE C[C@@H](O)[C@H](O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 717282966 XDTJZAMRBPHWPH-LDYMZIIASA-N 268.269 -0.005 5 10 CBBE NNc1ncnc(NC[C@H]2C[C@@H](O)C2)c1[N+](=O)[O-] 720929057 SEFURHKAHORJOS-OLQVQODUSA-N 254.250 -0.147 5 10 CBBE C[C@H](NS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1)C(N)=O 723694222 QUJCDUURJQHLLF-YFKPBYRVSA-N 291.260 -0.114 5 10 CBBE CCN(OC)C(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 844067449 NJHDVGMOVCTALF-UHFFFAOYSA-N 271.233 -0.542 5 10 CBBE NC(=O)N[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1116409023 HHFKRHXKCBMLMJ-MRVPVSSYSA-N 296.287 -0.549 5 10 CBBE Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)CO 1179850725 HQOUMSWEKCLSFW-SSDOTTSWSA-N 255.230 -0.740 5 10 CBBE C[C@@H](O)CN(Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)CO 1193486125 XDPMPKKYNRICDM-RKDXNWHRSA-N 272.305 -0.108 5 10 CBBE COC(=O)[C@](C)(CO)NC(=O)c1cc([N+](=O)[O-])cnc1C 1570231121 MQGGONSYQABHPO-LBPRGKRZSA-N 297.267 -0.048 5 10 CBBE O=C(N[C@@H]1CCOC[C@H]1O)c1[nH]nc([N+](=O)[O-])c1Cl 1594553211 AWLKXMYHMXEMFT-RFZPGFLSSA-N 290.663 -0.149 5 10 CBBE CC(C)(C)OCC(=O)NCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1703154359 YXUPOTKGERBUQY-RKDXNWHRSA-N 287.316 -0.301 5 10 CBBE CN(C)CCC(=O)NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1759266365 XBZSEVXLQJTCEW-GHMZBOCLSA-N 298.343 -0.822 5 10 CBBE O=C(OCc1cc([N+](=O)[O-])n[nH]1)[C@@H]1COCCO1 1852568185 WJVGYBPOWGHRPQ-ZETCQYMHSA-N 257.202 -0.224 5 10 CBBE Cn1cc([N+](=O)[O-])c(CSC[C@H](NC=O)C(=O)O)n1 1882730281 WJOHGCYVXVUKAI-ZETCQYMHSA-N 288.285 -0.239 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC(CO)(CO)C2)n1 1915002136 VSEMPWBIAGGJSL-UHFFFAOYSA-N 269.261 -0.934 5 10 CBBE C[C@@]1(CO)CCN1C(=O)Cn1cc([N+](=O)[O-])cn1 2035995743 NMTILXNNTBVBPI-JTQLQIEISA-N 254.246 -0.225 5 10 CBBE CN=c1[nH]c(=NCCC[C@@H](C)O)[nH]cc1[N+](=O)[O-] 2039924840 PYHHJQFPHYLEKO-SSDOTTSWSA-N 255.278 -0.157 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1[C@@H]2CCOC[C@H]21 2041249700 VEBNOFIBVPYNEB-XLPZGREQSA-N 253.262 -0.160 5 10 CBBE O=C(CNCCO)NCc1cccc([N+](=O)[O-])c1 2049615106 GDOYWOZCIPGAJN-UHFFFAOYSA-N 253.258 -0.207 5 10 CBBE Nc1cc(N[C@@H]2CNCC[C@H]2O)ncc1[N+](=O)[O-] 2063352902 HXVCMEMVBIQEEN-VXNVDRBHSA-N 253.262 -0.293 5 10 CBBE CN=c1[nH]c(N[C@@H]2CC[C@@H]2CN)ncc1[N+](=O)[O-] 2065393791 VZJRNXMBQYNSNL-RNFRBKRXSA-N 252.278 -0.002 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)NCC2(O)CC2)c1 2066916507 LCVSAOYOYGYNIT-UHFFFAOYSA-N 273.270 -0.207 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2C[C@H]2OC)[nH]1 2067891561 GNRGXPYKDSOEJK-NKWVEPMBSA-N 253.262 -0.222 5 10 CBBE Nc1ncnc(N[C@@]2(CO)CCNC2)c1[N+](=O)[O-] 2070055349 YUCDMRANTNJBAG-VIFPVBQESA-N 254.250 -0.897 5 10 CBBE Nc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC(CO)C2)c1 2092541538 HFZLYOBOIBEDQA-UHFFFAOYSA-N 287.297 -0.210 5 10 CBBE NC(=O)c1ccc(NCC2(N)COC2)cc1[N+](=O)[O-] 2095059118 UADKDSQXBYUAIN-UHFFFAOYSA-N 266.257 -0.167 5 10 CBBE Nc1nc(O[C@@H]2CN[C@H]3COC[C@@H]23)ccc1[N+](=O)[O-] 2102155510 DHWWXOJOGPUVFH-BKPPORCPSA-N 266.257 -0.062 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CCO[C@@H](CC(=O)O)C1 2102936359 BEBBKLZFKSEUTR-LURJTMIESA-N 271.233 -0.597 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC1COC1 2109046452 KXIJDXCGOAHSCG-UHFFFAOYSA-N 288.285 -0.443 5 10 CBBE C[S@@](=O)C1CN(C(=O)c2cc([N+](=O)[O-])ncc2N)C1 2115306421 RFXFHHJFBJMZFL-LJQANCHMSA-N 284.297 -0.225 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2C[C@@H](N)C[C@H](O)C2)[nH]1 2117109869 IIWUPLOZQBBOQM-YUMQZZPRSA-N 267.289 -0.648 5 10 CBBE CN=c1[nH]c(N2C[C@@H](C)[C@@H](CN)C2)ncc1[N+](=O)[O-] 2117181375 SGOIITJENDOOFB-SFYZADRCSA-N 266.305 -0.121 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CC[C@H]3C[C@H]2CN3)[nH]1 2117251039 SNGZWUBVSPQBDG-FXQIFTODSA-N 264.289 -0.228 5 10 CBBE CCN=c1ccc([N+](=O)[O-])c(N[C@@H]2COC[C@H]2N)[nH]1 2117256202 YSAZQOLKVWFYDG-HTQZYQBOSA-N 267.289 -0.019 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@H]3C[C@H]2CN3)[nH]1 2117256424 BBXQWYVCCWXXSM-RNJXMRFFSA-N 264.289 -0.567 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2NCC2(C)C)[nH]1 2117256513 CBZHZLXXQZXSKO-MRVPVSSYSA-N 266.305 -0.320 5 10 CBBE O=C1NCC2(CN(C(=O)c3ccc([N+](=O)[O-])o3)C2)N1 2121209084 MNIWPBYQSREJHS-UHFFFAOYSA-N 266.213 -0.305 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCN[C@H]2C[C@@H]21 2121234629 IWOKHADYJUTCKP-BBBLOLIVSA-N 265.273 -0.342 5 10 CBBE Cc1cc(O[C@H]2CS(=O)(=O)C[C@@H]2N)ncc1[N+](=O)[O-] 2121465730 QMSJYSVUHNKDRF-CBAPKCEASA-N 287.297 -0.199 5 10 CBBE Cc1cc([N+](=O)[O-])c(O[C@@H]2CS(=O)(=O)C[C@H]2N)cn1 2121492150 YCDFYOOZKSKLEG-GMSGAONNSA-N 287.297 -0.199 5 10 CBBE Cc1cccc([N+](=O)[O-])c1N1C[C@H](O)[C@H](O)[C@@H]1CO 2136111978 HKAWVSMOJAXAPH-JBLDHEPKSA-N 268.269 -0.194 5 10 CBBE C[C@]1(O)CN(c2ccc([N+](=O)[O-])c(N)n2)CC[C@H]1O 2136884268 RAQRCTHCHWEBBF-KCJUWKMLSA-N 268.273 -0.106 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCCc2nnnn2C)[nH]n1C 2142493130 PNNUKUGAGPVTFX-UHFFFAOYSA-N 266.265 -0.763 5 10 CBBE NNc1ccc(S(=O)(=O)Nn2cnnc2)c([N+](=O)[O-])c1 2145637136 QJTYXZAJYSVVAN-UHFFFAOYSA-N 299.272 -0.596 5 10 CBBE Cc1nc(NN)nc(N2C[C@@H]3C[C@]3(CO)C2)c1[N+](=O)[O-] 2146310768 MDNJIPGMVZHPND-WRWORJQWSA-N 280.288 -0.203 5 10 CBBE CCNc1ncnc(N[C@@H]2CN(C)C[C@H]2O)c1[N+](=O)[O-] 2146541827 XDIDNFVUYMURDM-HTQZYQBOSA-N 282.304 -0.097 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2C[C@H]3OCC[C@H]23)c1 2151899982 YORMJWBTHGTBJO-DDHJBXDOSA-N 282.300 -0.081 5 10 CBBE COC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(N)=O 2152356723 CHPYIZSIVJOPEG-MRVPVSSYSA-N 282.256 -0.394 5 10 CBBE O=C(O)[C@@]1(n2cc([N+](=O)[O-])cn2)CN[C@@]2(CCOC2)C1 2155239182 FUDMRJWWAIKLFX-QWRGUYRKSA-N 282.256 -0.276 5 10 CBBE CN=c1[nH]c(N2CC[C@@](O)(COC)C2)ncc1[N+](=O)[O-] 2157674838 SICACAPNCLVLCU-NSHDSACASA-N 283.288 -0.564 5 10 CBBE CN1CCCC[C@@H](N=c2[nH]c(NN)ncc2[N+](=O)[O-])C1 2158574607 SGEKINHYWXNGGT-MRVPVSSYSA-N 281.320 -0.012 5 10 CBBE NC[C@]1(Oc2ncc([N+](=O)[O-])cc2C(N)=O)CCOC1 2158606801 SYLXUCMUTCITSD-LLVKDONJSA-N 282.256 -0.415 5 10 CBBE Nc1ncnc(N(CCO)C[C@H]2CCCN2)c1[N+](=O)[O-] 2173957945 KHMJXCGFZGOPJS-MRVPVSSYSA-N 282.304 -0.482 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2[C@H]3CCCN[C@@H]32)[nH]1 2174035428 OGYQSNWJBRGRMV-XHNCKOQMSA-N 278.316 -0.259 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2CC[C@@]3(CNC(=O)N3)C2)[nH]1 2177691227 HQCDPZUEXCDTCF-LLVKDONJSA-N 278.272 -0.336 5 10 CBBE Nc1nc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)ccc1[N+](=O)[O-] 2182519434 BXLKFEHTYVYXFP-BJPCUFFRSA-N 280.284 -0.250 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCNC(=O)C2)[nH]1 2186333022 RYDUTTMXLADCPX-ZETCQYMHSA-N 280.288 -0.649 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NO[C@H](C(=O)O)C2CC2)n1 2186550437 WVMUPFJARCUYOC-QMMMGPOBSA-N 284.228 -0.147 5 10 CBBE CO[C@]1(C(=O)O)CCCN(C(=O)N2CC([N+](=O)[O-])C2)C1 2191503371 QYCUDFJVMJYFOP-LLVKDONJSA-N 287.272 -0.367 5 10 CBBE O=C(O)[C@@H](C[C@H]1CCCO1)NC(=O)N1CC([N+](=O)[O-])C1 2191516926 OGOYAKZUCYIZFO-RKDXNWHRSA-N 287.272 -0.321 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)N=c1[nH]nc(O)n1C 2199720222 COKZBNGKRXQJBI-UHFFFAOYSA-N 280.244 -0.076 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@]2(C)CCNC2=O)[nH]1 2200827110 ZEDVWOFRWANYEN-NSHDSACASA-N 280.288 -0.792 5 10 CBBE Nc1ccc(CN2C[C@H](O)[C@H](O)[C@H]2CO)cc1[N+](=O)[O-] 2201034922 PLUXFYMNCSETLC-GRYCIOLGSA-N 283.284 -0.925 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2COC3(CCC3)[C@@H]2O)[nH]1 2206480153 SORZLWKAMKEYCT-POYBYMJQSA-N 281.272 -0.686 5 10 CBBE CCn1ncc([N+](=O)[O-])c1C1(N)CS(=O)(=O)C1 2217262002 CTNOECRCQCVIMG-UHFFFAOYSA-N 260.275 -0.606 5 10 CBBE CO[C@H]1CN[C@H](CN=c2[nH]cncc2[N+](=O)[O-])C1 2219821881 CQPULWXDFBRGEG-JGVFFNPUSA-N 253.262 -0.405 5 10 CBBE O=C(N1CC([N+](=O)[O-])C1)[C@]12CCCO[C@H]1CNC2 2221330696 FFOMPAOARBYHJR-ONGXEEELSA-N 255.274 -0.758 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@@H]2CCCNC2=O)[nH]1 2223015914 GOLAMMAMJOFBSN-SSDOTTSWSA-N 253.262 -0.076 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@H](C)CS(N)(=O)=O)[nH]1 2223018892 YDOGMPFNLDRPOH-ZCFIWIBFSA-N 277.306 -0.678 5 10 CBBE O=[N+]([O-])c1cncnc1N1[C@H]2CC[C@H]1[C@@H](O)[C@@H](O)C2 2226993950 ZFFPNBAFJDIUPO-ZRUAGYDASA-N 266.257 -0.152 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CC(O)(C(=O)OC)C2)n1 2230781011 RVQBMWAQOOIKJL-UHFFFAOYSA-N 270.245 -0.465 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2[C@H]3CCNC[C@@H]32)n1 2240643082 TYGNRRWHJPTBRK-DKCNOQQISA-N 279.300 -0.200 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=NCC(CO)CO)[nH]1 2258641629 UYOGHGYHZBDKHE-UHFFFAOYSA-N 256.262 -0.618 5 10 CBBE CO[C@@H]1[C@H](O)C[C@H]1N=c1ccc([N+](=O)[O-])c(N)[nH]1 2258669186 VPKYWTJFQVQQCH-FKBGGTMYSA-N 254.246 -0.446 5 10 CBBE NNc1ncnc(N2CC[C@]3(O)C[C@H]3C2)c1[N+](=O)[O-] 2265206249 KZGGOKCXZRWZNK-WKEGUHRASA-N 266.261 -0.369 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC[C@H]2[C@H](O)CO)c1 2270701682 QXANUOLPIXULNB-GXSJLCMTSA-N 268.273 -0.188 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2CNC(=O)C2)[nH]1 2271159135 BJDQRJSZOCYXJO-LURJTMIESA-N 267.245 -0.747 5 10 CBBE O=C(N[C@]1(CO)CCNC1)c1ccc([N+](=O)[O-])cn1 2278222035 JPSZJHNXVZFBIT-LLVKDONJSA-N 266.257 -0.556 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NCCN2C(=O)CCC2=O)[nH]1 2286617565 TXWTVVBXOLVGKP-UHFFFAOYSA-N 279.256 -0.324 5 10 CBBE Nc1cccc(N2C[C@H](O)[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 2289397906 HJSQNNNXKKDKQI-INNHCVQGSA-N 283.284 -0.673 5 10 CBBE C[C@@H](O)[C@@H]1C[C@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 2310582905 DOXMCGOMBGJPSF-DSYKOEDSSA-N 254.246 -0.173 5 10 CBBE O=C(O)[C@]1(N2CC([N+](=O)[O-])C2)CC[C@H]2CNC[C@H]2C1 2347124832 YYWHDHQMJAWLCS-SBMIAAHKSA-N 269.301 -0.210 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1[C@H]2CC[C@@H]1[C@H](O)[C@H](O)C2 2357059510 FMHJHWUWABKDLK-SZACMFPPSA-N 284.247 -0.013 5 10 CBBE COC(=O)CNS(=O)(=O)c1ccc(N)c([N+](=O)[O-])c1 9558257 ZRPLJGJJGWKJIT-UHFFFAOYSA-N 289.269 -0.372 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)OC 36856911 CQANPYAECZRKSK-QMMMGPOBSA-N 285.256 -0.320 5 10 CBBE CC(C)(CO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 37888309 IQWSYIDPJFHFPX-VIFPVBQESA-N 258.278 -0.487 5 10 CBBE C[C@](O)(CN1C(=O)C(=O)c2cc([N+](=O)[O-])ccc21)C(=O)O 80198376 UTVGMMJILZMAMD-LBPRGKRZSA-N 294.219 -0.040 5 10 CBBE NC(=O)[C@H]1CNCCN1c1cc(F)cc([N+](=O)[O-])c1 88673921 WWDLMWLDQBECNK-SNVBAGLBSA-N 268.248 -0.003 5 10 CBBE CN(C)C(=O)[C@@H]1CNCCN1c1ccncc1[N+](=O)[O-] 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GQBUMLDKYDLCGY-CBAPKCEASA-N 287.272 -0.369 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@]2(CO)C[C@@H](O)C23CCC3)[nH]1 2193976128 ZXDOSIUYLDUDDA-SKDRFNHKSA-N 282.300 -0.172 5 10 CBBE O=C(O)c1cc(=NC[C@@H]2CCNC2=O)[nH]cc1[N+](=O)[O-] 2196757431 UVQOJICHVYMDBQ-LURJTMIESA-N 280.240 -0.342 5 10 CBBE CNc1cccc(N2C[C@H](O)[C@@H](O)[C@H]2CO)c1[N+](=O)[O-] 2201054785 ORUOKQPRLQKFGZ-SCVCMEIPSA-N 283.284 -0.461 5 10 CBBE CN(C)C[C@@H]1COC[C@@H]1N=c1ccc(N)c([N+](=O)[O-])[nH]1 2206383752 PTOWETTWLSRGOI-SCZZXKLOSA-N 281.316 -0.018 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC[C@H]2COCCN2)[nH]1 2223053987 XALUMZFBIVJSSF-QMMMGPOBSA-N 255.278 -0.367 5 10 CBBE C[C@H]1NC(=O)N(Cc2nn(C)cc2[N+](=O)[O-])C1=O 2223855943 XXUNLKXMGYXRCF-RXMQYKEDSA-N 253.218 -0.231 5 10 CBBE COC[C@@H]1[C@H](O)[C@H](O)CN1c1ncccc1[N+](=O)[O-] 2225516191 CSHIJYCVVLMBOH-BBBLOLIVSA-N 269.257 -0.453 5 10 CBBE NNc1cc(NCCn2ncnn2)ccc1[N+](=O)[O-] 2226070135 SNJKTTYQRBLKJJ-UHFFFAOYSA-N 264.249 -0.021 5 10 CBBE C[C@](O)(CO)[C@H]1CCN(c2ncncc2[N+](=O)[O-])C1 2226981478 ORZYOMRXZCUJBY-KWQFWETISA-N 268.273 -0.046 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CCNC[C@@]2(C)CO)n1 2230796646 KTRZOPIQAFAHRG-NSHDSACASA-N 269.305 -0.028 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H]2CN[C@H](CO)[C@@H]2C1 2235558755 UDMIUPVZIQQGOJ-QXFUBDJGSA-N 280.284 -0.425 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC(CN2CCNCC2)C1 2236845791 MRIDIXZYJCAXLE-UHFFFAOYSA-N 280.332 -0.330 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@H]2COC[C@@H]2N)[nH]1 2258649999 WSDBSJBOWSSYGY-BQBZGAKWSA-N 253.262 -0.493 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2C[C@H](O)C[C@H]2C(=O)O)n1 2271074540 UABZCVWHNPLWPA-RQJHMYQMSA-N 268.229 -0.283 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N2C[C@@H](O)[C@H](O)C2)n1 2271085568 KAVAFTMRAZASBL-HTQZYQBOSA-N 270.245 -0.927 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCC(=O)N(C)C)[nH]1 2271091158 NGYKLHCZJGVCSK-UHFFFAOYSA-N 269.261 -0.547 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CC[C@@H](C(N)=O)CC1 2272374239 LVSKNCKKRNWPJG-KNVOCYPGSA-N 268.277 -0.399 5 10 CBBE CNC[C@@]1(O)CCCN(c2ncnc(N)c2[N+](=O)[O-])C1 2286343372 XTMTWNVNFVHYNU-NSHDSACASA-N 282.304 -0.482 5 10 CBBE CO[C@@H]1[C@H](O)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cnc1O 2286718560 AITIEUSCCLELFY-HLTSFMKQSA-N 283.240 -0.427 5 10 CBBE CN(CC(F)(F)C(=O)O)C(=O)Cn1ccc([N+](=O)[O-])n1 2295295013 WCRSVHGDARPHFP-UHFFFAOYSA-N 292.198 -0.030 5 10 CBBE NC[C@H]1CN(c2ccn3ncc([N+](=O)[O-])c3n2)CCO1 2295876098 BNFRGRIEIFLLNG-QMMMGPOBSA-N 278.272 -0.199 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=NC[C@H]3[C@H]4CNC[C@@H]34)[nH]c12 2295923218 VRCBQFDTNXJWBU-AYMMMOKOSA-N 274.284 -0.063 5 10 CBBE O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H](O)[C@@H](O)[C@H]2C3)nc1 2330383235 SNRVVUQRCDLAFZ-NORCUCSASA-N 266.257 -0.295 5 10 CBBE CCN1CCN(c2ncnc(NN)c2[N+](=O)[O-])CC1 40610649 MJTUATNMAKYXNF-UHFFFAOYSA-N 267.293 -0.188 5 10 CBBE CN1C(=O)C[C@@H](Nc2nc(N)ccc2[N+](=O)[O-])C1=O 128088977 PMXPEZBYXIWFKD-RXMQYKEDSA-N 265.229 -0.259 5 10 CBBE CCOCCNCCn1cc([N+](=O)[O-])cnc1=O 128709369 XFIMYNNLPVALPN-UHFFFAOYSA-N 256.262 -0.222 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)NCC(F)(F)CO)cn1 193923092 LQDDVUSTSIJBFP-UHFFFAOYSA-N 297.239 -0.104 5 10 CBBE NNc1cc(NC[C@@H](O)C(N)=O)cc([N+](=O)[O-])c1 228827333 MNDBUKGRXJRIRV-MRVPVSSYSA-N 255.234 -0.862 5 10 CBBE CO[C@H]1CN(c2ncnc(N)c2[N+](=O)[O-])C[C@@H]1OC 234885993 RSATWVNXNIGEOY-BQBZGAKWSA-N 269.261 -0.183 5 10 CBBE C[C@H](Nc1nc(NN)ncc1[N+](=O)[O-])c1nncn1C 235522001 LHAHPVWVXBUONY-YFKPBYRVSA-N 279.264 -0.028 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NCCOCC(F)F 350782482 KANHIXDYGQPDJO-UHFFFAOYSA-N 279.203 -0.416 5 10 CBBE C[C@@H]1CN2CCC[C@H]2CN1C(=O)Cn1cnc([N+](=O)[O-])n1 408152498 AUQNKKYGDPQHIY-ZJUUUORDSA-N 294.315 -0.119 5 10 CBBE CN(C)C1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1 593574209 MVYQYFOOEADEGJ-UHFFFAOYSA-N 286.313 -0.076 5 10 CBBE NC[C@]1(CO)COCCN1c1cc([N+](=O)[O-])ccn1 693891350 DTCNSVDJOLMYQH-NSHDSACASA-N 268.273 -0.484 5 10 CBBE CCNc1cc([N+](=O)[O-])cc(NC(C(N)=O)C(N)=O)n1 695283100 RKGMQKPVSXTOMI-UHFFFAOYSA-N 282.260 -0.827 5 10 CBBE O=[N+]([O-])c1ccc(CN2C[C@H](O)C[C@@H]2CO)nc1 698213701 ROEFWNVNPGUROJ-GHMZBOCLSA-N 253.258 -0.083 5 10 CBBE O=C(N[C@H]1CNC[C@@H]1O)c1cc(F)cc([N+](=O)[O-])c1F 699916326 FJOMUBADXYIDMM-CBAPKCEASA-N 287.222 -0.065 5 10 CBBE NNc1ncnc(NCC2CS(=O)(=O)C2)c1[N+](=O)[O-] 701996427 LDKRIEWBTBOBKT-UHFFFAOYSA-N 288.289 -0.873 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CNC[C@H]2O)c1 702854145 ZLNSNZUUHJGORK-GZMMTYOYSA-N 280.284 -0.314 5 10 CBBE C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](O)CO 705081452 QTPVGEZLBPGRDK-LDYMZIIASA-N 268.269 -0.005 5 10 CBBE COc1ncnc(N[C@]2(CO)CCCNC2)c1[N+](=O)[O-] 711683284 YMUQZQXVSHEDGH-LLVKDONJSA-N 283.288 -0.080 5 10 CBBE O=[N+]([O-])c1c[nH]ccc1=N[C@@]1(CO)CCCNC1 711752872 NJHLNFBWSTTYFQ-NSHDSACASA-N 252.274 -0.062 5 10 CBBE C[C@@H](NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-])C(N)=O 723677764 RDDGLIGGJUWDEF-RXMQYKEDSA-N 291.260 -0.114 5 10 CBBE CCON(C)C(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 846505527 ZONHENSCFULRKG-UHFFFAOYSA-N 299.287 -0.374 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN2CC=C[C@H]2CO)c1 1175678143 MLDUXHNVKMTHGO-GXSJLCMTSA-N 268.273 -0.615 5 10 CBBE O=C(NC[C@H](O)Cn1ccnn1)c1cccc([N+](=O)[O-])c1 1299096968 ULCINIFQPFPVHM-NSHDSACASA-N 291.267 -0.023 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCC2(C1)OCCO2 1319629612 DLMVTHXNYWSKMX-UHFFFAOYSA-N 297.271 -0.448 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)OCC(=O)[C@H]1CCOC1 1323931667 VIKCIWXLTCRWJW-ZETCQYMHSA-N 284.228 -0.665 5 10 CBBE CN1CC(N2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)C1 1347771694 DEEZRLLJBSKAHN-UHFFFAOYSA-N 294.315 -0.610 5 10 CBBE NC(=O)C1(O)CN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 1472853803 PUYPPBUHXBSNDJ-UHFFFAOYSA-N 285.231 -0.737 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)NC2(C(N)=O)CC2)n1 1535209897 NKXAUXLKUUJULM-UHFFFAOYSA-N 267.245 -0.441 5 10 CBBE Cc1nn(C)c(C(=O)N2CC3(CNC(=O)O3)C2)c1[N+](=O)[O-] 1641652351 CLGOWPDBKVFESP-UHFFFAOYSA-N 295.255 -0.429 5 10 CBBE Cc1nonc1CN(C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1707376455 LVQXELJTQJJRDN-MWLCHTKSSA-N 297.315 -0.019 5 10 CBBE Cc1nc[nH]c1C(=O)NCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1745175739 HYKWKYPABCEXGI-RKDXNWHRSA-N 295.299 -0.428 5 10 CBBE N=c1[nH]c(=NCCN2C(=O)CSC2=O)[nH]cc1[N+](=O)[O-] 1871312558 DKXQGWODUVNWDY-UHFFFAOYSA-N 298.284 -0.673 5 10 CBBE CN(C(=O)N1CC([N+](=O)[O-])C1)[C@@]1(C(=O)O)CCOC1 1876136414 BWEFMSRZGJFSCD-JTQLQIEISA-N 273.245 -0.757 5 10 CBBE C[C@@]1(O)CCN(c2ncc([N+](=O)[O-])c(=N)[nH]2)C[C@@H]1O 1893340146 RZLKOKOJUMJVBL-OIBJUYFYSA-N 269.261 -0.881 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC2(CNC2)C1 1914234403 QVHPDEHXRGGTQQ-UHFFFAOYSA-N 265.273 -0.387 5 10 CBBE Cn1ncc([N+](=O)[O-])c1[C@H]1CC(=O)NC(=O)[C@H]1C(=O)O 1952155308 KFYHRAWRXKCVNY-FFWSUHOLSA-N 282.212 -0.841 5 10 CBBE COC[C@@](C)(CO)CNC(=O)c1c([N+](=O)[O-])cnn1C 1965400800 FUNAQJVKNCVSHR-LLVKDONJSA-N 286.288 -0.297 5 10 CBBE C[C@@H](CCN=c1nc([N+](=O)[O-])[nH]n1C)[S@@](C)=O 1997004482 QFXOBIVDCWKIRU-QVHKOIDPSA-N 261.307 -0.286 5 10 CBBE C[C@@H](CO)S(=O)(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2023717925 ZLOPSKBDSJPZLB-LURJTMIESA-N 261.259 -0.466 5 10 CBBE N=c1ccc([N+](=O)[O-])c(NCC(F)(F)C(N)=O)[nH]1 2029285726 ZMNUMOQSGHGYBA-UHFFFAOYSA-N 261.188 -0.065 5 10 CBBE Nc1ccnc(N[C@H]2CC(=O)NC2=O)c1[N+](=O)[O-] 2034957944 JSGDQCJWIIBKHE-YFKPBYRVSA-N 251.202 -0.601 5 10 CBBE O=[N+]([O-])c1cnc(Cl)[nH]c1=NC[C@H]1COC[C@@H]1O 2036573329 WNDSYJQTNUTVEW-FSPLSTOPSA-N 274.664 -0.121 5 10 CBBE CN1CCN[C@@H](CN=c2cc[nH]cc2[N+](=O)[O-])C1 2036983161 CCGXFVABAUVBOV-VIFPVBQESA-N 251.290 -0.273 5 10 CBBE NC(=O)C[C@H](N=c1cc[nH]cc1[N+](=O)[O-])C(=O)O 2041141614 QKDMGIODPHKWRT-LURJTMIESA-N 254.202 -0.848 5 10 CBBE NC1CC(O)(CN=c2[nH]c(Cl)ncc2[N+](=O)[O-])C1 2045135046 FWYOEXKFGLCZTR-UHFFFAOYSA-N 273.680 -0.276 5 10 CBBE N[C@@H]1CS(=O)(=O)C[C@@H]1Oc1cccc([N+](=O)[O-])n1 2057797207 PYXBBNKVZXFPQT-RQJHMYQMSA-N 273.270 -0.507 5 10 CBBE O=[N+]([O-])c1cccc(=N[C@@H]2CO[C@@H]3CNC[C@H]23)[nH]1 2057950680 UBLMVXUGVLMENL-IWSPIJDZSA-N 250.258 -0.190 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@H](O)CC23CNC3)n1 2066534092 MZSSCUKEUWJDNW-SSDOTTSWSA-N 253.262 -0.759 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N[C@]1(CO)CCNC1 2070018034 GZFTZLYVBWRTSP-SECBINFHSA-N 257.225 -0.340 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2[C@H]3CN[C@H]2C3)c1[N+](=O)[O-] 2082896875 ZYYXRYBQKSZRGJ-QYNIQEEDSA-N 250.262 -0.591 5 10 CBBE COCC[S@](=O)CCN=c1ncc([N+](=O)[O-])c[nH]1 2085948059 JFTAEQQCOATKPR-GOSISDBHSA-N 274.302 -0.386 5 10 CBBE COc1ncnc(N2C[C@@H](O)C[C@@H](O)C2)c1[N+](=O)[O-] 2105112890 GMWDFAUAKXVROR-KNVOCYPGSA-N 270.245 -0.675 5 10 CBBE COC(=O)[C@@H]1C[C@H]1Cn1cc([N+](=O)[O-])c(O)nc1=O 2115384987 IJJLVYWPNDZSNM-NTSWFWBYSA-N 269.213 -0.334 5 10 CBBE COC[C@@H]1C[C@H]1N=c1[nH]c(NN)nc(C)c1[N+](=O)[O-] 2117733478 XPVIBCCNRNAUGZ-NKWVEPMBSA-N 268.277 -0.152 5 10 CBBE CO[C@H]1COC[C@H]1Nc1ncnc(NN)c1[N+](=O)[O-] 2120779030 HRGLYCWXAULBSJ-RITPCOANSA-N 270.249 -0.504 5 10 CBBE Nc1ccc(N2CC[C@H](CO)[C@H](N)C2)nc1[N+](=O)[O-] 2122330392 ICUCSOCDVDXDGA-VXNVDRBHSA-N 267.289 -0.282 5 10 CBBE C[C@H](C[C@@H]1COCCN1)Oc1nc([N+](=O)[O-])nn1C 2128926439 LZIZHNYMUWERIA-HTQZYQBOSA-N 271.277 -0.131 5 10 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Nc1nc(OC[C@@H]2CCS(=O)(=O)N2)ccc1[N+](=O)[O-] 2089994200 WEZVEUVXRCYHOA-LURJTMIESA-N 288.285 -0.358 5 10 CBBE CN1C[C@@H](O)[C@H](Nc2nc(NN)ccc2[N+](=O)[O-])C1 2090349707 IJUAXDGRGQUHDC-HTRCEHHLSA-N 268.277 -0.638 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)NCC1COC1 2097859093 VODVXWHZLPPYOJ-UHFFFAOYSA-N 267.245 -0.348 5 10 CBBE CN=c1[nH]c(N[C@H](C(N)=O)C2CC2)ncc1[N+](=O)[O-] 2101465374 NARCREMZTDYDMP-ZETCQYMHSA-N 266.261 -0.476 5 10 CBBE CO[C@H](CCO)CNC(=O)Cn1cc([N+](=O)[O-])cn1 2112207603 FMYHUIYNKRYCIZ-SECBINFHSA-N 272.261 -0.695 5 10 CBBE N=c1[nH]c(N2CCC(O)(CN)CC2)ncc1[N+](=O)[O-] 2117175493 IEUMRQWXLAYGIS-UHFFFAOYSA-N 268.277 -0.913 5 10 CBBE CNC[C@@H](O)CN(C)c1ncnc(NC)c1[N+](=O)[O-] 2117213155 SLMXFTYALFCMSD-SSDOTTSWSA-N 270.293 -0.557 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCN[C@H](C)C2)[nH]1 2117363156 KCVCNZWEZUAUHB-SFYZADRCSA-N 266.305 -0.177 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC2[C@H]3COC[C@H]23)[nH]1 2118022328 BTLCLNPZGHBCFP-BQBZGAKWSA-N 265.273 -0.365 5 10 CBBE COCC1(CN=c2ccc(N)c([N+](=O)[O-])[nH]2)CNC1 2121533262 DNBFEPZRTWIPBP-UHFFFAOYSA-N 267.289 -0.358 5 10 CBBE CCCNc1ncnc(N[C@@H](CN)CO)c1[N+](=O)[O-] 2126182298 LQVNYRRAWRGPNY-ZETCQYMHSA-N 270.293 -0.062 5 10 CBBE CCCn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](CN)CO 2126184915 HSFCRZCYTAXRRN-QMMMGPOBSA-N 270.289 -0.144 5 10 CBBE COC(=O)[C@H](N)[C@@H](C)Oc1nccc(N)c1[N+](=O)[O-] 2128253563 XDHIOUHUVSEOOV-IYSWYEEDSA-N 270.245 -0.160 5 10 CBBE C[P@]1(=O)C[C@H](N)[C@@H](Oc2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2128259947 HNJQHNOBRCILKF-DOKIEFESSA-N 287.216 -0.121 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCN[C@H]3COC[C@H]32)n1 2132578923 IPNUOSOQALAOPC-GXSJLCMTSA-N 267.289 -0.499 5 10 CBBE O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1NC[C@@H](O)[C@H]1O 2136447430 VLHDJXAOUIXDQE-OPRDCNLKSA-N 267.241 -0.773 5 10 CBBE Cc1c([N+](=O)[O-])c(N2CCN[C@@H](CCO)C2)nn1C 2142483705 OOAAARDOVWOKEU-VIFPVBQESA-N 269.305 -0.203 5 10 CBBE Cc1nc([N+](=O)[O-])c(N2C[C@@]3(CO)C[C@]3(CO)C2)n1C 2146308396 AIYMDGOKAAZUNI-VXGBXAGGSA-N 282.300 -0.182 5 10 CBBE CN=c1nc(N2C[C@@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])c(C)[nH]1 2146321561 RKRJKCOSKKNASZ-UFBFGSQYSA-N 279.300 -0.025 5 10 CBBE C[C@@H]1CCN(c2nc(NN)ccc2[N+](=O)[O-])[C@H]1C(N)=O 2146460755 BUKWLHCIRLHCKQ-HZGVNTEJSA-N 280.288 -0.025 5 10 CBBE COc1ccc(C(=O)N(CCN)CCO)cc1[N+](=O)[O-] 2152160819 FLUOCMZVKBAGEU-UHFFFAOYSA-N 283.284 -0.003 5 10 CBBE CN=c1[nH]c(NCc2nnc(O)n2C)ncc1[N+](=O)[O-] 2157683627 IQYWHFSRTVMVSJ-UHFFFAOYSA-N 280.248 -0.705 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CCN(CCC(=O)O)CC1 2159179510 YSZMOBPLZGWLGM-UHFFFAOYSA-N 284.276 -0.680 5 10 CBBE NC1CC(O)(CNc2ncc(C(=O)O)cc2[N+](=O)[O-])C1 2163553058 QOBATLOVRPZGQG-UHFFFAOYSA-N 282.256 -0.048 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCn3nccc3C2)[nH]1 2165437214 KVMQGLKQUYIEFH-ZETCQYMHSA-N 275.272 -0.157 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC[C@@H]2Cc3nncn3C2)n1 2167732229 PSYFJWHDXXDHRZ-QMMMGPOBSA-N 277.288 -0.118 5 10 CBBE Nc1nc(N2CC[C@H](C(CO)CO)C2)ccc1[N+](=O)[O-] 2170659137 AOLWEAZPHGVVCC-QMMMGPOBSA-N 282.300 -0.001 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NCCN2CC=CC2)[nH]1 2173746474 ZPLMKRPDRFUPFR-UHFFFAOYSA-N 278.316 -0.056 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCC2CC(F)(CN)C2)[nH]1 2173747442 NLZONVSRSPCRGO-UHFFFAOYSA-N 284.295 -0.241 5 10 CBBE Cc1cc(N[C@@H]2C[C@H](O)[C@@H](O)[C@H]2O)nc(C)c1[N+](=O)[O-] 2174249454 SCWRTNAUHCWBDR-UFGYURQFSA-N 283.284 -0.126 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2[C@H]3CCCO[C@H]32)c1[N+](=O)[O-] 2176540192 UGGBBCYZNNHFPG-ZXFLCMHBSA-N 280.288 -0.010 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CCC(C2(O)CNC2)CC1 2176936635 XPNOJBVIFBCZGM-UHFFFAOYSA-N 281.316 -0.121 5 10 CBBE COC(=O)[C@H]1C[C@@H](Oc2nc(F)ncc2[N+](=O)[O-])CN1 2184618548 ZNSWSGZJEKDLRG-PHDIDXHHSA-N 286.219 -0.194 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1[C@H]2OCC[C@@H]2[C@H]1N 2186532652 MQKOMVYTZTVACG-UZRKRJFESA-N 281.272 -0.827 5 10 CBBE COc1nc(=NC[C@H]2CCN(C)C2=O)[nH]cc1[N+](=O)[O-] 2194628336 YUXAEXXQKVMVEC-SSDOTTSWSA-N 281.272 -0.295 5 10 CBBE COCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C)c1=O 2203273365 FEYAGENPILYMLL-LLVKDONJSA-N 285.300 -0.338 5 10 CBBE COCC(O)(CN=c1[nH]n(C)c(C)c1[N+](=O)[O-])COC 2207490489 WTKOXHUMFVWOMJ-UHFFFAOYSA-N 288.304 -0.506 5 10 CBBE O=C(N[C@@H]1CCC[C@H](O)[C@@H]1O)c1ccc([N+](=O)[O-])[nH]1 2224349441 PYELSIHNHCYETA-KDILMLJESA-N 269.257 -0.073 5 10 CBBE O=C(O)[C@@H]1CC[C@@H]1Cn1cc([N+](=O)[O-])c(O)nc1=O 2228907382 COZHRPPUQALWBJ-PHDIDXHHSA-N 269.213 -0.032 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@H]2CC(=O)N(C)C2=O)[nH]1 2230762684 YUXCQBGPKKQUIO-LURJTMIESA-N 267.245 -0.598 5 10 CBBE CCOC[C@@H](N)C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2231921245 QHARKFPQQHNQLP-SSDOTTSWSA-N 271.277 -0.692 5 10 CBBE Cc1nc(=N)[nH]c(=NCc2nn(C)cc2[N+](=O)[O-])[nH]1 2231933669 YGNPOMBRDJKGOL-UHFFFAOYSA-N 264.249 -0.732 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2C[C@@H](N)C[C@@H](C(N)=O)C2)n1 2239260418 YXVRLXOUYMNFFV-SFYZADRCSA-N 282.304 -0.550 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N[C@H]2CCNC[C@H]2O)n1 2258649390 VCNSZSYVAGKWFC-IONNQARKSA-N 253.262 -0.172 5 10 CBBE O=C(NC(CF)(CF)C(=O)O)N1CC([N+](=O)[O-])C1 2263485818 QOPSWPOPNYOZND-UHFFFAOYSA-N 267.188 -0.581 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H](O)[C@H](O)C1 2263657730 OQEYDWWQQHFMHF-RKDXNWHRSA-N 253.214 -0.833 5 10 CBBE CN=c1nc(N2CC[C@]3(O)C[C@H]3C2)c([N+](=O)[O-])c[nH]1 2265253801 BLMBRDBAIYDXEQ-CPCISQLKSA-N 265.273 -0.191 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2CC[C@H](N)[C@H](CO)C2)n1 2271065576 NLHJOIYCDYEROW-IUCAKERBSA-N 267.289 -0.161 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NC2CS(=O)(=O)C2)[nH]1 2271082058 IQPWRGGQHYNGFJ-UHFFFAOYSA-N 288.285 -0.838 5 10 CBBE CN=c1nc(N(CCO)CCCN)c([N+](=O)[O-])c(C)[nH]1 2281144422 JEUUYVVGOXMBDR-UHFFFAOYSA-N 284.320 -0.696 5 10 CBBE COC(=O)NC[C@@H](C)N=c1[nH]c(NN)ncc1[N+](=O)[O-] 2286133292 GIEMKWCOPAXCTR-RXMQYKEDSA-N 285.264 -0.751 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@H]2COC[C@@H]2CN)[nH]1 2286734210 LNRFMTNABJXXEY-YUMQZZPRSA-N 283.288 -0.661 5 10 CBBE O=C(N=c1cc[nH]cc1[N+](=O)[O-])[C@@]12CCO[C@H]1CNC2 2296435705 MZEREUQHCXUEDB-CMPLNLGQSA-N 278.268 -0.271 5 10 CBBE NCCS(=O)(=O)CCOc1ncncc1[N+](=O)[O-] 2314289786 YDCPGKWDFAWGGT-UHFFFAOYSA-N 276.274 -0.863 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@@H]2C[C@H]1[C@@H](O)[C@H](O)C2 2330381463 IIFKARDKCKCIFS-BZNPZCIMSA-N 268.273 -0.351 5 10 CBBE O=[N+]([O-])c1cncnc1N1C[C@@H]2C[C@H](O)[C@H](O)[C@H]1C2 2333697897 DSOWKWCMGPWNOY-WPYKOPORSA-N 266.257 -0.295 5 10 CBBE CC(C)n1nnnc1CN=c1nc([N+](=O)[O-])n(C)[nH]1 2345008241 MIGCJKNBQIGNPV-UHFFFAOYSA-N 267.253 -0.675 5 10 CBBE Cn1nc(N=[S@](C)(=O)N2CCNCC2)nc1[N+](=O)[O-] 2345023974 NUVMGWQPNBYSPH-IBGZPJMESA-N 289.321 -0.727 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCC[C@H](O)CCO)c1[N+](=O)[O-] 2351748755 XMQDLDPFLCTVRN-ZETCQYMHSA-N 271.277 -0.927 5 10 CBBE Nc1ccnc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c1[N+](=O)[O-] 2357596807 MIRDJCIGPNBOGG-NGELQDPLSA-N 280.284 -0.108 5 10 CBBE Cn1ncc2c(NN)nc(Cn3cc([N+](=O)[O-])cn3)nc21 63084207 KOCHHHZGDKYRDL-UHFFFAOYSA-N 289.259 -0.198 5 10 CBBE NC(=O)CNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1F 70243654 PGJOIPIWZJUMSY-UHFFFAOYSA-N 295.223 -0.363 5 10 CBBE O=C(O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 88375445 QWHNAGWUYWFOIR-QMMMGPOBSA-N 297.223 -0.791 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1[C@H]2OCC[C@@H]2[C@H]1N 90316942 NILBBSLLPVLHOR-QQRDMOCMSA-N 293.283 -0.385 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@H]3CNC[C@H]23)cn1 112251907 SDCPQBVQLVLSMI-YUMQZZPRSA-N 284.297 -0.514 5 10 CBBE CCNc1ncnc(N(CCO)CCO)c1[N+](=O)[O-] 124123910 AGBDQIMXFFYUEC-UHFFFAOYSA-N 271.277 -0.392 5 10 CBBE Cn1nnc(NC(=O)c2cc(NN)c(F)cc2[N+](=O)[O-])n1 127799734 BBFSAQPGYMTKHU-UHFFFAOYSA-N 296.222 -0.205 5 10 CBBE NS(=O)(=O)Nc1ccc(C(=O)O)cc1[N+](=O)[O-] 163349117 ZIRADBYGDQGFBL-UHFFFAOYSA-N 261.215 -0.092 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])c(C(=O)O)n1)NC1CC1 229734279 JEQGPHFZPBMFSX-UHFFFAOYSA-N 254.202 -0.232 5 10 CBBE NNc1cc(CN2C[C@H](O)[C@H](O)C2)ccc1[N+](=O)[O-] 236167852 DUOQJHDFLYSSMS-PHIMTYICSA-N 268.273 -0.582 5 10 CBBE O=C(c1cc(Cl)ncc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236571679 KTPILKMJTITIBW-YUMQZZPRSA-N 287.659 -0.179 5 10 CBBE NC(=O)N[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 342875239 DDTCUUNXRBKUHU-LURJTMIESA-N 267.245 -0.194 5 10 CBBE O=c1n(CCn2cc([N+](=O)[O-])cn2)nnn1C1CC1 351891226 VBVRMYDTJKJKOK-UHFFFAOYSA-N 265.233 -0.420 5 10 CBBE COC(=O)C[C@H](C)Nc1nc(NN)ncc1[N+](=O)[O-] 381666347 OSUHXLMLTFAXPL-YFKPBYRVSA-N 270.249 0.034 5 10 CBBE CCn1cc(CN=c2[nH]cnc(N)c2[N+](=O)[O-])nn1 404457024 KOMKXHZKSSPULG-UHFFFAOYSA-N 264.249 -0.388 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CC(F)(F)C[C@H]1CO 614880568 LQGYCKJHGHSLFW-LURJTMIESA-N 291.214 -0.585 5 10 CBBE CN(C)C[C@@H](O)CN(C)C(=O)c1ccc([N+](=O)[O-])[nH]1 690224235 KTGDGSHMJPIYLI-MRVPVSSYSA-N 270.289 -0.083 5 10 CBBE C[C@H]1CC(=O)NCCN1c1nc(NN)ncc1[N+](=O)[O-] 707422351 FEQOWIYFSFXMTI-LURJTMIESA-N 281.276 -0.615 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N[C@H]2COCC[C@H]2O)n1 710925386 UXMFUAMTGFIVHB-CAHLUQPWSA-N 270.249 -0.768 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1CC(CO)(CO)C1 721397716 OQMVZWFBDJKESW-UHFFFAOYSA-N 270.289 -0.089 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)OCc2nc(=O)n(C)[nH]2)n1 755590246 DRTXXAGLBWFREN-UHFFFAOYSA-N 296.243 -0.410 5 10 CBBE Cn1nnnc1CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1 819205809 NSNGRLGJVHXLMS-NSHDSACASA-N 292.299 -0.016 5 10 CBBE COC(=O)[C@@H](CC(C)C)NC(=O)Cn1ncc([N+](=O)[O-])n1 863374357 NXOQHKVXOXLHFY-MRVPVSSYSA-N 299.287 -0.110 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NOC[C@H]1CCOC1 1116754089 KQNOOHVVYVWDIB-ZETCQYMHSA-N 271.233 -0.729 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NCC2([S@](C)=O)CC2)n1 1448250849 QSWGYBPSEFQARY-IBGZPJMESA-N 286.313 -0.031 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](CO)[C@@H](CO)C1 1650619680 XHCMMVDIKLLUCJ-AOOOYVTPSA-N 298.299 -0.841 5 10 CBBE Nc1ccn(C[C@@H]2CNC(=O)O2)c(=O)c1[N+](=O)[O-] 1652952927 SSQJDPQDYCOAQL-YFKPBYRVSA-N 254.202 -0.553 5 10 CBBE O=C1NCCC2(CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C2)O1 1653007672 AEBKSGMLSUFPKU-UHFFFAOYSA-N 295.255 -0.498 5 10 CBBE CC(C)CNC(=O)CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1713821656 OICLBNVOKWKPQO-GHMZBOCLSA-N 298.343 -0.776 5 10 CBBE O=[N+]([O-])C1CN(S(=O)(=O)c2ccc(CO)cc2F)C1 1876165285 LZZBUGLNRHHJKQ-UHFFFAOYSA-N 290.272 -0.032 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@]23CCNC[C@H]2C3)n1 1891123750 RZOOKYLOLBHLEF-RDDDGLTNSA-N 265.273 -0.190 5 10 CBBE NNc1ncnc(N2CC[C@](F)(CO)C2)c1[N+](=O)[O-] 1917113147 UWPMPKVOUPRTJZ-SECBINFHSA-N 272.240 -0.419 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1N(CCO)C1COC1 1917255047 JPWCBMUOPVOORU-UHFFFAOYSA-N 281.268 -0.109 5 10 CBBE COC1(C(=O)O)CN(CCn2c([N+](=O)[O-])cnc2C)C1 1917705845 FJLYTGNQFMLCAM-UHFFFAOYSA-N 284.272 -0.115 5 10 CBBE COc1ncc([N+](=O)[O-])cc1[C@@H]1NCCNC1=O 1952266743 PSJAHQYWLLVLRS-QMMMGPOBSA-N 252.230 -0.241 5 10 CBBE CCn1ncnc1CN=c1[nH]n(C)cc1[N+](=O)[O-] 1963940165 GUBFUVXPHUWFKL-UHFFFAOYSA-N 251.250 -0.026 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N[C@H]1C[C@H](O)C1 1970597282 UXMKRQVYGXWXOV-ZKCHVHJHSA-N 254.246 -0.179 5 10 CBBE NCC1CC(NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 2028011822 KITOQOFXRNOAAF-UHFFFAOYSA-N 253.262 -0.355 5 10 CBBE C[C@]1(O)CON(c2cc([N+](=O)[O-])cc(NN)n2)C1 2032463448 HTVZFTUBHUKZOG-SECBINFHSA-N 255.234 -0.222 5 10 CBBE O=C1C[C@H](N=c2[nH]c(Cl)ncc2[N+](=O)[O-])C(=O)N1 2034961757 VUDGBMJQXMJGNP-VKHMYHEASA-N 271.620 -0.713 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCC[C@@]1(O)CCOC1 2041244126 ZAPRMTBOWCZKIB-SECBINFHSA-N 257.250 -0.901 5 10 CBBE O=C(N[C@@H]1CC[C@@H]1O)c1cc([N+](=O)[O-])cnc1O 2043134162 KBBJMKNDRJSOTQ-SFYZADRCSA-N 253.214 -0.052 5 10 CBBE O=[N+]([O-])c1c(N2C[C@@H](O)C[C@H](O)C2)ccnc1O 2043182678 SRMSQQWUBWTJBZ-BQBZGAKWSA-N 255.230 -0.373 5 10 CBBE CNc1ncnc(N(OC)C2CNC2)c1[N+](=O)[O-] 2053460284 CPXWKNDOGRHJAA-UHFFFAOYSA-N 254.250 -0.234 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@H]3COC[C@@H]32)c1[N+](=O)[O-] 2066298822 AYGKNAVCASIJNT-BQBZGAKWSA-N 251.246 -0.059 5 10 CBBE N=c1[nH]c(N2C[C@@H]3C[C@H]3[C@@H]2CN)ncc1[N+](=O)[O-] 2078252265 QOHPIBWCIZRBJX-XVMARJQXSA-N 250.262 -0.419 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@H](CCO)C2)[nH]1 2078427132 IIUMRGPUUSEXHF-LJGSYFOKSA-N 253.262 -0.208 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)[C@@H]1CF 2084787526 OGXQBGVQIJYMLX-GEVIPFJHSA-N 260.225 -0.792 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCC2[C@H]3CNC[C@H]23)[nH]n1C 2086318794 MWJUVOQJRIVESV-YUMQZZPRSA-N 251.290 -0.064 5 10 CBBE CO[C@@H]1CN(C)C[C@@H]1N=c1[nH]c(F)ncc1[N+](=O)[O-] 2095424467 PIYXZBDPKKUAAW-POYBYMJQSA-N 271.252 -0.313 5 10 CBBE COc1nc(=NCc2cnnn2C)[nH]cc1[N+](=O)[O-] 2101472338 LPIQEYDPXUOWGS-UHFFFAOYSA-N 265.233 -0.444 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC[C@@H]2CCC(=O)NC2)n1 2103187453 PRQUJBNFMMESNX-QMMMGPOBSA-N 267.289 -0.056 5 10 CBBE NNc1cc([N+](=O)[O-])cc(=NCCOCCCO)[nH]1 2104021523 MUTOHFBAJWKWEE-UHFFFAOYSA-N 271.277 -0.492 5 10 CBBE N[C@@H]1COC[C@@H]1Nc1nccc(C(=O)O)c1[N+](=O)[O-] 2105933849 PJBIYXBVVPQDCE-RQJHMYQMSA-N 268.229 -0.174 5 10 CBBE Cc1nc(NN)nc(N2CC=C[C@H](O)C2)c1[N+](=O)[O-] 2108784831 OKERHIIHAMZCBO-ZETCQYMHSA-N 266.261 -0.284 5 10 CBBE CNC1(C(N)=O)CN(c2ccc([N+](=O)[O-])cc2F)C1 2109480528 GQHCYLKEACQPRT-UHFFFAOYSA-N 268.248 -0.003 5 10 CBBE 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281.268 -0.260 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCC2(N)CCOCC2)[nH]1 2173889575 JZDFLHHRLVESMQ-UHFFFAOYSA-N 282.304 -0.810 5 10 CBBE CNc1nc[nH]c(=NC[C@H]2CNCCOC2)c1[N+](=O)[O-] 2173999947 YECGLNQGQODCEN-MRVPVSSYSA-N 282.304 -0.504 5 10 CBBE CN(C[C@]1(O)CCOC1)c1cc([N+](=O)[O-])cc(NN)n1 2185937694 OFPOUBSJZZRKAK-LLVKDONJSA-N 283.288 -0.137 5 10 CBBE COc1cc(N2C[C@H](O)[C@@H](O)[C@@H]2CO)cc([N+](=O)[O-])c1 2200878917 ZJHBTOJETPGZET-SRVKXCTJSA-N 284.268 -0.494 5 10 CBBE CNc1ncnc(N2C[C@@H]3C(C(N)=O)[C@H]3C2)c1[N+](=O)[O-] 2201290874 ZDJZBMKJPNUFCU-WDSKDSINSA-N 278.272 -0.406 5 10 CBBE O=C(O)c1cc(NCC2(CO)CNC2)ncc1[N+](=O)[O-] 2201716017 KDKUHWPREJCZBO-UHFFFAOYSA-N 282.256 -0.318 5 10 CBBE O=[N+]([O-])c1ccc2c(c1)C[C@@H](NS(=O)(=O)CCO)C2 2225758288 DTOGHGWLXCOLAR-JTQLQIEISA-N 286.309 -0.026 5 10 CBBE CN=c1[nH]c(O[C@H]2CNC[C@@H](F)C2)ncc1[N+](=O)[O-] 2226282471 BSDYYQRCHZVIGF-NKWVEPMBSA-N 271.252 -0.073 5 10 CBBE Cc1c([N+](=O)[O-])c(N2C[C@@H]3CN[C@@H](CO)[C@@H]3C2)nn1C 2235570009 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CN1CCN(c2nc(NN)ccc2[N+](=O)[O-])C[C@H]1CO 687627694 IRECBHPRQAQDIE-QMMMGPOBSA-N 282.304 -0.612 5 10 CBBE O=C1CN(Cc2ccc([N+](=O)[O-])cn2)[C@@H](C(=O)O)CN1 699097180 XYVOKUMULPPPKH-SECBINFHSA-N 280.240 -0.625 5 10 CBBE N[C@H]1CCOC[C@@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 721645662 YIKFTLNHFPWPIE-CBAPKCEASA-N 254.246 -0.231 5 10 CBBE C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])c1nnnn1C 787767550 GUPXGQACXUDJLJ-YFKPBYRVSA-N 281.232 -0.230 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)O[C@@H]1CCC(=O)NC1=O 798585810 CQVUSTKPGUDOEQ-MRVPVSSYSA-N 281.224 -0.105 5 10 CBBE CO[C@H]1COCC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1 1129187843 BALDCVFTNYMBDB-ONGXEEELSA-N 298.299 -0.041 5 10 CBBE COC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])nc1C 1158003238 MVWFZZYVBYIWAL-UHFFFAOYSA-N 299.287 -0.038 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CC[C@H]1O 1158033465 SJKSQAQMWLBJPH-HTQZYQBOSA-N 254.246 -0.261 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1CC2(C1)NC(=O)NC2=O 1164357813 DUOJSWGATDZLDF-UHFFFAOYSA-N 294.271 -0.482 5 10 CBBE CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)c1cn[nH]c1 1284522131 QYGHAVNMYSSBDV-RKDXNWHRSA-N 281.272 -0.737 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1[C@H]2CC[C@H]1CC(O)C2 1293927526 BIJQOPFEJKWMCR-YUMQZZPRSA-N 281.272 -0.299 5 10 CBBE O=C(N[C@H]1C[C@H](NCCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1317075871 HOUBMNYXISLIIY-ZYUZMQFOSA-N 257.290 -0.729 5 10 CBBE O=C(N1CCC(n2ccc([N+](=O)[O-])n2)CC1)C1(O)COC1 1448915026 QKFCAHKLBOQPME-UHFFFAOYSA-N 296.283 -0.284 5 10 CBBE C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1nnc(O)n1C 1469595646 ZWSOXCOQRBHSQB-KVQBGUIXSA-N 255.234 -0.637 5 10 CBBE COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C)n1)C(N)=O 1519742244 KEMOBIHPHPURIF-SECBINFHSA-N 282.256 -0.472 5 10 CBBE Cn1cnc([N+](=O)[O-])c1NC(=O)CCN1C(=O)CCC1=O 1521389152 VRDJJKALDPPIJQ-UHFFFAOYSA-N 295.255 -0.194 5 10 CBBE Nc1nc(NC[C@H]2CNC(=O)C2)ncc1[N+](=O)[O-] 1642800535 REAHULHIZXGIOK-RXMQYKEDSA-N 252.234 -0.485 5 10 CBBE CCCCN1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1733500873 XIFKMKWUZBTDBI-NXEZZACHSA-N 271.317 -0.385 5 10 CBBE O=C(N[C@@H]1C[C@H]2C[C@@]2(C(=O)O)C1)N1CC([N+](=O)[O-])C1 1876137208 OHNCRVJMFJBRFH-MVKOHCKWSA-N 269.257 -0.090 5 10 CBBE Cn1cc([N+](=O)[O-])c(=NCC2(O)CCNCC2)[nH]1 1918783599 CVORVIAJPHNHHY-UHFFFAOYSA-N 255.278 -0.723 5 10 CBBE C[C@@H]1C(=O)NCCN1Cc1nn(C)cc1[N+](=O)[O-] 1964131497 RCIHJMWOFCIZET-SSDOTTSWSA-N 253.262 -0.351 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN[C@H]2C[C@H]21 1964396958 MSFMAHMQHJKJDV-DTWKUNHWSA-N 251.246 -0.636 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2CC[C@@H]2O)c1[N+](=O)[O-] 2043154017 KCBWHDOPLQTGRB-RITPCOANSA-N 254.250 -0.664 5 10 CBBE O=Cc1ccc(N2CC(O)(CO)C2)c([N+](=O)[O-])c1 2051956825 MLOHOXOCYMNWIS-UHFFFAOYSA-N 252.226 -0.049 5 10 CBBE Cn1cnc([N+](=O)[O-])c1NC[C@H]1C[C@H](O)[C@H](N)C1 2052669289 QBXTUSKOVJBDPW-PRJMDXOYSA-N 255.278 -0.162 5 10 CBBE CN=c1[nH]c(N2C[C@@H]3C(N)[C@H]3C2)ncc1[N+](=O)[O-] 2053522514 MNOMFKNHBRUFRB-WDSKDSINSA-N 250.262 -0.758 5 10 CBBE C[C@@H](N)[C@H](O)C(=O)NCc1cccc([N+](=O)[O-])c1 2056838146 IIRLFQLXWVTTIP-XCBNKYQSSA-N 253.258 -0.081 5 10 CBBE C[C@@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H]1N 2066471338 FKWMCWWHHWOMMA-RQJHMYQMSA-N 253.262 -0.253 5 10 CBBE O=C(O)[C@H](CC1CC1)NC(=O)N1CC([N+](=O)[O-])C1 2071558395 MDHHGTMCODOBET-QMMMGPOBSA-N 257.246 -0.090 5 10 CBBE Cc1cc(C(=O)N2CC([N+](=O)[O-])C2)cc(NN)n1 2071564730 CJINGCWBGZZIJQ-UHFFFAOYSA-N 251.246 -0.223 5 10 CBBE O=[N+]([O-])c1c(Cl)ncnc1N1CCC1(CO)CO 2073989272 VEQNYYPFAGFCEZ-UHFFFAOYSA-N 274.664 -0.028 5 10 CBBE NNc1ncnc(N2C[C@@H]3C[C@H](C2)O3)c1[N+](=O)[O-] 2077858245 OFUNUZDQDXVQNQ-OLQVQODUSA-N 252.234 -0.352 5 10 CBBE Cc1c([N+](=O)[O-])c(N2CCOC[C@@H]2CN)nn1C 2086320319 HSZCJPWQIILRMW-QMMMGPOBSA-N 255.278 -0.199 5 10 CBBE Nc1nc(N2CCCC2(CO)CO)ccc1[N+](=O)[O-] 2089868466 QZUKJKQSXAXPES-UHFFFAOYSA-N 268.273 -0.104 5 10 CBBE O=[N+]([O-])c1ccc(F)cc1OC[C@@]1(O)CNC[C@@H]1O 2100930849 GMSSFZYHBPHKDN-QWRGUYRKSA-N 272.232 -0.192 5 10 CBBE CN=c1[nH]c(=NCCc2cnn[nH]2)[nH]cc1[N+](=O)[O-] 2101465580 QMYXKVNSZQDHAG-UHFFFAOYSA-N 264.249 -0.957 5 10 CBBE CN1CCN(Cc2nn(C)cc2[N+](=O)[O-])[C@H](CN)C1 2102865003 QTSDYYIMKSKMKJ-SECBINFHSA-N 268.321 -0.597 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N[C@@H]2CCNC[C@H]2CO)[nH]1 2117126348 YNYLZHHMJNDFGG-IONNQARKSA-N 267.289 -0.215 5 10 CBBE NC(=O)[C@H]1OCC[C@H]1N=c1[nH]c(F)ncc1[N+](=O)[O-] 2117467531 SACMSCQFYPTKMU-XINAWCOVSA-N 271.208 -1.000 5 10 CBBE O=C1NC(=O)[C@H]2CN(Cc3ccc([N+](=O)[O-])o3)C[C@@H]12 2119295506 ZSPJXJOLDBQMDL-OCAPTIKFSA-N 265.225 -0.108 5 10 CBBE CCCc1nn(C)c(O[C@H](CN)C(N)=O)c1[N+](=O)[O-] 2119763696 NAAPFARCHAEMCM-SSDOTTSWSA-N 271.277 -0.528 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2[C@@H]3CCO[C@H]32)c1 2119892423 VZUAMZSHOIDDDL-LMLFDSFASA-N 268.273 -0.471 5 10 CBBE Nc1cc(N2C[C@H]3NC(=O)O[C@@H]3C2)ncc1[N+](=O)[O-] 2120414623 CDSQLFKSRISMMN-HTRCEHHLSA-N 265.229 -0.131 5 10 CBBE COc1nc(N[C@H]2CNC[C@H]2OC)ncc1[N+](=O)[O-] 2122538851 SFPKJYWTYRQFSL-POYBYMJQSA-N 269.261 -0.208 5 10 CBBE Cc1[nH]ccc(=NC2CN(S(C)(=O)=O)C2)c1[N+](=O)[O-] 2126948971 ZWEFKQOLHCXCCJ-UHFFFAOYSA-N 286.313 -0.224 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N=[S@]2(=O)CC[C@H](N)C2)n1 2129974949 DFYCAKKHLAHSOK-PVDFSEMESA-N 287.301 -0.333 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C(CO)[C@H]3C2)n1 2129988174 NDSXRGPOWYRUJP-BQBZGAKWSA-N 266.257 -0.361 5 10 CBBE CC1(C)OC[C@H](N)[C@@]1(C(=O)O)n1ccnc1[N+](=O)[O-] 2137000036 SLRMMENGIPWBHI-WKEGUHRASA-N 270.245 -0.293 5 10 CBBE CN=c1[nH]c(=NC[C@@H]2[C@H]3CN[C@H]2C3)[nH]cc1[N+](=O)[O-] 2138288944 RPIHZGOYUKUGIA-PRJMDXOYSA-N 264.289 -0.710 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(NC[C@@]2(O)CCNC2)c1 2144611044 KGTTXSWYJYVYEC-GFCCVEGCSA-N 280.284 -0.170 5 10 CBBE COc1ncnc(N2C[C@@H](CO)C[C@H]2CO)c1[N+](=O)[O-] 2146124665 ATQWKMYYFHRKNY-YUMQZZPRSA-N 284.272 -0.427 5 10 CBBE CNc1ncnc(N2C[C@H](O)[C@H](N(C)C)C2)c1[N+](=O)[O-] 2146136448 CPFSUPMGRAZMOD-SFYZADRCSA-N 282.304 -0.462 5 10 CBBE CN=c1[nH]c(NC[C@H](O)c2cnc[nH]2)ncc1[N+](=O)[O-] 2157672056 JLEWHQSEKLFTKD-QMMMGPOBSA-N 279.260 -0.283 5 10 CBBE CN(C)c1nc(-n2cnc(C(=O)O)n2)ncc1[N+](=O)[O-] 2157677031 RQGYMGAGSAPOLP-UHFFFAOYSA-N 279.216 -0.270 5 10 CBBE COC(=O)CC[C@@H](O)Cn1cc([N+](=O)[O-])c(O)nc1=O 2162024052 BVBXQEQPKBRGPC-ZCFIWIBFSA-N 287.228 -0.829 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@@H]1C[C@@H]2COC[C@@H]2N1 2162369563 JYWRWYQJYVQCGL-CSMHCCOUSA-N 283.263 -0.265 5 10 CBBE CCN(c1ncc([N+](=O)[O-])c(=NC)[nH]1)[C@H]1CCNC1=O 2171238523 OYEYRBBNZIBFPM-ZETCQYMHSA-N 280.288 -0.437 5 10 CBBE CN=c1[nH]c(N2C[C@@H](OC)C[C@H]2CN)ncc1[N+](=O)[O-] 2173837584 OFRIUOMJWCRJKA-YUMQZZPRSA-N 282.304 -0.599 5 10 CBBE CCCN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@H](N)CO)[nH]1 2174011016 LGFZFDLYLSOODW-QMMMGPOBSA-N 284.320 -0.910 5 10 CBBE CN(C(=O)c1nn(C)cc1[N+](=O)[O-])C1(C(=O)O)COC1 2186550345 VETNCLKPLUJGIV-UHFFFAOYSA-N 284.228 -0.746 5 10 CBBE N=c1nc(N2C[C@H](N)CC[C@@H]2C(=O)O)c([N+](=O)[O-])c[nH]1 2188776393 ONNXUWDHULJOEF-PHDIDXHHSA-N 282.260 -0.822 5 10 CBBE O=C(O)[C@@]1(O)CCN(c2ncccc2[N+](=O)[O-])C[C@H]1O 2197468440 IZGBRDNGXKODNE-LDYMZIIASA-N 283.240 -0.624 5 10 CBBE Nc1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H](CO)[C@H](O)[C@H]2O)c1 2206738165 ALFXVYWOJPNYRU-ITNRJIJASA-N 283.284 -0.309 5 10 CBBE O=C(O)[C@@H]1C[C@@H](O)CN1c1ncncc1[N+](=O)[O-] 2219809351 NXKUSHPKAGUKMS-RITPCOANSA-N 254.202 -0.591 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@H]2CCC(=O)NC2)[nH]1 2223018883 SMDAJZIWELSEMQ-ZETCQYMHSA-N 253.262 -0.076 5 10 CBBE CNc1cc(N2CC(O)(C(N)=O)C2)ccc1[N+](=O)[O-] 2225904710 JOWOBBVMYMUZID-UHFFFAOYSA-N 266.257 -0.327 5 10 CBBE O=[N+]([O-])c1cncnc1N1CCC(NCCO)CC1 2226998899 QOZQLIARMQQBPZ-UHFFFAOYSA-N 267.289 -0.065 5 10 CBBE O=C(NCC[C@@]1(O)CCNC1)c1ccc([N+](=O)[O-])[nH]1 2230122487 ZDTCXJVUNHWKCV-NSHDSACASA-N 268.273 -0.233 5 10 CBBE Cc1cc([N+](=O)[O-])c(N2CC[C@@](O)(CO)[C@@H](O)C2)cn1 2234099527 DTRACIDGQNMVNB-NWDGAFQWSA-N 283.284 -0.407 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)[C@H]1COC 2240592462 JAFHOMPXMVJTSS-UTLUCORTSA-N 286.288 -0.632 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CCOC3(CNC3)C2)n1 2272931411 RLARIZALKWXFBS-UHFFFAOYSA-N 267.289 -0.010 5 10 CBBE C[C@@]1(Nc2nc(NN)ccc2[N+](=O)[O-])CCNC1=O 2273268670 GGAVFNBBNVBGFW-SNVBAGLBSA-N 266.261 -0.034 5 10 CBBE CO[C@@H](CN)COc1ncc([N+](=O)[O-])cc1C(N)=O 2277929850 SFTJTAOLFMLLKB-ZETCQYMHSA-N 270.245 -0.559 5 10 CBBE O=[N+]([O-])c1cnn2ccc(N3CC(O)(CO)C3)nc12 2278407385 SBIRNQVRBCLRLP-UHFFFAOYSA-N 265.229 -0.819 5 10 CBBE Nc1ccc(C(=O)N2CC[C@H]2[C@H](O)CO)cc1[N+](=O)[O-] 2286215589 WGYMIBOUMOXBMF-GXSJLCMTSA-N 281.268 -0.255 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N2CC[C@@H](O)[C@H](O)C2)n1 2286634306 UXUJRUVZBXPUHG-RKDXNWHRSA-N 284.272 -0.537 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NC[C@H](CCO)OC)[nH]1 2286648903 LSPGEAJXFCHSHJ-QMMMGPOBSA-N 286.288 -0.238 5 10 CBBE Cc1[nH]ccc(=NCCn2cc(CN)nn2)c1[N+](=O)[O-] 2287184844 OVXAPAQAKYUWLM-UHFFFAOYSA-N 277.288 -0.118 5 10 CBBE COC[C@H](CCN=c1nc([N+](=O)[O-])n(C)[nH]1)OC 2321698690 BQLKYXXVAYMABR-ZETCQYMHSA-N 259.266 -0.391 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@@H]3C[C@H]2[C@H]3CO)n1 2333100411 BVYOPBQTCQSDNX-ACZMJKKPSA-N 266.261 -0.513 5 10 CBBE 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10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@H](O)[C@@H](O)C2(C)C)n1 2124800444 FNVHRCHXFZWXQY-VHSXEESVSA-N 270.289 -0.356 5 10 CBBE Nc1cc(O[C@@H]2CN[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 2128110660 URYWVCVRBKTQBB-CAHLUQPWSA-N 268.229 -0.234 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@H]2CC(=O)N(C)C2=O)[nH]n1C 2142488047 XJOOTGZYOOAEFX-LURJTMIESA-N 267.245 -0.772 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H](CO)CCCO)[nH]1 2146547446 HNXCTLHZFFLCLC-MRVPVSSYSA-N 285.304 -0.876 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)Nc1ncncn1 2149650737 VGQGJQAUGATVAQ-UHFFFAOYSA-N 276.216 -0.287 5 10 CBBE COC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(N)=O 2152389968 TWOVEHYHFLCIQV-WDEREUQCSA-N 283.284 -0.282 5 10 CBBE CN=c1[nH]c(N2C[C@H]3C[C@@]2(CO)CO3)ncc1[N+](=O)[O-] 2157680904 VLXNTMWNHCXVIH-RDDDGLTNSA-N 281.272 -0.812 5 10 CBBE C[C@H]1CCNC(=O)[C@@H]1CN=c1[nH]cc([N+](=O)[O-])c(=N)[nH]1 2159273390 BIZPPCRBXSMKKB-NKWVEPMBSA-N 280.288 -0.597 5 10 CBBE CO[C@H]1CN[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 2172484805 GIOWYECCNNJRBJ-DTWKUNHWSA-N 283.288 -0.716 5 10 CBBE Nc1ncnc(N[C@@H]2[C@H](N)[C@@H]3CCCO[C@H]32)c1[N+](=O)[O-] 2174027134 VTUHUQFJXYJZME-YYWONIAYSA-N 280.288 -0.116 5 10 CBBE CNc1ncnc(N2CC3(CNC(=O)C3)C2)c1[N+](=O)[O-] 2176160833 DATNIMVSMCRYRB-UHFFFAOYSA-N 278.272 -0.247 5 10 CBBE CO[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC[C@H]1O 2186539397 FJZXTBGJBMCNQF-RKDXNWHRSA-N 284.272 -0.450 5 10 CBBE O=[N+]([O-])c1ccc2c(c1)CN(S(=O)(=O)N1CC(O)C1)C2 2191538036 BQZSJWKTIPKXAM-UHFFFAOYSA-N 299.308 -0.168 5 10 CBBE CN=c1nc(N2CCO[C@@H]3COC[C@H]32)c([N+](=O)[O-])c[nH]1 2192638543 YUZOAGZWNVRAFM-RKDXNWHRSA-N 281.272 -0.548 5 10 CBBE CC1(C)CN[C@@H](CN=c2[nH]cc([N+](=O)[O-])c(=N)[nH]2)CO1 2194693272 ZIGWBRHOFIGUOI-ZETCQYMHSA-N 282.304 -0.602 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@H]2CCNC2=O)[nH]1 2196748370 MWULWZTXPVGVRO-ZETCQYMHSA-N 280.288 -0.873 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2199433033 BMQVUIXJUNXCRW-GZELUMCTSA-N 281.268 -0.121 5 10 CBBE COc1cccc(N2C[C@H](O)[C@H](O)[C@H]2CO)c1[N+](=O)[O-] 2200877427 UMMYWBGDBBWNSI-VDDIYKPWSA-N 284.268 -0.494 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CCn2c(CN)nnc2C1 2203318742 AVGMEQJHPCTNGM-UHFFFAOYSA-N 278.276 -0.601 5 10 CBBE CCc1nn(C)c(N2C[C@H](O)[C@H](O)[C@@H]2CF)c1[N+](=O)[O-] 2205610256 KACIQQMOGJTEPS-OYNCUSHFSA-N 288.279 -0.229 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@]2(CO)C[C@@H](O)C2(C)C)[nH]n1C 2207476382 PGVSBRPPTPDCEY-PRHODGIISA-N 284.316 -0.008 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@H]2CNC[C@H](F)C2)c1[N+](=O)[O-] 2226274186 KWPLNQNFTZPBPX-RNFRBKRXSA-N 270.268 -0.360 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCCCNC(=O)NC)[nH]1 2230762187 VAASUSJEJUZRDP-UHFFFAOYSA-N 270.293 -0.036 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CC[C@@](O)(CO)[C@@H](O)C2)n1 2239007577 RDSAOLDXOIPGDP-GXSJLCMTSA-N 286.288 -0.894 5 10 CBBE COc1ncnc(OC[C@H](CN)OC)c1[N+](=O)[O-] 2263474024 CSLZBOIQFKBCOS-LURJTMIESA-N 258.234 -0.254 5 10 CBBE CNC(=O)[C@@H](C)N=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2278431450 BIXCIBFFFJMEGO-ZCFIWIBFSA-N 264.245 -0.394 5 10 CBBE C[C@H](O)CN(CCN)c1cc(C(=O)O)c([N+](=O)[O-])cn1 2285397088 CBKHVFHMXPZNCV-ZETCQYMHSA-N 284.272 -0.166 5 10 CBBE CN(CC1(O)CNC1)c1ncc([N+](=O)[O-])cc1C(=O)O 2287296351 NAEWMGIUMJSSDA-UHFFFAOYSA-N 282.256 -0.542 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1C[C@@H]1CC[C@H]2CNC[C@H]2O1 2289350739 SMTJTOXZUUMLJL-INTQDDNPSA-N 280.284 -0.082 5 10 CBBE O=[N+]([O-])c1cc(F)cc(N2C[C@H](O)[C@@H](O)[C@H](CO)C2)c1 2289407256 FIMNPTVCVGJGFX-QILRFPOHSA-N 286.259 -0.116 5 10 CBBE NC(CO)(CO)c1nc2ccc([N+](=O)[O-])cc2[nH]1 2320975620 JQVOMHWLZUETEJ-UHFFFAOYSA-N 252.230 -0.390 5 10 CBBE Cn1[nH]c(=NCCC(=O)NC(C)(C)C)nc1[N+](=O)[O-] 2344952306 JBKAOIYWIWFVAW-UHFFFAOYSA-N 270.293 -0.138 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCC[C@@H]3CNC[C@H]32)nc1[N+](=O)[O-] 2345008714 SXMDCFMUBGGDLC-IWSPIJDZSA-N 266.305 -0.055 5 10 CBBE Cn1[nH]c(=N[C@@H]2[C@@H]3C[C@H]4[C@H](CN[C@H]42)C3)nc1[N+](=O)[O-] 2345029579 ACKIQFMMOJZQPH-OAHBRNHXSA-N 264.289 -0.447 5 10 CBBE O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N(CCO)C1CC1 36130357 IXZBMABVTRTPIX-UHFFFAOYSA-N 267.241 -0.120 5 10 CBBE C[C@H](NC(=O)[C@@H](N)CC(N)=O)c1cccc([N+](=O)[O-])c1 37766572 HNFAMWLENGGYGE-XVKPBYJWSA-N 280.284 -0.025 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H](CO)C2)cn1 70302331 ALKRLNUPJMZGBB-QMMMGPOBSA-N 287.297 -0.007 5 10 CBBE NC(=O)[C@H]1CNCCN1c1ccc(F)cc1[N+](=O)[O-] 88673977 UIURBTDBHWQHAP-SNVBAGLBSA-N 268.248 -0.003 5 10 CBBE C[C@H](C(N)=O)S(=O)(=O)c1ncccc1[N+](=O)[O-] 121332150 OETYEKAHZMJSDV-RXMQYKEDSA-N 259.243 -0.363 5 10 CBBE NC(=O)[C@@H]1COCCN1c1ccc([N+](=O)[O-])c(C(=O)O)c1 135655174 LTPILBFLZYUDMG-JTQLQIEISA-N 295.251 -0.017 5 10 CBBE Cc1cc(C(=O)N[C@@H](CC(N)=O)C(=O)O)cc([N+](=O)[O-])c1 137089628 YBBLXTZJCQNJKV-VIFPVBQESA-N 295.251 -0.038 5 10 CBBE CC1(C)C(=O)NC(=O)CN1c1ncnc(N)c1[N+](=O)[O-] 156922151 DETKINUWDZGPKH-UHFFFAOYSA-N 280.244 -0.792 5 10 CBBE NNc1ncnc(N2CCC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 160507399 MIRPVOUAJNCIES-LURJTMIESA-N 281.276 -0.628 5 10 CBBE O=[N+]([O-])c1cccc2oc(NC(CO)(CO)CO)nc12 236506051 RWOXSTRTUIUMQN-UHFFFAOYSA-N 283.240 -0.136 5 10 CBBE C[S@](=O)CCNC(=O)c1ccc(NN)cc1[N+](=O)[O-] 312008738 RMYZZVMYIPBGOO-IBGZPJMESA-N 286.313 -0.011 5 10 CBBE CN1CC[C@]2(CCN(C(=O)Cn3cnc([N+](=O)[O-])n3)C2)C1 346303192 WUPGZPWPDOLJSW-LBPRGKRZSA-N 294.315 -0.260 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NCC1(O)CCCCC1 353657424 LQJXFBCLZLPWAI-UHFFFAOYSA-N 283.288 -0.002 5 10 CBBE Cn1nnnc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-] 356474494 POAUGWICYQUFNO-UHFFFAOYSA-N 278.228 -0.246 5 10 CBBE Cc1nc(NN)nc(N[C@@H]2CCNC2=O)c1[N+](=O)[O-] 693889693 HTIMJOROWJUYEN-RXMQYKEDSA-N 267.249 -0.721 5 10 CBBE O=[N+]([O-])c1ccc(CN2CC[C@](O)(CO)C2)nc1 699112531 DYOJCUYJTXGYGX-LLVKDONJSA-N 253.258 -0.081 5 10 CBBE O=C(N[C@H]1CNC[C@H]1O)c1csc([N+](=O)[O-])c1 699970447 WRSUBWYXRFBALX-NKWVEPMBSA-N 257.271 -0.281 5 10 CBBE Nc1ncc([N+](=O)[O-])c(N2CCC[C@@H](CO)[C@H]2CO)n1 709805478 ZYLRNODHQBQBNE-IONNQARKSA-N 283.288 -0.463 5 10 CBBE Cc1cc(N)c([N+](=O)[O-])cc1S(=O)(=O)Nc1nn[nH]n1 709831676 SYKKKJCRJKKMLF-UHFFFAOYSA-N 299.272 -0.201 5 10 CBBE O=C1CC2(CCC2)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1 874920898 NVGILNNYCJQVPI-RKDXNWHRSA-N 267.285 -0.077 5 10 CBBE COC(=O)[C@H]1CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 1134370950 DOOOQRXBFMFORA-SECBINFHSA-N 295.251 -0.470 5 10 CBBE CN(CCO)CCN(C)C(=O)c1nn(C)cc1[N+](=O)[O-] 1149207176 YGZKITOIZNHJNK-UHFFFAOYSA-N 285.304 -0.676 5 10 CBBE CCc1nc(CNC(=O)c2nn(C)cc2[N+](=O)[O-])n[nH]1 1569575950 HTTKVQVQUWNZLM-UHFFFAOYSA-N 279.260 -0.061 5 10 CBBE CC(=O)NC[C@H]1CN(c2c([N+](=O)[O-])cnn2C)CCO1 1650775046 RJXUKSLNMDAHJJ-VIFPVBQESA-N 283.288 -0.330 5 10 CBBE Cc1c(NC(=O)[C@H](O)[C@@H](O)C(=O)O)cccc1[N+](=O)[O-] 1865945818 CILFKIOHXXWRHI-RKDXNWHRSA-N 284.224 -0.352 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@@H]3OCCO[C@H]3C2)n1 1884695505 LIRJNSOLEMFTDY-QWRGUYRKSA-N 268.273 -0.072 5 10 CBBE COc1ncnc(NC[C@@H]2CCNC2=O)c1[N+](=O)[O-] 1887193109 VYWSXLXKSXUIDZ-LURJTMIESA-N 267.245 -0.059 5 10 CBBE CCn1nnc(Cn2cc([N+](=O)[O-])c(C(=O)O)n2)n1 1892846477 LTGWHPIIGWFPMG-UHFFFAOYSA-N 267.205 -0.456 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NCc1cn(CC(=O)O)nn1 1916408725 UQZQOUAHMVYEDX-UHFFFAOYSA-N 281.232 -0.384 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CC[C@]3(CNCCO3)C2)n1 1967639343 LZZODSIRPVBJHZ-LBPRGKRZSA-N 281.316 -0.107 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCCN=S(C)(C)=O 1997008095 MQMQACJOSPVZCV-UHFFFAOYSA-N 262.295 -0.715 5 10 CBBE C[C@]1(O)CON(c2nc(NN)ccc2[N+](=O)[O-])C1 2032463395 HDQPOHVMQRIMOC-SECBINFHSA-N 255.234 -0.222 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NCCOCCCO)[nH]1 2042208707 OYUPGPKILJGAOB-UHFFFAOYSA-N 257.250 -0.970 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCNC[C@]2(C)CO)n1 2044501211 LXMFCTKTBJXSIX-SNVBAGLBSA-N 255.278 -0.511 5 10 CBBE C[C@@H]1NCCC[C@H]1N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2053686688 FWVXYQRHHAXPAT-NKWVEPMBSA-N 252.278 -0.228 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=N[C@H]1CNCC[C@H]1O 2063342997 ZOBLRAJARMNPAN-CAHLUQPWSA-N 257.225 -0.920 5 10 CBBE CO[C@@H]1C[C@@H](N)C[C@@H]1Oc1nc([N+](=O)[O-])nn1C 2067172644 FIRNPFFGBQDHME-QYNIQEEDSA-N 257.250 -0.393 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=N[C@@H]2COC[C@@H]2F)[nH]1 2071511883 QYXPOAZPPZTMOS-CRCLSJGQSA-N 258.213 -0.759 5 10 CBBE Cc1c([N+](=O)[O-])c(O[C@@H]2COC[C@H]2CN)nn1C 2086316671 KJJLBFXEQRYDEC-HTQZYQBOSA-N 256.262 -0.011 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCNC1 2087143040 DXGXUWMIKOKSKD-NSHDSACASA-N 268.273 -0.613 5 10 CBBE CN(C[C@@H]1CCN1)c1ncc([N+](=O)[O-])cc1C(N)=O 2087501111 PFJDHINXHKLNMI-ZETCQYMHSA-N 265.273 -0.113 5 10 CBBE C[C@@H]1CCN(c2nc(=N)[nH]cc2[N+](=O)[O-])[C@@H]1C(N)=O 2090258909 MCKAFEPZOPBVBX-VDTYLAMSSA-N 266.261 -0.503 5 10 CBBE O=C(O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)O1 2097055680 ZFEXRAYISSICPR-SSDOTTSWSA-N 270.201 -0.592 5 10 CBBE CN1CC(Cn2ccc(=O)c([N+](=O)[O-])c2)(C(=O)O)C1 2097198417 QGQHQMDWEBRTIQ-UHFFFAOYSA-N 267.241 -0.227 5 10 CBBE O=C(O)CC1(O)CN(C(=O)c2ccc([N+](=O)[O-])o2)C1 2110674863 YJZNLPXYEBWDBX-UHFFFAOYSA-N 270.197 -0.151 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@@H]3CCO[C@H]3C2)n1 2115448729 AJZSBJNPJRDSBQ-XPUUQOCRSA-N 266.261 -0.105 5 10 CBBE NC[C@H]1C[C@H](CN=c2cc(N)c([N+](=O)[O-])c[nH]2)CO1 2117188755 LGLSUHXWEYLJSY-HTQZYQBOSA-N 267.289 -0.230 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@H]2CCOC[C@H]2N)[nH]1 2117392715 PGRKHWGZGUZJHT-BDAKNGLRSA-N 267.289 -0.019 5 10 CBBE C[C@@H]1[C@@H](O)CN1S(=O)(=O)c1c(N)cccc1[N+](=O)[O-] 2126120707 WHCLWTITCJXZIV-MUWHJKNJSA-N 287.297 -0.069 5 10 CBBE Cc1cc([N+](=O)[O-])c(NC(C(N)=O)C(N)=O)cc1N 2141777096 BKIMBDRTOGGTPL-UHFFFAOYSA-N 267.245 -0.763 5 10 CBBE O=C(NCCC1(O)CNC1)c1cc([N+](=O)[O-])cnc1O 2143827140 CXMAMXXAWWUVPB-UHFFFAOYSA-N 282.256 -0.850 5 10 CBBE O=C(N[C@H]1C(=O)NC[C@@H]1C(=O)O)c1cc([N+](=O)[O-])cs1 2144412950 XZPGALASYMOHPB-CAHLUQPWSA-N 299.264 -0.415 5 10 CBBE CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)[C@H](O)C1 2146511111 PQIXQHBFZMCODC-DTWKUNHWSA-N 282.256 -0.900 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CCOC[C@H](CO)C2)n1 2154469457 KZWZNRMJWLQYPY-QMMMGPOBSA-N 283.288 -0.280 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=NC[C@H]2C[C@]23CCOC3)[nH]1 2156727917 FNSXVNUAHWYWGT-HQJQHLMTSA-N 280.288 -0.069 5 10 CBBE Cn1c(C(=O)N2C[C@H](N)[C@H]3COC[C@@H]32)ccc1[N+](=O)[O-] 2158356813 HKRQVMPCHQJQJC-WEDXCCLWSA-N 280.284 -0.269 5 10 CBBE Cn1cc([N+](=O)[O-])c(Cn2cc(C(=O)O)ncc2=O)n1 2159111493 PTYROOWEUJTQCS-UHFFFAOYSA-N 279.212 -0.369 5 10 CBBE COC1(C(N)=O)CN(Cc2cccc([N+](=O)[O-])c2N)C1 2161268474 XMJHCJULXPGWLX-UHFFFAOYSA-N 280.284 -0.137 5 10 CBBE CNc1nc[nH]c(=NCc2nccc(O)n2)c1[N+](=O)[O-] 2163354401 YFXXTSYWGWCLDG-UHFFFAOYSA-N 277.244 -0.044 5 10 CBBE CCCn1cc([N+](=O)[O-])cc1C(=O)N1CC(O)(CO)C1 2171952108 UMDIZGOGIRJUMQ-UHFFFAOYSA-N 283.284 -0.015 5 10 CBBE COc1nc(N[C@@H]2CNCC[C@@H]2CO)ncc1[N+](=O)[O-] 2172897671 YGEWERVGPOCKRE-HTQZYQBOSA-N 283.288 -0.224 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@]23CNC[C@H]2C3)[nH]1 2173899202 SXHQYZDAZYYFOL-PRHODGIISA-N 278.316 -0.318 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CCC[C@@H]2[C@H](O)CO)[nH]1 2179799808 PNUFUJCTJHYVJE-PSASIEDQSA-N 282.300 -0.225 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@@H]21 2186369033 BSFNEOAKEZEHMK-MUWHJKNJSA-N 279.256 -0.254 5 10 CBBE CN=c1nc(N2CC[C@@H]3CNC[C@H]32)c([N+](=O)[O-])c(C)[nH]1 2188884458 REGDXIKNXKKZHT-RKDXNWHRSA-N 278.316 -0.045 5 10 CBBE C[C@]1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 2197969187 YBKFCNONHFVSTO-KOLCDFICSA-N 284.272 -0.865 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@H]2C=CCN2)[nH]1 2199041592 WGPPNPVJFCTJJU-VIFPVBQESA-N 278.316 -0.091 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC2CC([C@@H](F)CO)C2)[nH]1 2199128089 UVLDZXOQDZEKDM-RRQHEKLDSA-N 285.279 -0.209 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CCOC[C@@H]2C(N)=O)c1 2206779993 SXECWSKSMUPDLU-SNVBAGLBSA-N 281.272 -0.429 5 10 CBBE C[C@H](CN=c1[nH]cncc1[N+](=O)[O-])c1nn[nH]n1 2219816497 BZLOQZZAZSOGPV-RXMQYKEDSA-N 250.222 -0.465 5 10 CBBE CCn1ncc([N+](=O)[O-])c1O[C@H]1CN(C)C[C@H]1N 2223813226 BIXZOQPIAJRSIT-APPZFPTMSA-N 255.278 -0.169 5 10 CBBE CS(=O)(=O)[C@H]1CNC[C@H]1Nc1ncncc1[N+](=O)[O-] 2227000831 SVXWCRFPIYNBNC-SVRRBLITSA-N 287.301 -0.818 5 10 CBBE NNc1cccc(CN2CC(C(N)=O)C2)c1[N+](=O)[O-] 2228606044 BHAXVRKYDCLAQF-UHFFFAOYSA-N 265.273 -0.203 5 10 CBBE Cc1c([N+](=O)[O-])c(=Nc2cnn(CCN)c2)[nH]n1C 2229344797 MIUFJOLOGMUDHO-UHFFFAOYSA-N 265.277 -0.043 5 10 CBBE CO[C@H](CO)CN=c1[nH]c(Cl)ncc1[N+](=O)[O-] 2252812191 DAYCPZLADOXXDM-YFKPBYRVSA-N 262.653 -0.121 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NC[C@@H](C)CO)[nH]1 2258627934 LXTOCYAIRNDQEZ-SSDOTTSWSA-N 256.262 -0.007 5 10 CBBE CO[C@H]1[C@@H](OCc2nn(C)cc2[N+](=O)[O-])C[C@H]1N 2258706561 VZTYCAOZVZWKBP-WHFVKQHSSA-N 256.262 -0.041 5 10 CBBE Cc1cnc(NCC2(O)CS(=O)(=O)C2)cc1[N+](=O)[O-] 2267891607 HBTBAIRAIVYQAY-UHFFFAOYSA-N 287.297 -0.130 5 10 CBBE O=C(O)c1cc(NC2CC(O)(CO)C2)ncc1[N+](=O)[O-] 2284563839 QZFCJHMDQZDULQ-UHFFFAOYSA-N 283.240 -0.014 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N[C@H](C(=O)O)[C@H](C)O)n1 2286635814 GOVLFWYCDBGOLA-XNCJUZBTSA-N 286.244 -0.223 5 10 CBBE CO[C@@H]1[C@@H](N)C[C@@H]1Oc1ncc([N+](=O)[O-])c(N(C)C)n1 2286749723 WKXODXICBAZZFW-CNUIFLNQSA-N 283.288 -0.056 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@H](O)C[C@H]1CO 2295573318 LBXKROKNAAQVKS-UWVGGRQHSA-N 281.268 -0.052 5 10 CBBE C[C@H](Cn1cnnc1)N=c1nc([N+](=O)[O-])n(C)[nH]1 2321694987 WKJNKRAPWNGYOK-ZCFIWIBFSA-N 252.238 -0.763 5 10 CBBE C[C@@H]1CNC[C@H](CN=c2nc([N+](=O)[O-])n(C)[nH]2)C1 2321756399 FFNWCPPKFICXMW-JGVFFNPUSA-N 254.294 -0.197 5 10 CBBE Cn1[nH]c(=N[C@H]2C[C@@H](CN)C2(C)C)nc1[N+](=O)[O-] 2321761655 VFCXDJREGGTAPA-BQBZGAKWSA-N 254.294 -0.070 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@H]2CCC[C@@H](O)[C@H]2O)[nH]n1C 2333447424 KMHZVIHCPPQDSP-XKSSXDPKSA-N 270.289 -0.255 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@H]2C[C@H](O)[C@H]2C1 2333483136 YNNJOUWHYKCGCM-JEZHCXPESA-N 266.257 -0.370 5 10 CBBE Cn1[nH]c(=NC[C@@H]2[C@H](C(=O)O)C2(F)F)nc1[N+](=O)[O-] 2345030570 LZSPDMDDDOBOLT-QWWZWVQMSA-N 277.187 -0.477 5 10 CBBE NC(=O)c1ccc(CNCC(=O)O)c([N+](=O)[O-])c1 35385131 KLPYDESGSYKDAE-UHFFFAOYSA-N 253.214 -0.132 5 10 CBBE NC[C@@H](O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 35453811 QXLNYFFOFSYZFW-MRVPVSSYSA-N 267.241 -0.360 5 10 CBBE NNc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCNC2=O)c1 51093979 NLEGYJXJRUMRTE-SECBINFHSA-N 293.283 -0.111 5 10 CBBE Cn1cc([N+](=O)[O-])c(=O)n(Cc2cc(NN)ccn2)c1=O 92425511 WZEPBLBKIFHVQH-UHFFFAOYSA-N 292.255 -0.816 5 10 CBBE C[C@@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])ccc1NN 157132942 YICNAEKRHNHYNG-LURJTMIESA-N 281.272 -0.126 5 10 CBBE CCN(CC(N)=O)c1ncnc(NC)c1[N+](=O)[O-] 231829309 BPWHFMJVIOWNHF-UHFFFAOYSA-N 254.250 -0.262 5 10 CBBE CN(CCOCCO)c1nc(N)ncc1[N+](=O)[O-] 302374448 MAONMXGWHKKQDG-UHFFFAOYSA-N 257.250 -0.588 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1NCC1(O)CNC1 311012568 AQULTFBADPCKJV-UHFFFAOYSA-N 255.278 -0.134 5 10 CBBE CNc1cnc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C(N)=O 311434611 RKOPQZPSRAHATQ-YFKPBYRVSA-N 267.245 -0.365 5 10 CBBE CN(C[C@H](O)CN)S(=O)(=O)c1cccc([N+](=O)[O-])c1 311716249 OQWZTMQGWSRMIC-SECBINFHSA-N 289.313 -0.465 5 10 CBBE O=[N+]([O-])c1cnc(N2CCC[C@](O)(CO)C2)nc1 313664906 HGCQYPOFPBFLLF-SNVBAGLBSA-N 254.246 -0.292 5 10 CBBE Cc1nc(N)nc(N2CC[C@](O)(CO)C2)c1[N+](=O)[O-] 314169764 LGPQHDXAWIKRNJ-SNVBAGLBSA-N 269.261 -0.791 5 10 CBBE CC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 355265929 OUGQLLSWQBRBKD-MRVPVSSYSA-N 269.261 -0.439 5 10 CBBE Cn1cncc1CCN=c1[nH]cnc(N)c1[N+](=O)[O-] 401683466 UOJXQUWVQMVVDZ-UHFFFAOYSA-N 263.261 -0.223 5 10 CBBE CC[C@@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)C(=O)OC 591973559 IPOGRABZLDPQIH-LURJTMIESA-N 269.261 0.000 5 10 CBBE CN[C@H](C(N)=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-] 698514322 PQGGMROFHAPKBX-SVRRBLITSA-N 254.246 -0.170 5 10 CBBE COc1ncnc(N2CCN(C)C[C@H]2CO)c1[N+](=O)[O-] 699476765 YDLRORXKXIAXFA-QMMMGPOBSA-N 283.288 -0.494 5 10 CBBE Cn1nc(O)n(-c2cc([N+](=O)[O-])ccc2C(=O)O)c1=O 700381718 VLNUWCSQRTYJPF-UHFFFAOYSA-N 280.196 -0.117 5 10 CBBE O=C(N[C@H]1CNC[C@@H]1O)c1c(F)cccc1[N+](=O)[O-] 714026346 RLRBAQWQQSFCIO-CBAPKCEASA-N 269.232 -0.204 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1[C@H]2CC[C@@H]1CNC2 723867718 LIOZJYSMEDPHMS-DTORHVGOSA-N 265.273 -0.246 5 10 CBBE O=C1OCC[C@@H]1NS(=O)(=O)c1ncccc1[N+](=O)[O-] 849369032 WIXOISBEBDAOSJ-LURJTMIESA-N 287.253 -0.416 5 10 CBBE Cc1nc(N2CCN3C[C@H](O)C[C@H]3C2)ncc1[N+](=O)[O-] 1326839441 RLIDNWIFHSLYCI-VHSXEESVSA-N 279.300 -0.052 5 10 CBBE NC(=O)NC[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1596032821 QEPYXXCZIJSHJN-IWSPIJDZSA-N 270.289 -0.442 5 10 CBBE Cc1[nH]nc(C(=O)N2CCN(C)C[C@H]2CO)c1[N+](=O)[O-] 1641533913 PLXZMXVOCTWETB-QMMMGPOBSA-N 283.288 -0.625 5 10 CBBE CNC(=O)[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 1643501317 HUMPATPJFKOVHG-VIFPVBQESA-N 267.289 -0.141 5 10 CBBE O=C(NCC(=O)N1CC[C@H]1CO)c1cccc([N+](=O)[O-])c1 1645409064 PCFBXHNXIWKOFM-NSHDSACASA-N 293.279 -0.082 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CC[C@@H](NC(N)=O)C2)n1 1650933083 XUZWBBQJPVMWBK-ZCFIWIBFSA-N 254.250 -0.425 5 10 CBBE O=C(c1cc2n(n1)CCCO2)N1CCN=C1C[N+](=O)[O-] 1851756381 ZQUOFMNGXWEGTR-UHFFFAOYSA-N 279.256 -0.203 5 10 CBBE NC(=O)C[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1866106248 QTBBXGWZNDHIHL-LURJTMIESA-N 297.227 -0.356 5 10 CBBE CCO[C@H](CNC(=O)N1CC([N+](=O)[O-])C1)CC(=O)O 1876137162 NOWARZUDQYCTGN-QMMMGPOBSA-N 275.261 -0.463 5 10 CBBE O=C(O)[C@@H]1[C@@H]2CC[C@@H]2CN1C(=O)N1CC([N+](=O)[O-])C1 1876148490 GVOXMKFEIBMWGX-VDAHYXPESA-N 269.257 -0.138 5 10 CBBE CC1(C)NC(=O)N(CCCN2CC([N+](=O)[O-])C2)C1=O 1876150299 SJUNZKCALDUYSQ-UHFFFAOYSA-N 270.289 -0.332 5 10 CBBE CN=c1[nH]c(=NC[C@@H]2CCCCN2)[nH]cc1[N+](=O)[O-] 1885004173 HTNGZHFYXZQLJD-QMMMGPOBSA-N 266.305 -0.176 5 10 CBBE NC(=O)C1(O)CN(c2c(C(=O)O)cccc2[N+](=O)[O-])C1 1915225261 XCFIUSNAZWGKAG-UHFFFAOYSA-N 281.224 -0.671 5 10 CBBE COC(=O)C1(N)CC(Oc2c([N+](=O)[O-])cnn2C)C1 1916436771 SRMBXGXHZUZKFW-UHFFFAOYSA-N 270.245 -0.260 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCN3C(=O)NC[C@@H]3C2)n1 1964211244 PCDJPGROEXEWAS-MRVPVSSYSA-N 280.288 -0.462 5 10 CBBE Nc1ccccc1S(=O)(=O)N1CC([N+](=O)[O-])C1 2016887913 SBOLXUPIKSHWAP-UHFFFAOYSA-N 257.271 -0.082 5 10 CBBE COc1ncnc(N2C[C@@](C)(O)CO2)c1[N+](=O)[O-] 2032462777 ZPUOXOQMLGRCPL-SECBINFHSA-N 256.218 -0.104 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H](CCN)C(F)(F)F 2041250128 BAOTYDQCNIFCPP-SCSAIBSYSA-N 268.199 -0.163 5 10 CBBE O=[N+]([O-])c1c(F)nc[nH]c1=NC[C@@H]1[C@H]2CNC[C@H]21 2044046683 LWAUQLJIOUICFY-ZMONIFLSSA-N 253.237 -0.177 5 10 CBBE O=[N+]([O-])c1c(N[C@@H]2C[C@@H](O)C[C@@H]2O)ccnc1O 2046399927 SRYIIKBKNNBWPM-NJUXHZRNSA-N 255.230 -0.009 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2CCCCN2)[nH]1 2053600847 APLBUOMDMYLJSD-SSDOTTSWSA-N 252.278 -0.227 5 10 CBBE NC[C@H]1COC[C@H]1Nc1ncnc(N)c1[N+](=O)[O-] 2053716950 CWNFRRFFPOZAGU-NTSWFWBYSA-N 254.250 -0.647 5 10 CBBE NC(=O)[C@@H]1OCC[C@@H]1N=c1cccc([N+](=O)[O-])[nH]1 2053795130 MKQYOPXRMVISNB-IMTBSYHQSA-N 252.230 -0.534 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NC/C=C/C(=O)O)n1 2066488427 BAHQCZVWVRTUQM-NSCUHMNNSA-N 254.202 -0.301 5 10 CBBE CN(C)[C@@H]1CN(c2ncnc(N)c2[N+](=O)[O-])C[C@H]1O 2089916356 UHDXTNXBUPRUON-RNFRBKRXSA-N 268.277 -0.922 5 10 CBBE NC(=O)c1ccc(O[C@H]2COC[C@H]2N)cc1[N+](=O)[O-] 2090645748 JVCSOFGLBMFRAC-SCZZXKLOSA-N 267.241 -0.201 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@H]2C[C@H]1[C@@H](O)[C@@H]2O 2104391867 DJMWUMOFDGQPFL-IXROVEORSA-N 270.220 -0.546 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCCOC(=O)NC)[nH]1 2104893606 BDBXXJDKTSGRRO-UHFFFAOYSA-N 270.249 -0.962 5 10 CBBE CN=c1[nH]c(NCc2nc(=O)o[nH]2)ncc1[N+](=O)[O-] 2116167603 HIRAKBHNJZTSSG-UHFFFAOYSA-N 267.205 -0.863 5 10 CBBE CCCN=c1nc(N(CCN)OC)c([N+](=O)[O-])c[nH]1 2117216910 YZTPZYHPSPFTLO-UHFFFAOYSA-N 270.293 -0.045 5 10 CBBE NNc1ncnc(N2CC=CC[C@H]2CO)c1[N+](=O)[O-] 2119806400 ANMLMTOROCSFOS-ZETCQYMHSA-N 266.261 -0.202 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)CCNC12CCC2 2120792442 JLFIFUQKKDMOQA-SNVBAGLBSA-N 267.245 -0.118 5 10 CBBE NCc1ocnc1Cn1cc([N+](=O)[O-])c(C(=O)O)n1 2123095372 RCJHROJUVXNIKV-UHFFFAOYSA-N 267.201 -0.016 5 10 CBBE CN1CCN(c2c([N+](=O)[O-])cnn2C)[C@@H](CCO)C1 2138070863 CFRQXYAXAQIQLK-VIFPVBQESA-N 269.305 -0.169 5 10 CBBE NC(=O)CC[C@@H](N=c1cccc([N+](=O)[O-])[nH]1)C(=O)O 2141186010 KYGRTSKYXDJUDZ-ZCFIWIBFSA-N 268.229 -0.458 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@]2(C(=O)O)C[C@H](O)C2)[nH]n1C 2142481845 QHXVDINRUDEDIC-XGAOUMNUSA-N 270.245 -0.551 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@@]2(O)CCN(C)C2)[nH]n1C 2142497697 YJKRVBDEFOWTBE-NSHDSACASA-N 269.305 -0.463 5 10 CBBE CCOC(=O)CC[C@@H](O)Cn1cc([N+](=O)[O-])cnc1=O 2143456829 ALZZLTVRZYTJMF-SECBINFHSA-N 285.256 -0.144 5 10 CBBE Nc1ncnc(N2[C@H](CO)C[C@@H]3OCC[C@@H]32)c1[N+](=O)[O-] 2146701995 HFRHGNAXMDRJIV-FXQIFTODSA-N 281.272 -0.305 5 10 CBBE CC1(C)CN(c2nc(NN)ccc2[N+](=O)[O-])CC(=O)N1 2150465626 PHEHYEVOXZAWEM-UHFFFAOYSA-N 280.288 -0.010 5 10 CBBE NNc1ncnc(NC[C@H]2C[C@H](O)CCO2)c1[N+](=O)[O-] 2154219000 DJIIMTGMAOIBBT-RNFRBKRXSA-N 284.276 -0.378 5 10 CBBE CN=c1[nH]c(NC[C@@H](O)c2cnc[nH]2)ncc1[N+](=O)[O-] 2157672052 JLEWHQSEKLFTKD-MRVPVSSYSA-N 279.260 -0.283 5 10 CBBE COc1nc(N[C@H]2COC[C@@H]2C(=O)O)ncc1[N+](=O)[O-] 2157677489 WGLOYMPILSYMFN-WDSKDSINSA-N 284.228 -0.095 5 10 CBBE COc1nc(OC2CC(N)(C(=O)O)C2)ncc1[N+](=O)[O-] 2157681455 CPSJIFLZOWFJCJ-UHFFFAOYSA-N 284.228 -0.283 5 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269.261 -0.565 5 10 CBBE C[C@]1(CN=c2[nH]cnc(F)c2[N+](=O)[O-])CNCCO1 2106061742 XVZACVKMAFBPSX-SNVBAGLBSA-N 271.252 -0.264 5 10 CBBE N=c1cc([N+](=O)[O-])cc(NCC2(O)CCNCC2)[nH]1 2117388953 DDZLGPLXIHTEKC-UHFFFAOYSA-N 267.289 -0.071 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2CCONC2)[nH]1 2117394662 HQBSIKZYQWUACR-SSDOTTSWSA-N 268.277 -0.716 5 10 CBBE CCON(C(=O)Cn1ccc([N+](=O)[O-])n1)C1CNC1 2118327680 RGALHONRKWPSIT-UHFFFAOYSA-N 269.261 -0.457 5 10 CBBE NC[C@H](Oc1nc2ccc([N+](=O)[O-])cc2[nH]1)C(N)=O 2119764289 WGFXDVPMWGCKIY-QMMMGPOBSA-N 265.229 -0.338 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@]1(N)CCOC1 2129973454 VRLQAXYMHDMFEC-JTQLQIEISA-N 269.261 -0.824 5 10 CBBE O=c1nc(O)c([N+](=O)[O-])cn1CC1COCCOC1 2131425701 TVBPEGCHYZOSHJ-UHFFFAOYSA-N 271.229 -0.480 5 10 CBBE NNc1cc(N2CC[C@@H](O)[C@@H](O)C2)cc([N+](=O)[O-])c1 2132117404 WJLCWCPXWRHHEF-MNOVXSKESA-N 268.273 -0.188 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1[C@H]2CCNC[C@H]1COC2 2139772815 URQBKOOOXMHAQV-IUCAKERBSA-N 267.289 -0.105 5 10 CBBE Cn1c(C(=O)N2C[C@H](CO)C[C@@H]2CO)ccc1[N+](=O)[O-] 2146121148 FXRCOCYNQQGUAA-RKDXNWHRSA-N 283.284 -0.251 5 10 CBBE CN(CC(CO)CO)c1cc(C(=O)O)c([N+](=O)[O-])cn1 2150413892 CREIGTNTFYJOLI-UHFFFAOYSA-N 285.256 -0.275 5 10 CBBE CN=c1nc(OC[C@@H]2COCCO2)c([N+](=O)[O-])c(C)[nH]1 2154020084 YRVLAPWIFJMKQH-QMMMGPOBSA-N 284.272 -0.049 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CCOC[C@H](CO)C1 2154493874 QFNBRICFOQMXIL-VIFPVBQESA-N 284.272 -0.741 5 10 CBBE NNc1ncnc(NC[C@H]2C[C@@H](CO)CO2)c1[N+](=O)[O-] 2157532037 KAHWKRJPBSIPEP-NKWVEPMBSA-N 284.276 -0.520 5 10 CBBE CN=c1[nH]c(N2CC[C@@H](O)[C@@H](CO)C2)ncc1[N+](=O)[O-] 2157680386 NLYGBLVEVVOHOS-VXNVDRBHSA-N 283.288 -0.972 5 10 CBBE N[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1C(F)F 2158711452 DYGFNCVKOLSBBX-BQBZGAKWSA-N 289.242 -0.158 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=N[C@@H]1CCc2nncn2C1 2159935235 ODGGTMDVYSRIDV-ZCFIWIBFSA-N 279.235 -0.036 5 10 CBBE COc1ncnc(O[C@@H]2CN[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 2167173676 KFUZKZRNTCKMJM-NTSWFWBYSA-N 284.228 -0.413 5 10 CBBE NC(=O)NCCCN=c1cc(C(=O)O)c([N+](=O)[O-])c[nH]1 2167838824 PFAUEKDVIVZAQO-UHFFFAOYSA-N 283.244 -0.420 5 10 CBBE CCN(c1nc(NN)ccc1[N+](=O)[O-])[C@@H]1CCNC1=O 2171225792 IDUCJYTXLSIVPQ-MRVPVSSYSA-N 280.288 -0.010 5 10 CBBE CN=c1nc(N2CCC(N)(CO)CC2)c([N+](=O)[O-])c[nH]1 2173842869 QAOAOTOZXKVDAA-UHFFFAOYSA-N 282.304 -0.862 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@H]3CNC[C@H]32)[nH]1 2174036890 DTDDFWQFNNCWDR-DJLDLDEBSA-N 278.316 -0.320 5 10 CBBE Cc1[nH]c(=N)nc(NC23COC(CN)(C2)C3)c1[N+](=O)[O-] 2174038942 ZXXDYMFBZMKVPP-UHFFFAOYSA-N 280.288 -0.222 5 10 CBBE O=[N+]([O-])c1cnc(=NC[C@@H]2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)[nH]c1 2174415544 CLBLFBLIYUAIAR-GOIIVKRLSA-N 280.284 -0.404 5 10 CBBE C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H](O)C(=O)O 2176871991 XOQJQZYJJUHJFE-CLZZGJSISA-N 285.212 -0.741 5 10 CBBE CO[C@@H]1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 2187239694 VWZONIMVNMMCLQ-FXBDTBDDSA-N 284.272 -0.554 5 10 CBBE CN(c1ncnc(NN)c1[N+](=O)[O-])C1COCCOC1 2188030772 CFXRXKZNYHPRCG-UHFFFAOYSA-N 284.276 -0.478 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN[C@@H]2COC[C@@H]21 2189093529 NJYFAMRWPGIXRG-KOLCDFICSA-N 280.284 -0.254 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)n1 2201284754 OVYARPPCIPIZJL-MTBHXBHISA-N 278.272 -0.557 5 10 CBBE CN1CCN(c2ncc([N+](=O)[O-])c(=N)[nH]2)[C@H](CCO)C1 2202830200 KKVDYFFKOGNVNI-MRVPVSSYSA-N 282.304 -0.700 5 10 CBBE COC(=O)[C@@H]1C[C@@H](Oc2nn(C)c(C)c2[N+](=O)[O-])CN1 2207487390 FTEINOVBWMBUIQ-SFYZADRCSA-N 284.272 -0.081 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@H]2CCO[C@@H]2C(N)=O)[nH]1 2230778535 JXGPEUXUKMNXRD-XPUUQOCRSA-N 269.261 -0.712 5 10 CBBE O=[N+]([O-])c1cc(F)cnc1N1CC[C@](O)(CO)[C@@H](O)C1 2234106901 RLDHZWCBYZMDIW-ONGXEEELSA-N 287.247 -0.577 5 10 CBBE O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1CONC1=O 2237449653 ZCSSBGKNYSYYHJ-VIFPVBQESA-N 283.215 -0.177 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@H]2OCC[C@@H]2CN)n1 2240643228 VMTWEXTVTMYZLA-XCBNKYQSSA-N 283.288 -0.692 5 10 CBBE O=[N+]([O-])c1cccnc1NCC1(O)CS(=O)(=O)C1 2256094322 NCUFIPVJANBQEN-UHFFFAOYSA-N 273.270 -0.439 5 10 CBBE COC(=O)[C@@H](CN)Oc1nc(C)ncc1[N+](=O)[O-] 2258632794 IWVOHFJNIFPSKC-SSDOTTSWSA-N 256.218 -0.428 5 10 CBBE N[C@@H]1COC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 2263702540 KWJLLKFZGDLROE-APPZFPTMSA-N 252.230 -0.554 5 10 CBBE N[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 2263705274 ASQABJOYRCUJKS-ZCFIWIBFSA-N 254.202 -0.869 5 10 CBBE CNc1ncnc(N(CCN)C[C@H](C)O)c1[N+](=O)[O-] 2269805490 WNWTXDATRKEXKP-ZETCQYMHSA-N 270.293 -0.428 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCCn2cnnn2)[nH]1 2286643877 YHFFSWGIGYAMJH-UHFFFAOYSA-N 280.248 -0.948 5 10 CBBE Cc1ncc([N+](=O)[O-])c(NN(C)S(C)(=O)=O)n1 2301550097 MJUXWLOUYUZBCC-UHFFFAOYSA-N 261.263 -0.088 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@@H](O)[C@@H](O)[C@H]2CF)n1 2311998991 NDZUOWKYHRDFPH-NJUXHZRNSA-N 260.225 -0.792 5 10 CBBE Cn1[nH]c(=NCC2COCCOC2)nc1[N+](=O)[O-] 2321695812 DVZFKMBTYCOHDJ-UHFFFAOYSA-N 257.250 -0.780 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@]3(C(=O)O)C[C@H]23)nc1[N+](=O)[O-] 2321740744 DSPCVDJJSFXMTJ-UDJQAZALSA-N 253.218 -0.580 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2CC[C@H]1[C@@H]2N 2331666123 QPSFARIGVRPNHW-ACLDMZEESA-N 265.273 -0.110 5 10 CBBE Nc1cc(NC[C@H]2NC[C@@H](O)[C@H]2O)cc([N+](=O)[O-])c1 2333606782 FIVKGZGKDFXIQN-MXWKQRLJSA-N 268.273 -0.718 5 10 CBBE C[C@H](N=c1nc([N+](=O)[O-])n(C)[nH]1)[C@H]1CCS(=O)(=O)C1 2344967021 AKTDXKGWYFFSOM-BQBZGAKWSA-N 289.317 -0.620 5 10 CBBE CO[C@@H]1C[C@@H](C(=O)O)N(c2nc([N+](=O)[O-])n(C)n2)C1 2345005357 XNALIPMWPXQMSI-RITPCOANSA-N 271.233 -0.598 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)[nH]1 2355335912 IWQXFYGJKYFKHR-NNXMZFEESA-N 280.284 -0.277 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N1CCN(CCO)CC1 35189104 ZEMVXFSPWIEZLA-UHFFFAOYSA-N 297.315 -0.682 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1CCNC[C@@H]1C(=O)O 91554652 YYTNAUFRWUILFF-MRVPVSSYSA-N 283.288 -0.018 5 10 CBBE Cc1nc(NN)nc(N(C)CC(=O)N(C)C)c1[N+](=O)[O-] 234227269 XXBNMZZVXPTOMK-UHFFFAOYSA-N 283.292 -0.497 5 10 CBBE CN1CCN(Nc2cc([N+](=O)[O-])cc(NN)n2)CC1 234332609 DZAQIBIANHHSJE-UHFFFAOYSA-N 267.293 -0.150 5 10 CBBE CN1CCN(c2ncc([N+](=O)[O-])cc2C(=O)O)CC1=O 234333712 OKMAOOMRAURSEV-UHFFFAOYSA-N 280.240 -0.034 5 10 CBBE CNC(=O)c1ccn(-c2cc([N+](=O)[O-])cc(NN)n2)n1 234370334 AXMNAVXHDWVCBT-UHFFFAOYSA-N 277.244 -0.179 5 10 CBBE O=[N+]([O-])c1ccc(N2C[C@H](O)[C@H](O)C2)c(CO)c1 236521918 XMOJXZHQPRANNG-PHIMTYICSA-N 254.242 -0.371 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)N[C@H]1CCOC1 302256569 BAYHSRWAGLHTPR-LURJTMIESA-N 267.245 -0.206 5 10 CBBE O=C(O)/C=C/CNC(=O)Cn1cc([N+](=O)[O-])cn1 306074746 FJSAEDHTNKNJKO-OWOJBTEDSA-N 254.202 -0.452 5 10 CBBE C[C@H]1C(=O)NC(=O)CN1c1ccc(N)c([N+](=O)[O-])n1 311779802 HSSPCSNWHDDDIO-YFKPBYRVSA-N 265.229 -0.577 5 10 CBBE NC(=O)[C@@]1(O)CCN(c2ccc(CO)cc2[N+](=O)[O-])C1 312513798 SLFYTSWVCMBSAP-GFCCVEGCSA-N 281.268 -0.486 5 10 CBBE O=C(O)[C@@H](O)CS(=O)(=O)c1cccc([N+](=O)[O-])c1 313475550 UDVNTXWGURVQTQ-QMMMGPOBSA-N 275.238 -0.186 5 10 CBBE COC(=O)/C=C/Cn1c(=O)c([N+](=O)[O-])cn(C)c1=O 328423998 BNTVJTOLXKPQFQ-ONEGZZNKSA-N 269.213 -0.816 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC(=O)N(C)C2)n1 331153837 BCUCZJBNBZSQEO-ZETCQYMHSA-N 281.272 -0.228 5 10 CBBE CCO[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H]1CN 593916372 IODGBQVDWAGBHE-VXNVDRBHSA-N 283.288 -0.246 5 10 CBBE O=C1NCC[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 594788915 BZLXBJYFSUVVEZ-SECBINFHSA-N 285.281 -0.238 5 10 CBBE O=C(NC[C@H]1CN2CCCN1CC2)c1c[nH]nc1[N+](=O)[O-] 597627423 ZQONSAZEAWRXJA-VIFPVBQESA-N 294.315 -0.562 5 10 CBBE O=C(N[C@H]1CNC[C@@H]1O)c1ccc([N+](=O)[O-])cc1F 699900203 PNDIKDGQCOJSOV-UWVGGRQHSA-N 269.232 -0.204 5 10 CBBE O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CNC[C@H]1O 700632063 YDWRHULNXBXBOG-WCBMZHEXSA-N 281.268 -0.578 5 10 CBBE CN(c1cc([N+](=O)[O-])cc(NN)n1)[C@@H]1COC[C@H]1O 708084146 ZKYLFRZEIDDJGX-HTQZYQBOSA-N 269.261 -0.529 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)Nc1nn[nH]n1 709952444 HLPFYEBPPHSCMN-UHFFFAOYSA-N 265.193 -0.959 5 10 CBBE O=C(c1c(F)cccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 714017330 LTDDXOUFYAQFFD-IUCAKERBSA-N 270.216 -0.089 5 10 CBBE CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1C 763729207 ZAHBEVOAVSMHAB-JTQLQIEISA-N 281.268 -0.260 5 10 CBBE O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(CCn2cncn2)CC1 1147843376 KWTIJELNQRHZTC-GHMZBOCLSA-N 294.315 -0.913 5 10 CBBE Cn1nnn(CCOc2ccccc2[N+](=O)[O-])c1=O 1189770263 RTBPPJOTGAGYGR-UHFFFAOYSA-N 265.229 -0.036 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)OC[C@H]1COCCO1 1326736316 UKPPCXZPOKDMHK-SSDOTTSWSA-N 272.217 -0.855 5 10 CBBE COC(=O)c1cnc(N2CC[C@@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 1458535355 NHNKSUKXQVYUTF-ZJUUUORDSA-N 297.267 -0.292 5 10 CBBE COC(=O)[C@H]1[C@@H](O)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1556207642 JOFQUKQYYAYRJE-JGVFFNPUSA-N 298.255 -0.544 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@H](C(N)=O)C1 1585412977 IHUATSQDWKWFMM-QMMMGPOBSA-N 281.272 -0.566 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nn1ccnn1 1624632588 KRDUWUVXEWJBLB-UHFFFAOYSA-N 264.201 -0.882 5 10 CBBE O=[N+]([O-])c1cnn(CCN2CC[C@H](c3nn[nH]n3)C2)c1 1655439444 NJMOITAQEOUIEK-QMMMGPOBSA-N 278.276 -0.206 5 10 CBBE C[C@@H](CN)N(CC(=O)O)Cc1nn(C)cc1[N+](=O)[O-] 1878844492 YCLICOPPHBSTPA-ZETCQYMHSA-N 271.277 -0.438 5 10 CBBE Cn1cc([N+](=O)[O-])c(C[S@@](=O)CC[C@H](N)C(=O)O)n1 1882626530 VJKTXKCVGNDYBT-PVDFSEMESA-N 290.301 -0.621 5 10 CBBE CCCn1cc([N+](=O)[O-])c(=O)n(CC=CC(=O)O)c1=O 1912012217 NCCCAHYPPBZLBI-UHFFFAOYSA-N 283.240 -0.031 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CC(CO)(CO)C2)[nH]1 1914984581 CUILJKULEKXWJY-UHFFFAOYSA-N 268.273 -0.756 5 10 CBBE NC[C@]1(CO)COCCN1c1cccc([N+](=O)[O-])n1 1925559722 VRQGZPFDWPJJQZ-NSHDSACASA-N 268.273 -0.484 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CC[C@H]2CNC[C@H]21 1963567121 WVVQDPQZILZTOD-IVZWLZJFSA-N 279.300 -0.095 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)N2C[C@H]3[C@@H](O)C[C@H]3C2)c1 1965792287 PVOVVRIIJVUFJZ-XROYCOCOSA-N 299.308 -0.009 5 10 CBBE CS[C@@H]1COC[C@@H]1N=c1nc([N+](=O)[O-])[nH]n1C 2026384395 DRYHHJXDUWMCFC-NTSWFWBYSA-N 259.291 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CBBE COC[C@@](C)(NC(=O)N1CC([N+](=O)[O-])C1)C(=O)O 2071563683 MLTJCTSMBFVKRT-SECBINFHSA-N 261.234 -0.853 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@@H]3C[C@]3(CO)C2)n1 2090115692 HYJQGSBRKLFTQQ-QUBYGPBYSA-N 266.261 -0.511 5 10 CBBE Cc1c(CN2CC(N)(C(N)=O)C2)cccc1[N+](=O)[O-] 2109488165 WKIWBTYSDUVAOH-UHFFFAOYSA-N 264.285 -0.098 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2C=CCNC2)[nH]1 2117337134 FQEHEUBRMFBJEC-MRVPVSSYSA-N 264.289 -0.481 5 10 CBBE Cc1cc(O[C@@H]2CS(=O)(=O)C[C@@H]2N)ncc1[N+](=O)[O-] 2121465732 QMSJYSVUHNKDRF-IONNQARKSA-N 287.297 -0.199 5 10 CBBE O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H](C2)[C@H](O)[C@@H]3O)nc1 2126149396 YVUFWEZZUPLFJR-SWOGREBESA-N 266.257 -0.437 5 10 CBBE O=[N+]([O-])c1cnc(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)nc1 2134816077 JNIFMSSXMOVJFQ-MIBSWOBISA-N 266.257 -0.295 5 10 CBBE C[C@]1(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CNCCO1 2137715385 YYYVIBNUWJXODN-LLVKDONJSA-N 266.257 -0.271 5 10 CBBE Cc1nn(C)c(N2C[C@H](O)[C@@H](O)[C@@H]2CF)c1[N+](=O)[O-] 2140665166 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2109592423 MDIXYRGIZQVJLV-JTQLQIEISA-N 272.261 -0.646 5 10 CBBE C[C@@H]1C[C@@H]1N(CCO)c1ncnc(NN)c1[N+](=O)[O-] 2110788044 XJDSJTDEEOSWJT-RQJHMYQMSA-N 268.277 -0.123 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H](F)C2CNC2)[nH]1 2117113957 OUTNJSGVXNHELI-SSDOTTSWSA-N 270.268 -0.760 5 10 CBBE CCCN=c1cc([N+](=O)[O-])cc(NC[C@@H](N)CO)[nH]1 2117354779 CGLDTZOTQZLHEN-MRVPVSSYSA-N 269.305 -0.035 5 10 CBBE Cc1cc(=N[C@@H]2CCO[C@H]2C(N)=O)c([N+](=O)[O-])c[nH]1 2117474516 IXGCVFMJLXWWHS-GMSGAONNSA-N 266.257 -0.225 5 10 CBBE C[C@@H](O)[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N(C)C)n1 2117479175 VOMUICMQNWFYPG-RNFRBKRXSA-N 271.277 -0.396 5 10 CBBE C[C@H](O)[C@@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-] 2118159979 LYPQHQNAVMLHHB-WKEGUHRASA-N 270.241 -0.228 5 10 CBBE CON(c1nc(=N)[nH]c(C)c1[N+](=O)[O-])[C@@H]1CCNC1 2119476370 PXJBTDYUKBMSEQ-SSDOTTSWSA-N 268.277 -0.165 5 10 CBBE Cc1nc([N+](=O)[O-])c(O[C@H]2CNC[C@H]2N(C)C)n1C 2119764913 DHOFIHMWTRIDEX-BDAKNGLRSA-N 269.305 -0.082 5 10 CBBE Cc1nc([N+](=O)[O-])c(O[C@]2(C(N)=O)CCNC2)n1C 2119885751 RJESWRRTAPOILT-SNVBAGLBSA-N 269.261 -0.767 5 10 CBBE C[C@]1(O)CC[C@H](N=c2[nH]c(NN)ncc2[N+](=O)[O-])C1 2130304496 YZCAANQVFOHJOK-WKEGUHRASA-N 268.277 -0.192 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC[C@]2(C[C@H](O)CO2)C1 2137136455 VPCGDQSEJOMVQR-XVKPBYJWSA-N 269.261 -0.547 5 10 CBBE Cc1c([N+](=O)[O-])c(N2C[C@H](O)[C@@H](N(C)C)C2)nn1C 2142482399 XSHARLCHWOCXGD-IUCAKERBSA-N 269.305 -0.252 5 10 CBBE CO[C@@H]1CN[C@@H](CN=c2[nH]n(C)c(C)c2[N+](=O)[O-])C1 2142484643 AMLHGFAUBLVMGF-BDAKNGLRSA-N 269.305 -0.153 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CC(OC(=O)NC)C2)[nH]1 2146881273 ZVTRLHFWESXJJE-UHFFFAOYSA-N 281.272 -0.002 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC[C@]12CNC[C@H]1C2 2148964445 OVZFKUWYEMCEKI-SKDRFNHKSA-N 279.300 -0.093 5 10 CBBE Nc1[nH]c(=NCCCC[C@H](N)C(=O)O)ccc1[N+](=O)[O-] 2151572286 WIHMMGUEYWIUJG-ZETCQYMHSA-N 283.288 -0.012 5 10 CBBE COc1nc(N[C@@H]2[C@H](N)[C@@H]3CCO[C@H]32)ncc1[N+](=O)[O-] 2157678118 GDBYDZJYKMUAJI-KDBVAPGDSA-N 281.272 -0.080 5 10 CBBE Cn1c(C(=O)N2C[C@H](O)[C@H]3COC[C@@H]32)ccc1[N+](=O)[O-] 2158414255 MECNDJDNYRANPT-HGNGGELXSA-N 281.268 -0.235 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCCn1cc(C2CC2)nn1 2159180222 IKTAQARYKFYWCD-UHFFFAOYSA-N 278.276 -0.274 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CCN([C@H]2CCNC2)CC1 2159180360 JXEMMNMWOSGYSX-VIFPVBQESA-N 281.320 -0.793 5 10 CBBE CNC(=O)OCCNC(=O)c1cc(=N)[nH]cc1[N+](=O)[O-] 2161180860 LPAIZAZLYHBGKP-UHFFFAOYSA-N 283.244 -0.512 5 10 CBBE O=C(O)c1cc(N2CCNC[C@@H](O)C2)ncc1[N+](=O)[O-] 2162797309 INZYKJNJIGIGPO-SSDOTTSWSA-N 282.256 -0.542 5 10 CBBE NC(=O)C1(N)CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 2165758412 KIDGJSLKQCPZFR-UHFFFAOYSA-N 298.686 -0.113 5 10 CBBE COC(=O)[C@H]1C[C@@H](Oc2ccc([N+](=O)[O-])c(N)n2)CN1 2167173783 JJRLAZHAZOOIPE-RNFRBKRXSA-N 282.256 -0.146 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC(=O)N[C@@H]3CC[C@H]32)n1 2168362882 MOGGPSCVQBRZNM-RNFRBKRXSA-N 278.272 -0.257 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2C[C@@](F)(CN)C2)[nH]1 2173753212 NLZONVSRSPCRGO-AGGWVSIMSA-N 284.295 -0.241 5 10 CBBE CN=c1nc(N2CC[C@@H](C3CNC3)C2)c([N+](=O)[O-])c[nH]1 2173805387 RNTSQBJLYGBMEI-MRVPVSSYSA-N 278.316 -0.106 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@H]3CCO[C@@]3(CN)C2)n1 2175189379 MQDBWQUPPZLSQS-SKDRFNHKSA-N 281.316 -0.122 5 10 CBBE C[C@H]1CNC(=O)CN1C(=O)c1cc([N+](=O)[O-])ncc1N 2181166784 DAXGIFGJOCOUIJ-LURJTMIESA-N 279.256 -0.468 5 10 CBBE Cc1ccnc(N2CC3(C2)OC[C@H](O)[C@H]3O)c1[N+](=O)[O-] 2183728536 QNCVCXXOCNPKRB-WCBMZHEXSA-N 281.268 -0.391 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[C@@H](CO)CO1 2186548973 YHXYFZOYXPGFCB-YUMQZZPRSA-N 284.272 -0.545 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@@H]1C(=O)O 2186551997 VEDFQRDPCAFKKQ-XNCJUZBTSA-N 284.228 -0.700 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)[nH]1 2199526936 MMQKJHSYUXXBLF-SEZOGAINSA-N 280.284 -0.277 5 10 CBBE CN(C)[C@@H]1CN(c2cc(NN)ccc2[N+](=O)[O-])C[C@H]1O 2206776112 PITYHQATBIFUFI-VXGBXAGGSA-N 281.316 -0.009 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2COC[C@]2(C)C(=O)O)[nH]n1C 2207479358 ZGQUXXOIWHHDFQ-HQJQHLMTSA-N 284.272 -0.040 5 10 CBBE CN[C@H](C)CC(=O)NCc1nn(C)cc1[N+](=O)[O-] 2223843038 LAJCHSQEXIGWIG-SSDOTTSWSA-N 255.278 -0.058 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC[C@H]2COCCN2C)[nH]1 2230761325 DNOUHNBKFVIOIW-VIFPVBQESA-N 269.305 -0.024 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N[C@@H](CC(N)=O)C(=O)O 2231842528 OZHGBSRMCORGLO-YFKPBYRVSA-N 271.233 -0.448 5 10 CBBE CN=c1cc(C)[nH]c(=NCc2nn(C)cc2[N+](=O)[O-])[nH]1 2240655126 ZGSQYVYWCFDGMS-UHFFFAOYSA-N 277.288 -0.076 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]2CO)[nH]1 2258637940 WEGZNDQTWJZAAY-RNFRBKRXSA-N 254.246 -0.254 5 10 CBBE CCc1nn(C)c(N2CC(O)(CCO)C2)c1[N+](=O)[O-] 2270657972 RTJYCTXRKHZBOT-UHFFFAOYSA-N 270.289 -0.176 5 10 CBBE NNc1cc(N2CC[C@H]2[C@@H](O)CO)ccc1[N+](=O)[O-] 2270702626 UYJLCECAEPEMNC-QWRGUYRKSA-N 268.273 -0.188 5 10 CBBE O=[N+]([O-])c1cnn2ccc(NC3(CO)CNC3)nc12 2278460714 ZAHBMVONXZSEQD-UHFFFAOYSA-N 264.245 -0.616 5 10 CBBE Nc1ccc(C(=O)N2CC[C@H]2[C@H](O)CO)c([N+](=O)[O-])c1 2286221639 BTEIXTZYJJLUQD-GXSJLCMTSA-N 281.268 -0.255 5 10 CBBE O=C(O)[C@@]1(n2ccc([N+](=O)[O-])n2)CCN[C@@H]2C[C@@H]21 2309975170 DYZCUSPOQUKUBF-NYNCVSEMSA-N 252.230 -0.047 5 10 CBBE Cn1[nH]c(=NCC(=O)N2CCCC2)nc1[N+](=O)[O-] 2321752148 JCDAAZQOQDPHFS-UHFFFAOYSA-N 254.250 -0.821 5 10 CBBE Cn1[nH]c(=Nc2cnc(CN)nc2)nc1[N+](=O)[O-] 2321754329 BKYLJJTWGALPRV-UHFFFAOYSA-N 250.222 -0.863 5 10 CBBE O=C(O)[C@]1(N2CC([N+](=O)[O-])C2)CCNCC1(F)F 2326347364 SVCIFUYUIKKRRO-MRVPVSSYSA-N 265.216 -0.601 5 10 CBBE CO[C@H]1CNC[C@@](C(=O)O)(n2cnc([N+](=O)[O-])c2)C1 2344507159 GMLVPHWNRLTYPQ-XCBNKYQSSA-N 270.245 -0.421 5 10 CBBE Cn1nc(O[C@H]2CCCOC23CNC3)nc1[N+](=O)[O-] 2345006507 NSSPMHJKWOCWTM-ZETCQYMHSA-N 269.261 -0.377 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O 2354486188 VKZCZOIWOXCTJN-SCFXILDESA-N 281.268 -0.501 5 10 CBBE NCc1ccc([N+](=O)[O-])c(OCC(=O)NC(N)=O)c1 50516552 CLVMIAJDTTWFBN-UHFFFAOYSA-N 268.229 -0.373 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1C(=O)NCCC(N)=O 51128692 MUDBSMFOEROMGX-UHFFFAOYSA-N 267.245 -0.514 5 10 CBBE C[C@@](O)(CO)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 90283979 JLXWPEZPXLZLSZ-LBPRGKRZSA-N 268.269 -0.003 5 10 CBBE NC(=O)[C@@H]1CNCCN1c1nc2c([N+](=O)[O-])cccc2o1 94357287 UCDADWIJRXIORI-QMMMGPOBSA-N 291.267 -0.001 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CCCOC2)c1 109546705 LQGWBGJYDBSGSU-MWLCHTKSSA-N 270.289 -0.079 5 10 CBBE CCNc1ncnc(NCCOCC(N)=O)c1[N+](=O)[O-] 230106395 MHGLSROWVVDSJH-UHFFFAOYSA-N 284.276 -0.270 5 10 CBBE CN(C)C[C@@H]1C[C@@H](O)CN1c1nc(N)ncc1[N+](=O)[O-] 234267173 BMNXAZSTCGNMGY-JGVFFNPUSA-N 282.304 -0.532 5 10 CBBE C[C@H](NC(CO)(CO)CO)c1ccc([N+](=O)[O-])cc1 235507381 ZWYOZTWKDZDTLD-VIFPVBQESA-N 270.285 -0.039 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@](O)(CO)C1 313631670 HAGIEXUPQGBJRS-NSHDSACASA-N 270.289 -0.471 5 10 CBBE CNc1ncc([N+](=O)[O-])c(N2CCC[C@](O)(CO)C2)n1 313816133 SAZKNKYRUNALHM-LLVKDONJSA-N 283.288 -0.250 5 10 CBBE N[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)C(=O)O 322966726 VYQPVXVAZJUEQU-QMMMGPOBSA-N 271.204 -0.124 5 10 CBBE Cc1nn(CC(=O)N[C@@H]2COC[C@H]2O)c(C)c1[N+](=O)[O-] 322993986 PYUZUOFLHTXPEL-RKDXNWHRSA-N 284.272 -0.716 5 10 CBBE COC1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 358215460 UUVOFMHSJFXHJC-UHFFFAOYSA-N 252.230 -0.076 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H]2CCC[C@H]2O)c1 572121330 PXTCBVFGPCKQMO-ZMLRMANQSA-N 284.316 -0.097 5 10 CBBE CN1C[C@@H]2CCN(C[C@H](O)Cn3cc([N+](=O)[O-])cn3)[C@@H]2C1 590010464 IUZBDAOGKHMKIG-WCFLWFBJSA-N 295.343 -0.212 5 10 CBBE C[C@H]1C(=O)N(C)CN1CCn1cc([N+](=O)[O-])cn1 592189138 FULSXGGTJANDLZ-QMMMGPOBSA-N 253.262 -0.089 5 10 CBBE CN1CC[C@H](NS(=O)(=O)c2nn(C)cc2[N+](=O)[O-])C1 599218257 OJZCCKATQLTVRM-ZETCQYMHSA-N 289.317 -0.689 5 10 CBBE NC(=O)[C@H]1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 600316989 KBHLZJZUZFZHNG-ZKCHVHJHSA-N 281.272 -0.439 5 10 CBBE CNc1ncnc(NC[C@H](O)[C@H](C)O)c1[N+](=O)[O-] 717339348 PQMLILBWVFAURT-WDSKDSINSA-N 257.250 -0.420 5 10 CBBE C[C@H](O)[C@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])nc1 717395411 VUPASJSLQTUGLX-POYBYMJQSA-N 291.285 -0.990 5 10 CBBE Cc1nc(NN)nc(NCC2(CO)COC2)c1[N+](=O)[O-] 717686107 KCKIVLUZSSNXHA-UHFFFAOYSA-N 284.276 -0.600 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@H]1COCCO1 729101042 JMNKCIUTCSOTKO-MRVPVSSYSA-N 271.229 -0.250 5 10 CBBE C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCS1(=O)=O 870740463 FUGGBDHAFGNFMS-BWZBUEFSSA-N 262.287 -0.703 5 10 CBBE Cc1cc(C(=O)N2C[C@@H](O)[C@H](CO)C2)c(N)c([N+](=O)[O-])c1 1161337361 ZZOVBCQLEKGUPF-GZMMTYOYSA-N 295.295 -0.089 5 10 CBBE NC(=O)c1ccc(N2CCN(CC[N+](=O)[O-])CC2)nc1 1167755301 KOBNIRNOGKKHKZ-UHFFFAOYSA-N 279.300 -0.421 5 10 CBBE Nc1ccc(C(=O)N2CC[C@@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 1171676013 WZUOAPNNQIPKOM-MNOVXSKESA-N 281.268 -0.255 5 10 CBBE CS(=O)(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1462632999 UUGUOLPFBAEBOK-DJLDLDEBSA-N 291.329 -0.951 5 10 CBBE CN(C)C[C@]1(O)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1471373203 JFOSFRDBSQPROA-LLVKDONJSA-N 283.288 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O=C(CNCCO)Nc1c(O)cccc1[N+](=O)[O-] 2049618838 PZEYLCFALYNJKY-UHFFFAOYSA-N 255.230 -0.179 5 10 CBBE NC[C@@H]1C[C@@H]1NS(=O)(=O)c1cncc([N+](=O)[O-])c1 2058868686 AFGPSPFPYBYGMF-RCOVLWMOSA-N 272.286 -0.385 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NCC(CO)CO)[nH]1 2059279355 FXFDKVIYJXRDPQ-UHFFFAOYSA-N 256.262 -0.534 5 10 CBBE O=[N+]([O-])c1cccc(N2C[C@H](O)[C@H](O)[C@@H]2CO)c1 2080588036 OTXWLXQOKAVNTM-GARJFASQSA-N 254.242 -0.503 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1[C@H]2CCNC[C@H]21 2083266894 LVZKQDCSFUEBHC-XLPZGREQSA-N 252.278 -0.587 5 10 CBBE Cc1c([N+](=O)[O-])c(OC[C@@H](N)CN(C)C)nn1C 2086317661 XQEQKZCFUVDDRM-QMMMGPOBSA-N 257.294 -0.096 5 10 CBBE Nc1nc[nH]c(=NC[C@H]2CCCC(=O)N2)c1[N+](=O)[O-] 2089286925 SKJXUBWSGJJAQS-ZCFIWIBFSA-N 266.261 -0.531 5 10 CBBE CC[C@H](CS(C)(=O)=O)N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2090094043 ITNUKXSWRRCNFZ-ZCFIWIBFSA-N 289.317 -0.546 5 10 CBBE Cn1cnc(CCNCc2nn(C)cc2[N+](=O)[O-])n1 2102862600 BMBPKHBJONMLJU-UHFFFAOYSA-N 265.277 -0.211 5 10 CBBE CN(C)C1(C)CN(c2ncnc(NN)c2[N+](=O)[O-])C1 2104375391 VLBYONDSOYWMOY-UHFFFAOYSA-N 267.293 -0.189 5 10 CBBE O=C(O)c1ccc([N+](=O)[O-])c(NCC2(O)CNC2)n1 2105948361 QVOFMWIPTMAHMT-UHFFFAOYSA-N 268.229 -0.566 5 10 CBBE O=[N+]([O-])c1cc(Cl)cnc1N[C@@H]1C[C@H](O)[C@H](O)[C@H]1O 2108827279 CDPBOJCQMUQVSC-WOPDXLMNSA-N 289.675 -0.090 5 10 CBBE CN=c1nc(N2CC[C@@H]3C[C@]3(O)C2)c([N+](=O)[O-])c[nH]1 2114551986 AHVSBTKCMZXOAI-HQJQHLMTSA-N 265.273 -0.191 5 10 CBBE CCn1ncc(CN=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])n1 2115774577 TWXFDVRUOKJOIZ-UHFFFAOYSA-N 264.249 -0.557 5 10 CBBE CO[C@H]1CN[C@H](CN=c2[nH]c(F)ncc2[N+](=O)[O-])C1 2115963767 FRMAAPAIUDQYJW-NKWVEPMBSA-N 271.252 -0.265 5 10 CBBE Cc1[nH]c(=N)nc(NC2(CCO)CNC2)c1[N+](=O)[O-] 2117255482 QLLZRHPUYDZHAT-UHFFFAOYSA-N 268.277 -0.758 5 10 CBBE Cc1nc([N+](=O)[O-])c(O[C@@H]2CNC[C@H]2N(C)C)n1C 2119764916 DHOFIHMWTRIDEX-RKDXNWHRSA-N 269.305 -0.082 5 10 CBBE CN=c1nc(N2CC[C@@H]3[C@H](O)C[C@H]32)c([N+](=O)[O-])c[nH]1 2121687663 SLYZICFGCFQPGV-LKEWCRSYSA-N 265.273 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2206948792 ZPVVKNPDYRQEOY-UHFFFAOYSA-N 284.272 -0.019 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2CCOC[C@H]2C(=O)O)[nH]n1C 2207488837 NBDJXOASXSYCHN-HTQZYQBOSA-N 284.272 -0.040 5 10 CBBE O=[N+]([O-])c1cncnc1N1CCOC[C@@H](CO)C1 2219801542 CXEMBSHMOAQDAS-MRVPVSSYSA-N 254.246 -0.170 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H](F)C[C@@H](O)C1 2226283946 OXPJDFVGAGPJPL-NKWVEPMBSA-N 272.236 -0.127 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N[C@H]1CCO[C@H]1C(N)=O 2231920998 QQHRCNQNSVYTHE-POYBYMJQSA-N 269.261 -0.134 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NCC2(C(N)=O)CC2)[nH]1 2258622101 QKAVHXJNMNSNIG-UHFFFAOYSA-N 251.246 -0.207 5 10 CBBE CO[C@@H](CO)CNC(=O)c1ccc([N+](=O)[O-])cn1 2263656258 AYVPZRHNZJPUER-MRVPVSSYSA-N 255.230 -0.273 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NC[C@@H](O)[C@@H](C)O)[nH]1 2271092267 VSUBLWQQOHXMSU-HTRCEHHLSA-N 272.261 -0.893 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N(CCO)CCCO 2278156342 YPGZFSZPEKJBCM-UHFFFAOYSA-N 269.257 -0.193 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2CC(O)(C(F)(F)CO)C2)[nH]1 2288521289 YMNJHQYYZDWREG-UHFFFAOYSA-N 290.226 -0.419 5 10 CBBE O=C(N[C@@H]1CO[C@H]2CNC[C@H]12)c1ccc([N+](=O)[O-])cn1 2295655352 RAHYIKQOEZNZQJ-IEBDPFPHSA-N 278.268 -0.294 5 10 CBBE O=C(NC1CC(O)(C(=O)O)C1)c1ccc([N+](=O)[O-])cn1 2295657558 UMEJAFLLOBGQEU-UHFFFAOYSA-N 281.224 -0.302 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=N[C@@H]3COC[C@@H]3CO)[nH]c12 2295877716 KMTCUWCTMVHIHB-JGVFFNPUSA-N 279.256 -0.521 5 10 CBBE O=[N+]([O-])c1cccnc1NC[C@H]1NC[C@@H](O)[C@H]1O 2312325739 GOZYJJKJKDDRPF-VDAHYXPESA-N 254.246 -0.905 5 10 CBBE C[C@H]1OCC[C@@]1(CN)Oc1nc([N+](=O)[O-])n(C)n1 2321706002 ZBIMMIOLEJGYCL-MUWHJKNJSA-N 257.250 -0.392 5 10 CBBE Cn1[nH]c(=NCCO[C@@H]2CCOC2)nc1[N+](=O)[O-] 2321707444 LOKFAOKANXNBAX-SSDOTTSWSA-N 257.250 -0.637 5 10 CBBE Cn1[nH]c(=NC[C@H]2CC(F)(F)CO2)nc1[N+](=O)[O-] 2321708597 XQPPCBRCHIZOGO-RXMQYKEDSA-N 263.204 -0.019 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@@H](N)C23CCC3)nc1[N+](=O)[O-] 2321741060 JJWMVGLHROIDIV-RNFRBKRXSA-N 252.278 -0.173 5 10 CBBE Cn1[nH]c(=NC[C@@H]2CCCNCC2)nc1[N+](=O)[O-] 2321760482 GXFGNMKFOCTJCC-MRVPVSSYSA-N 254.294 -0.053 5 10 CBBE CS(=O)(=O)C[C@H](Nc1cc([N+](=O)[O-])ccn1)C(=O)O 2335451619 WQQGRFPKHHDEBE-ZETCQYMHSA-N 289.269 -0.101 5 10 CBBE CCn1cc(CCN=c2nc([N+](=O)[O-])n(C)[nH]2)nn1 2344953053 QMMKHDLCRIEAJF-UHFFFAOYSA-N 266.265 -0.589 5 10 CBBE Cn1nc(N2CCO[C@H](CC(=O)O)C2)nc1[N+](=O)[O-] 2345023879 MUPVWKMWYVPBBG-ZCFIWIBFSA-N 271.233 -0.597 5 10 CBBE C[C@@H](O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 20214115 BOBSFPYZWPVYOW-CLZZGJSISA-N 257.202 -0.513 5 10 CBBE COCC[C@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)C(=O)O 52786113 AJOWOWRISQSAQG-QMMMGPOBSA-N 298.255 -0.010 5 10 CBBE C[C@@H](O)[C@@H](N)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 80748774 DFIHIVCJFUQZPR-XCBNKYQSSA-N 289.313 -0.419 5 10 CBBE CNS(=O)(=O)c1cc([N+](=O)[O-])c(NN)s1 87798118 GTOJRIZFZXJQGZ-UHFFFAOYSA-N 252.277 -0.150 5 10 CBBE NNc1cccc(N(CCO)CCO)c1[N+](=O)[O-] 87863950 OVTYXJVCHFRDOZ-UHFFFAOYSA-N 256.262 -0.329 5 10 CBBE O=[N+]([O-])c1cnc2ccc(NC[C@H](O)CO)nn12 133482960 XUZRWESMHISDIQ-LURJTMIESA-N 253.218 -0.597 5 10 CBBE CN1CCO[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21 155103257 RNCXWMFBRAFJHO-IUCAKERBSA-N 281.272 -0.527 5 10 CBBE COC[C@@H](O)CN(C)C(=O)c1cccc(NN)c1[N+](=O)[O-] 157127590 BSWIKVHVHSDZAP-QMMMGPOBSA-N 298.299 -0.040 5 10 CBBE CCNC(=O)[C@@H]1CNCCN1c1nn(C)cc1[N+](=O)[O-] 231672153 IWQKZEOMVKTKLA-QMMMGPOBSA-N 282.304 -0.757 5 10 CBBE CCNc1cc([N+](=O)[O-])cc(N2C[C@H](O)[C@H](O)C2)n1 233660246 FRALECUSTXSTEJ-DTORHVGOSA-N 268.273 -0.037 5 10 CBBE Cc1nc(N)nc(N2CCNC(=O)C2(C)C)c1[N+](=O)[O-] 235975337 CHSZQHMGYAZFSP-UHFFFAOYSA-N 280.288 -0.010 5 10 CBBE NNc1ncnc(NC2COCCOC2)c1[N+](=O)[O-] 311876234 MKXNEJBCONBLBF-UHFFFAOYSA-N 270.249 -0.502 5 10 CBBE COc1ccc(NC(=O)[C@H](N)CC(N)=O)cc1[N+](=O)[O-] 312179500 UODTZSGFSMQVHU-SSDOTTSWSA-N 282.256 -0.255 5 10 CBBE Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1COC[C@H]1O 323533822 NWLTXXOKEXWOFP-HTQZYQBOSA-N 268.229 -0.939 5 10 CBBE CCN(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362321803 UEJLIFOXTJVRSE-UHFFFAOYSA-N 257.206 -0.881 5 10 CBBE C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)[C@H](C)CN1CCO 419007284 RICBERHOTZAWQF-DTWKUNHWSA-N 296.331 -0.142 5 10 CBBE CN1C[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1 590044108 GYCRAVMTCBZOMU-ONGXEEELSA-N 279.300 -0.046 5 10 CBBE CN1CC[C@H](NS(=O)(=O)c2ncccc2[N+](=O)[O-])C1 594751333 UDWNWIKWDNQLJQ-QMMMGPOBSA-N 286.313 -0.028 5 10 CBBE CCN(C[C@@H](C)O)c1ncnc(NN)c1[N+](=O)[O-] 692160771 SERSVOVDOHEVNY-ZCFIWIBFSA-N 256.266 -0.123 5 10 CBBE CN(CCOCCN)C(=O)CCn1cnc([N+](=O)[O-])c1 698940743 GQWAQJAGDSRCBO-UHFFFAOYSA-N 285.304 -0.385 5 10 CBBE CCNc1ncc([N+](=O)[O-])c(N[C@@H](C)[C@H](O)CO)n1 698949975 JXCDYCWDNQMYAX-POYBYMJQSA-N 271.277 -0.030 5 10 CBBE O=C(N[C@@H]1CNC[C@@H]1O)c1cc([N+](=O)[O-])cnc1Cl 699907026 YHQODFOAJCBXQR-SFYZADRCSA-N 286.675 -0.294 5 10 CBBE O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CNC[C@@H]1O 701102582 YIWALXMARVWICY-MNOVXSKESA-N 281.268 -0.578 5 10 CBBE 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CN=c1nc(N=[S@](C)(=O)CCN)c([N+](=O)[O-])c(C)[nH]1 2117287368 QUSBIKMNVVSZSK-LJQANCHMSA-N 288.333 -0.155 5 10 CBBE O=C(NCC(CO)CO)c1ccnc(Cl)c1[N+](=O)[O-] 2123161931 RXPPUKBQAPHNCW-UHFFFAOYSA-N 289.675 -0.026 5 10 CBBE O=[N+]([O-])c1cc(F)cnc1NCC(CO)(CO)CO 2123167044 RCNKLHVMJQHVFI-UHFFFAOYSA-N 275.236 -0.496 5 10 CBBE O=C(O)[C@@H]1C[C@H](Oc2nc(F)ncc2[N+](=O)[O-])CN1 2128202146 VRIQLDNQMGSJNY-WHFBIAKZSA-N 272.192 -0.282 5 10 CBBE CNc1nc[nH]c(=NC[C@H]2CNC(=O)O2)c1[N+](=O)[O-] 2129933327 JMOQSSJZTLWNBS-YFKPBYRVSA-N 268.233 -0.631 5 10 CBBE CO[C@@H]1CNC[C@@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 2129976855 GAXYQUULRLVHBA-POYBYMJQSA-N 269.261 -0.955 5 10 CBBE C[C@@H](O)CN(CCO)C(=O)c1nn(C)cc1[N+](=O)[O-] 2129990837 FGTUBKIUOHVLTA-SSDOTTSWSA-N 272.261 -0.856 5 10 CBBE C[C@H](C(=O)Nc1ncccc1[N+](=O)[O-])N1CC(N)C1 2137713994 CBLRBBZVBXGZMK-SSDOTTSWSA-N 265.273 -0.040 5 10 CBBE Cc1c([N+](=O)[O-])c(N2CCNC[C@H]2C(=O)O)nn1C 2142497748 YVGVPLIHKPIDEY-ZETCQYMHSA-N 269.261 -0.500 5 10 CBBE COC[C@H](Nc1ccc(C(N)=O)c([N+](=O)[O-])c1)C(N)=O 2152362470 ZFHBCLSKCXXIDU-QMMMGPOBSA-N 282.256 -0.394 5 10 CBBE Cn1c(=O)n(C)n(Cc2cccc([N+](=O)[O-])c2N)c1=O 2155867939 WVUCDGHRPSDTCA-UHFFFAOYSA-N 279.256 -0.576 5 10 CBBE CCOCCOCCN=c1[nH]cc([N+](=O)[O-])c(=NC)[nH]1 2157680739 SAMDWRTUPHDPRI-UHFFFAOYSA-N 285.304 -0.265 5 10 CBBE COC[C@@](O)(CO)CNC(=O)c1cc([N+](=O)[O-])cn1C 2158611730 QEZZOICOHVNCFA-NSHDSACASA-N 287.272 -0.967 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1C[C@H]2CNC[C@H]1C2 2161554590 BMRUPIILCXHIMK-IQJOONFLSA-N 279.300 -0.095 5 10 CBBE CO[C@H]1CN[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 2172485632 MMGRGWGRFWZTIT-WCBMZHEXSA-N 283.288 -0.716 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=N[C@H](CN)C(F)(F)F)[nH]1 2173906633 IMTWGYHZENFBAD-ZCFIWIBFSA-N 294.237 -0.038 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2C[C@H]3CN[C@H]2C3)[nH]1 2174007635 WQFVZOGKGQLYJW-XHNCKOQMSA-N 278.316 -0.259 5 10 CBBE CCNc1ncnc(N[C@H](C)C2(O)CNC2)c1[N+](=O)[O-] 2174046428 QXXXNYFHXCQFAK-SSDOTTSWSA-N 282.304 -0.049 5 10 CBBE Cc1cc(N[C@@H]2C[C@H](O)[C@H](O)[C@H]2O)nc(C)c1[N+](=O)[O-] 2174249455 SCWRTNAUHCWBDR-ULCXWNMLSA-N 283.284 -0.126 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N[C@@H]2[C@H]3CS(=O)(=O)C[C@H]32)[nH]1 2174643525 UJXTXVOUYFWMLO-MTBHXBHISA-N 298.324 -0.092 5 10 CBBE COc1ncnc(NCC2(CCO)CNC2)c1[N+](=O)[O-] 2175828142 JPQQYQFUMPEWGM-UHFFFAOYSA-N 283.288 -0.223 5 10 CBBE Nc1ncnc(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@@H]3O)c1[N+](=O)[O-] 2182540552 JODBNBCLKHOFLM-HSLWUYEYSA-N 281.272 -0.855 5 10 CBBE O=C1NC(=O)[C@H]2CN(c3cc([N+](=O)[O-])cc(F)n3)C[C@@H]12 2183218165 HTFKGPCRWBIBSL-KNVOCYPGSA-N 280.215 -0.162 5 10 CBBE Nc1ccnc(O[C@@H]2C[C@@H]3CNCCN3C2)c1[N+](=O)[O-] 2184673600 PJJAPUKWOLFZBF-RKDXNWHRSA-N 279.300 -0.003 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC1(CO)CC(O)C1 2194001508 YXXBOGAVVFFMRE-UHFFFAOYSA-N 284.272 -0.817 5 10 CBBE N=c1[nH]c(OC[C@@H](N)C[C@@H]2CCOC2)ncc1[N+](=O)[O-] 2195458969 UUJUMBDHLHQCAB-YUMQZZPRSA-N 283.288 -0.070 5 10 CBBE C[C@H]1OCC[C@]1(O)CN=c1[nH]cncc1[N+](=O)[O-] 2219808180 JRXKNWJMOTWPPF-XCBNKYQSSA-N 254.246 -0.242 5 10 CBBE O=[N+]([O-])c1ccc(Cl)nc1NC[C@@H]1NC[C@@H](O)[C@H]1O 2225661391 SWFCKRKVOFBFGQ-KWPFTWCOSA-N 288.691 -0.251 5 10 CBBE CN=c1[nH]c(N2C[C@@H](F)C[C@@H](O)C2)ncc1[N+](=O)[O-] 2226295139 MGKLYIWSJCRDSP-NKWVEPMBSA-N 271.252 -0.243 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CCN(CCN)CC2)n1 2230798081 UENNVIXWTYOESO-UHFFFAOYSA-N 268.321 -0.108 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@]2(C)CCNC2)n1 2231917792 LKGQKRPDOGUIBK-NSHDSACASA-N 267.289 -0.056 5 10 CBBE O=[N+]([O-])c1nccn1C[C@H]1COCC2(CNC2)O1 2253639541 HNRSGHMLKIGJDN-QMMMGPOBSA-N 254.246 -0.451 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCC2(N)CC2)[nH]1 2258633023 LGDLHVBCYANZCB-UHFFFAOYSA-N 253.262 -0.144 5 10 CBBE N=c1ccc([N+](=O)[O-])c(NC2CNCCNC2)[nH]1 2259428205 QBOIUZHUJCTGSW-UHFFFAOYSA-N 252.278 -0.624 5 10 CBBE N=c1cc(C(=O)N2CC[C@@]3(O)C[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2279960933 IKFUYJWJZIYJBV-JMCQJSRRSA-N 278.268 -0.001 5 10 CBBE COc1cc([N+](=O)[O-])c(C(=O)NOC2CNC2)cc1O 2283634204 AVAOIPDRPOQSHO-UHFFFAOYSA-N 283.240 -0.058 5 10 CBBE O=[N+]([O-])c1cnc(C2CC2)[nH]c1=N[C@@H]1C[C@H](O)C[C@@H]1O 2286644245 JTKBTQRBBUAPAJ-XKSSXDPKSA-N 280.284 -0.020 5 10 CBBE Cc1cnc(N2C[C@H](O)[C@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 2289493838 IBBSXKWCTNZAOS-DVVUODLYSA-N 283.284 -0.551 5 10 CBBE O=[N+]([O-])c1ccc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)nc1 2308774220 SYKNHLGINWNDTG-QRPIXLCVSA-N 251.242 -0.080 5 10 CBBE COC(=O)[C@@H](C)CN(C)c1nc([N+](=O)[O-])n(C)n1 2321733438 UPMFVAPWVJSYBA-LURJTMIESA-N 257.250 -0.031 5 10 CBBE Cn1[nH]c(=NCCOCCC(=O)O)nc1[N+](=O)[O-] 2321757263 QRYAEVSKESSSOQ-UHFFFAOYSA-N 259.222 -0.952 5 10 CBBE Cn1[nH]c(=N[C@H]2CCNCC23CC3)nc1[N+](=O)[O-] 2321759036 NFLRINNWGVRYKN-ZETCQYMHSA-N 252.278 -0.301 5 10 CBBE COC1CN(CCN=c2[nH]cnc(N)c2[N+](=O)[O-])C1 2340018267 XQGWRIHMHWYTCD-UHFFFAOYSA-N 268.277 -0.869 5 10 CBBE O=C(O)C(CO)(CO)Nc1cc(F)cc([N+](=O)[O-])c1 2344092416 ZXKYRJGYTHLXBG-UHFFFAOYSA-N 274.204 -0.046 5 10 CBBE Cn1nc([C@]2(C(=O)O)C[C@H]3CC[C@H]2O3)nc1[N+](=O)[O-] 2344954675 IEONCZOYSWTDCL-DGAHNEANSA-N 268.229 -0.003 5 10 CBBE C[C@]12CNC[C@H]1C[C@@](C(=O)O)(N1CC([N+](=O)[O-])C1)C2 2350095993 IJKBTHLNLXNLFY-JFUSQASVSA-N 269.301 -0.210 5 10 CBBE CCCn1cc([N+](=O)[O-])c(=O)n(C[C@H](C)CN)c1=O 70527787 HOSHMRDNMJCRLA-MRVPVSSYSA-N 270.289 -0.077 5 10 CBBE Cc1ccc(C(=O)N2CCNC[C@H]2C(N)=O)cc1[N+](=O)[O-] 88662475 YWNWWKRDDLGNHW-NSHDSACASA-N 292.295 -0.197 5 10 CBBE O=C(NC[C@H](O)CO)c1ccc(F)c([N+](=O)[O-])c1 90280127 WGOFAPAQJMLYDV-ZETCQYMHSA-N 258.205 -0.183 5 10 CBBE CCn1cc(Cn2cc([N+](=O)[O-])c(=O)[nH]c2=O)cn1 104300487 XULSCLNIUODANK-UHFFFAOYSA-N 265.229 -0.291 5 10 CBBE NCC(=O)NCc1cn(-c2ccccc2[N+](=O)[O-])nn1 163384145 ISDFUDFPUJGIDQ-UHFFFAOYSA-N 276.256 -0.250 5 10 CBBE COc1ncnc(N2C[C@H](CO)OC[C@@H]2C)c1[N+](=O)[O-] 167777563 IRBCKPUEKQGCPC-JGVFFNPUSA-N 284.272 -0.021 5 10 CBBE CCCNc1ncnc(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 228816784 VNLGJWYMSYRZRS-ZCFIWIBFSA-N 284.276 -0.535 5 10 CBBE Nc1cc(C(=O)N[C@H]2CNC(=O)C2)c([N+](=O)[O-])cc1F 229365634 BJQJNWNEOMLTKQ-RXMQYKEDSA-N 282.231 -0.066 5 10 CBBE Nc1cc(NCCS(N)(=O)=O)ccc1[N+](=O)[O-] 236342703 JQOUZIMMNSGZEH-UHFFFAOYSA-N 260.275 -0.123 5 10 CBBE NC(=O)[C@H](N)C[S@@](=O)c1cccc([N+](=O)[O-])c1 313466994 BESUSLAEGHGTMF-CQLKUDPESA-N 257.271 -0.485 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NCCN=c1cc[nH]cc1 347978790 OEDMCTWGAOAKJH-UHFFFAOYSA-N 290.283 -0.013 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H]2CNC[C@H]21 368377665 NIBDVCQNLWDGGT-DTWKUNHWSA-N 265.273 -0.388 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@@H](C(=O)O)c2ccnn2C)[nH]1 402695135 ZUWBCFGIEBFWJN-MRVPVSSYSA-N 280.244 -0.279 5 10 CBBE CN1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cn2)C1 593534449 AAWYYNZZJNBVNQ-MRVPVSSYSA-N 286.313 -0.028 5 10 CBBE C[C@@]1(CO)C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])c[nH]1 698130982 VLJNOKHRVSVJDH-KCJUWKMLSA-N 269.257 -0.119 5 10 CBBE COC[C@@H](ONC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)O 709543988 SQBNYCZDNQOMQS-SSDOTTSWSA-N 287.228 -0.306 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCNC[C@H]1O 710441588 GSICJGJDASAJGN-GXSJLCMTSA-N 282.300 -0.131 5 10 CBBE C[C@H]1CNC[C@@H]1NC(=O)CCn1cnc([N+](=O)[O-])c1 721976902 BCWSJBLLPJJIQA-IUCAKERBSA-N 267.289 -0.095 5 10 CBBE C[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 861326045 CREAJWVKPNNTHB-PHDIDXHHSA-N 288.285 -0.211 5 10 CBBE COc1ncc(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 863447192 NFCOMDQHZRSART-RKDXNWHRSA-N 266.257 -0.191 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NCC(=O)N2CCCO2)n1 1261827415 YBQCOMPFLDVPMD-UHFFFAOYSA-N 283.244 -0.778 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2COC[C@H]2O)n1 1297982540 YUBSZTOXEXNNTL-NXEZZACHSA-N 267.241 -0.212 5 10 CBBE NC(=O)[C@H](F)C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1301876042 HMKAOYHDEBSZKE-SECBINFHSA-N 299.262 -0.007 5 10 CBBE CCCNC(=O)CNC(=O)c1nn(C)cc1[N+](=O)[O-] 1319892852 NUIWJZXZJPKZJF-UHFFFAOYSA-N 269.261 -0.416 5 10 CBBE O=[N+]([O-])CCN1CCN(C[C@H]2CCCS2(=O)=O)CC1 1333221106 PSVWVUKRIFRCAF-LLVKDONJSA-N 291.373 -0.542 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H](O)C[C@H]1CO 1342931792 KTIMYOKFIFAGDO-IUCAKERBSA-N 267.241 -0.443 5 10 CBBE C[C@H](CS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1537955989 OQOPEGWACFIUKK-FSDSQADBSA-N 250.276 -0.799 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)CC(N)=O)n1 1543526435 LOBCCIBNVPCTFS-ZCFIWIBFSA-N 269.261 -0.195 5 10 CBBE Cn1[nH]cnc1=NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1566667998 WUHDJCBGOGSMCL-VIFPVBQESA-N 277.240 -0.183 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N1C[C@H](O)C[C@]1(C)CO 1585125674 PSZDHNMYZBFKLF-BXKDBHETSA-N 298.299 -0.556 5 10 CBBE CC(=O)N1CCN(CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1688553986 ITSZDMRFISVXEW-VXGBXAGGSA-N 298.343 -0.726 5 10 CBBE CN=c1[nH]c(N2C[C@@H]3C[C@H]3[C@H]2CN)ncc1[N+](=O)[O-] 1905379301 ZONAHKGMNLWFSW-XLPZGREQSA-N 264.289 -0.368 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H](CO)C[C@@H]2CCCO2)[nH]1 1926692743 DDQMMLYMASQRDN-SFYZADRCSA-N 283.288 -0.439 5 10 CBBE Cn1ncc([N+](=O)[O-])c1[C@@H]1CC(=O)NC(=O)[C@H]1C(=O)O 1952155307 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Cc1c(N2CC(N)(C(N)=O)C2)cccc1[N+](=O)[O-] 2047095701 QFNCZJTVHKSSKR-UHFFFAOYSA-N 250.258 -0.094 5 10 CBBE NNc1ncnc(N2CCC23COC3)c1[N+](=O)[O-] 2051857797 CIROTZZUDMXMLR-UHFFFAOYSA-N 252.234 -0.351 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2C[C@@H]2CN)[nH]1 2053954524 ZKEPBOHSWABDBN-RNFRBKRXSA-N 252.278 -0.723 5 10 CBBE CCNc1ncnc(N[C@@H](CN)CO)c1[N+](=O)[O-] 2062354417 PPQSTNMJYANABE-LURJTMIESA-N 256.266 -0.452 5 10 CBBE CN(C)C[C@H](N)COc1nc(F)ncc1[N+](=O)[O-] 2064966945 ZWNCZEPPCKHDNB-LURJTMIESA-N 259.241 -0.208 5 10 CBBE O=[N+]([O-])c1cnc(NC[C@@]2(O)CCCNC2)nc1 2081461234 YYXMKNRCVJFNLM-SNVBAGLBSA-N 253.262 -0.089 5 10 CBBE COc1nc(=NC[C@H]2CC[C@H]2O)[nH]cc1[N+](=O)[O-] 2084666183 XILGLPHQGDDUDX-HTRCEHHLSA-N 254.246 -0.002 5 10 CBBE CO[C@](C)(CO)CN=c1[nH]n(C)c(C)c1[N+](=O)[O-] 2086324209 IQVNOIWWLFSREK-JTQLQIEISA-N 258.278 -0.132 5 10 CBBE CONCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 2089099142 LDBZVIOWWMTCDP-UHFFFAOYSA-N 290.301 -0.195 5 10 CBBE NNc1ncnc(NC[C@@H]2CCS2(=O)=O)c1[N+](=O)[O-] 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CONC(=O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 1179623365 KGYBCDMOWVHZIX-UHFFFAOYSA-N 282.256 -0.107 5 10 CBBE CN1C(=O)[C@@H]2CN(c3c([N+](=O)[O-])ncn3C)C[C@@H]2C1=O 1187340844 LQOPXHZRHBQRPM-KNVOCYPGSA-N 279.256 -0.621 5 10 CBBE CO[C@@H]1COCC[C@H]1N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 1462486601 MUKZOUNVZMPKKU-RKDXNWHRSA-N 299.287 -0.551 5 10 CBBE O=C(c1[nH]nc([N+](=O)[O-])c1Cl)N1CC(CO)(CO)C1 1471784077 QXEMXPAZOQPDPI-UHFFFAOYSA-N 290.663 -0.602 5 10 CBBE C[N+](C)(C)CCOC(=O)C1CN(S(C)(=O)=O)C1 1849766814 DQFFFKOYYPQCJB-UHFFFAOYSA-N 265.355 -0.873 5 10 CBBE N[C@@H](CCC(=O)Nc1ncc([N+](=O)[O-])s1)C(O)O 1865959593 YNLXLVVSRMCJDK-BYPYZUCNSA-N 276.274 -0.592 5 10 CBBE C[C@@]1(O)CCN(c2ncnc(N)c2[N+](=O)[O-])C[C@H]1O 1893301869 SRAMXUBZEZIQSG-LHLIQPBNSA-N 269.261 -0.711 5 10 CBBE O=C(Cc1ccccc1[N+](=O)[O-])NC1(CO)CNC1 1918424146 LALGNKCZFHJQQH-UHFFFAOYSA-N 265.269 -0.412 5 10 CBBE Cn1c(O)nnc1CN=c1cccc([N+](=O)[O-])[nH]1 1925571919 XAXDRQDTCCNKBF-UHFFFAOYSA-N 250.218 -0.142 5 10 CBBE CC(=O)N1CC(N=c2cc([N+](=O)[O-])cc(NN)[nH]2)C1 1926323383 LHSKKJSIRXKJQT-UHFFFAOYSA-N 266.261 -0.660 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N=[S@@]1(=O)CC[C@@H](N)C1 1997014368 ROYRAEWMLSHXBR-WXQGDBPDSA-N 260.279 -0.446 5 10 CBBE CC1(C)C[C@H](S(=O)(=O)N2CC([N+](=O)[O-])C2)CN1 2016888871 JEHLMGBDXLBXGG-QMMMGPOBSA-N 263.319 -0.582 5 10 CBBE C[C@@H](CS(N)(=O)=O)NC(=O)c1ccc([N+](=O)[O-])o1 2035446751 CUBZRMLXNKFSBV-YFKPBYRVSA-N 277.258 -0.405 5 10 CBBE CC1(C)C[C@](C(=O)O)(n2cnc([N+](=O)[O-])n2)CN1 2037703276 IZZUQQDQDCISIO-VIFPVBQESA-N 255.234 -0.262 5 10 CBBE N=c1[nH]c(N[C@@H]2COC[C@@H]2CO)ncc1[N+](=O)[O-] 2039900789 YFUBFACTHRDJGD-NTSWFWBYSA-N 255.234 -0.783 5 10 CBBE CN=c1[nH]c(=NC[C@H]2CCOC2)[nH]cc1[N+](=O)[O-] 2039925156 UYMCRBIYDZDLOB-SSDOTTSWSA-N 253.262 -0.281 5 10 CBBE Cn1cc([N+](=O)[O-])c(C[S@@](=O)CCNCCN)n1 2041186003 XMWITJYLBHAXNB-SFHVURJKSA-N 275.334 -0.875 5 10 CBBE Nc1ccnc(N2CCOC[C@H](N)C2)c1[N+](=O)[O-] 2053534764 HITAVIRVMMBMQQ-SSDOTTSWSA-N 253.262 -0.264 5 10 CBBE CC1(C)CN[C@@H]1CN=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2053596335 YWQSQCUUYYJYPD-SSDOTTSWSA-N 252.278 -0.371 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2CCNC2)[nH]1 2053679725 FDIFPVXTHJDSIS-SSDOTTSWSA-N 252.278 -0.708 5 10 CBBE O=C(O)[C@H]1CNCCN1c1cncc([N+](=O)[O-])c1 2062694781 UYSFENHFEIUDGK-SECBINFHSA-N 252.230 -0.147 5 10 CBBE Cc1cc(=NCC[C@@H](O)C(=O)O)[nH]cc1[N+](=O)[O-] 2064343642 RURLQDRRVRERTM-MRVPVSSYSA-N 255.230 -0.032 5 10 CBBE CN(C[C@@]1(O)CCOC1)c1nc([N+](=O)[O-])nn1C 2066021416 QWDNTAYJGZKTLL-VIFPVBQESA-N 257.250 -0.689 5 10 CBBE CN(C(=O)N1CC([N+](=O)[O-])C1)C1CC(C(=O)O)C1 2071558115 IIBWJMPIQGHGTH-UHFFFAOYSA-N 257.246 -0.138 5 10 CBBE O=C(O)[C@@H](NC(=O)N1CC([N+](=O)[O-])C1)C1CCC1 2071563407 INLQUQDJUGZNFZ-QMMMGPOBSA-N 257.246 -0.090 5 10 CBBE O=[N+]([O-])c1ncccc1N1C[C@H](O)[C@H](O)[C@@H]1CF 2084788591 VGPCVDWFCFCQNO-XHNCKOQMSA-N 257.221 -0.130 5 10 CBBE NC(=O)C(NCc1cc([N+](=O)[O-])ccc1F)C(N)=O 2093958358 PAWOTTKJTBBNSY-UHFFFAOYSA-N 270.220 -0.837 5 10 CBBE C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CCNC1 2098554042 DGVQKCGBMYZAQH-BDAKNGLRSA-N 267.289 -0.095 5 10 CBBE CN(C)c1nc(N[C@@H]2CONC2=O)ncc1[N+](=O)[O-] 2101466430 CFVIZPGTGSFLBE-RXMQYKEDSA-N 268.233 -0.707 5 10 CBBE O=C(O)[C@H]1C[C@@H](Oc2ccnc(O)c2[N+](=O)[O-])CN1 2110867273 DGKBXPZWGDLEOJ-PHDIDXHHSA-N 269.213 -0.111 5 10 CBBE Cc1nc(Cl)[nH]c(=N[C@@H]2CCNC[C@H]2O)c1[N+](=O)[O-] 2116276285 ZXKNJCQKHOUVJG-RNFRBKRXSA-N 287.707 -0.097 5 10 CBBE CO[C@H]1CN[C@@H](CN=c2cc(N)c([N+](=O)[O-])c[nH]2)C1 2117170649 JGPZDYGJRRTCEK-HTQZYQBOSA-N 267.289 -0.217 5 10 CBBE CN=c1[nH]c(N=[S@@]2(=O)CC[C@H](N)C2)ncc1[N+](=O)[O-] 2117182439 GQJRKLBIPQMUEF-INMOSUBGSA-N 286.317 -0.321 5 10 CBBE Cc1cc(=O)n(CC(=O)NCCO)c(C)c1[N+](=O)[O-] 2117621144 KEZGCXUZTQIOJM-UHFFFAOYSA-N 269.257 -0.518 5 10 CBBE N=c1[nH]c(N2CCC[C@H]2[C@@H](O)CO)ncc1[N+](=O)[O-] 2123222131 FMUNFGWKHSRNAS-XPUUQOCRSA-N 269.261 -0.881 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCNCC23CC3)[nH]1 2129388346 ACFJAPLOBNXMJB-MRVPVSSYSA-N 264.289 -0.227 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCNC[C@@H]2F)n1 2129979852 QFDZLRYVJMIWMT-BQBZGAKWSA-N 271.252 -0.242 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@H]3CNC[C@H]2C3)c1[N+](=O)[O-] 2131207094 JLUHMBKRGUEPAN-HTQZYQBOSA-N 264.289 -0.096 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCN[C@@H]3C2)n1 2132371839 BQCJCATUJFEYFU-JGVFFNPUSA-N 265.273 -0.238 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2CNCC[C@H]2CO)[nH]n1C 2142485820 JBWQUYHHFONDDQ-DTWKUNHWSA-N 269.305 -0.559 5 10 CBBE C[C@@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CNCCO1 2143335928 MQQRZZKJBFICRX-NSHDSACASA-N 283.288 -0.714 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@]2(C)COCCO2)[nH]1 2145378513 ZTBOKUHPQCLBQH-LLVKDONJSA-N 283.288 -0.512 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N1C[C@@H]2C(CO)[C@H]2C1 2146879775 PQYYKOZYDHCLFR-IUCAKERBSA-N 280.284 -0.122 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CCOC[C@H]1N 2148820334 HBWQXUDKYZAKRZ-RKDXNWHRSA-N 281.272 -0.383 5 10 CBBE CN=c1nc(N2C[C@H]3C[C@H]2CN(C)C3)c([N+](=O)[O-])c[nH]1 2160647835 HHWINAAKOTYVIR-IUCAKERBSA-N 278.316 -0.011 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1C[C@H]2COC[C@]2(C(=O)O)C1 2161010571 ODYAZUVOMPTGLC-WRWORJQWSA-N 282.256 -0.134 5 10 CBBE Nc1cnc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@@H](O)C1 2161357408 PUKNVHOJKJKWKZ-RNFRBKRXSA-N 282.256 -0.860 5 10 CBBE O=C(c1cc([N+](=O)[O-])cnc1O)N1C[C@@H](O)C[C@@H](O)C1 2161390866 KSYBWLHDIXRASD-OCAPTIKFSA-N 283.240 -0.737 5 10 CBBE CN(C)c1nc(N2C[C@@H](O)C[C@H](O)C2)ncc1[N+](=O)[O-] 2161394231 PHZUNBJOVDDPFI-YUMQZZPRSA-N 283.288 -0.617 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)CC(=O)O 2166543606 LQXDUPCVSMJOOP-SSDOTTSWSA-N 283.240 -0.059 5 10 CBBE N=c1[nH]c(N[C@@H]2[C@H](N)[C@H]3CCCO[C@H]32)ncc1[N+](=O)[O-] 2173818725 PIWRBPIWHBQKJV-ZOQUXTDFSA-N 280.288 -0.286 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NC[C@@]23CN[C@@H](CO2)C3)[nH]1 2173889156 GHGOEXCJMGFULV-PRHODGIISA-N 279.300 -0.004 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@](F)(CN)C2)[nH]1 2174008115 DLWSCSWMORJWRH-DGFRNANFSA-N 284.295 -0.098 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NCCNCCOC)[nH]1 2174021903 RNPKUDCWWVAMHC-UHFFFAOYSA-N 284.320 -0.773 5 10 CBBE CC1(C)CO[C@H](CN=c2[nH]cc([N+](=O)[O-])c(=N)[nH]2)CO1 2176631927 DOGANYYHPJGMKI-SSDOTTSWSA-N 283.288 -0.175 5 10 CBBE Cc1nn(CC(=O)N[C@@H]2[C@@H]3CNC[C@@H]32)c(C)c1[N+](=O)[O-] 2182062357 YIHMZZUSGWFHDE-DOFRTFSJSA-N 279.300 -0.258 5 10 CBBE O=C(COc1ccccc1[N+](=O)[O-])NC1(CO)COC1 2189263467 REZKHOGFPPHFNO-UHFFFAOYSA-N 282.252 -0.149 5 10 CBBE O=[N+]([O-])c1cncnc1O[C@@H]1CN[C@H]2COC[C@@H]12 2219824541 QGIXPNOYCJERMC-BKPPORCPSA-N 252.230 -0.250 5 10 CBBE CC(C)n1cc([N+](=O)[O-])c(=NC[C@@H](O)[C@H](C)O)[nH]1 2223035648 YYSPDSYBEWMPOC-IONNQARKSA-N 258.278 -0.052 5 10 CBBE Nc1ccnc(ON2C[C@H](N)CC2=O)c1[N+](=O)[O-] 2224109211 JNTNZOYKKSRTED-RXMQYKEDSA-N 253.218 -0.575 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCC2(S(N)(=O)=O)CC2)[nH]1 2230760191 WZUBQMWJZNVFCM-UHFFFAOYSA-N 289.317 -0.534 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)[C@H]2CF)n1 2230781921 VIPLLPKLOLAZCQ-BWVDBABLSA-N 274.252 -0.309 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@H]2C[C@@H](C1)[C@H](CO)[C@H]2N 2239341028 QMVREEIEZBKJBO-JXUBOQSCSA-N 281.316 -0.280 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2C[C@H]3CCO[C@@]3(CO)C2)[nH]1 2239832449 UBQJPTXPGIEQDV-PRHODGIISA-N 280.284 -0.010 5 10 CBBE COc1nccc(O[C@H](CN)C(N)=O)c1[N+](=O)[O-] 2260206175 KTLJHBVGEAQENS-ZCFIWIBFSA-N 256.218 -0.810 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC[C@@](CF)(C(=O)O)C1 2266551500 XGZQFUSFCGXMKT-VIFPVBQESA-N 273.224 -0.026 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC1CNCCNC1 2272023812 BESILSWVFMUILR-UHFFFAOYSA-N 267.289 -0.776 5 10 CBBE C[C@H](CS(N)(=O)=O)NC(=O)c1ccc([N+](=O)[O-])cn1 2278183759 TZMBRTUOUPYTEZ-ZCFIWIBFSA-N 288.285 -0.603 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=N[C@@H]3C[C@H](O)C[C@@H]3O)[nH]c12 2295856365 HDUHNZFJMJSFNX-OOZYFLPDSA-N 279.256 -0.645 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC[C@H]1C[C@@H]2CNC[C@@H]21 2309701564 WWUDSGIJGFGIKK-PRJMDXOYSA-N 253.262 -0.042 5 10 CBBE N=c1cc([N+](=O)[O-])cc(NCCOC2CNC2)[nH]1 2315480096 IJBLNEUHFZSLOZ-UHFFFAOYSA-N 253.262 -0.197 5 10 CBBE Cn1nc(N2CC3(C2)CS(=N)(=O)C3)nc1[N+](=O)[O-] 2321756277 CTIKEGFALQHRDP-UHFFFAOYSA-N 272.290 -0.410 5 10 CBBE C[C@H](N)[C@@H]1CN(c2nc([N+](=O)[O-])n(C)n2)CCO1 2321760203 BXPLUCUUGFTZQM-BQBZGAKWSA-N 256.266 -0.724 5 10 CBBE Cn1[nH]c(=N[C@H]2C[C@H](CN)C2(C)C)nc1[N+](=O)[O-] 2321761658 VFCXDJREGGTAPA-RQJHMYQMSA-N 254.294 -0.070 5 10 CBBE Cn1nc(N2CCC[C@H]3CNC[C@H]32)nc1[N+](=O)[O-] 2321765093 OFJPLFXTCREXQA-JGVFFNPUSA-N 252.278 -0.089 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2C[C@H]3CC[C@@H]2N3)[nH]1 2330487075 DTPYHCJNWZARMO-RNJXMRFFSA-N 264.289 -0.228 5 10 CBBE O=C(O)[C@H]1[C@H](O)[C@H](O)CN1c1ccc([N+](=O)[O-])cc1 2332873756 NCIJKZRLWJIAFC-OPRDCNLKSA-N 268.225 -0.410 5 10 CBBE O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1NC[C@@H](O)[C@H]1O 2332938779 GAWKEDZJYYQYHK-KXUCPTDWSA-N 267.241 -0.773 5 10 CBBE CS(=O)(=O)[C@H]1CC[C@@H]1N=c1ccc([N+](=O)[O-])c(N)[nH]1 2342722022 WPDKUGPCPROCHZ-XPUUQOCRSA-N 286.313 -0.019 5 10 CBBE 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COc1cccc(NC[C@@H]2NC[C@H](O)[C@@H]2O)c1[N+](=O)[O-] 2233978322 UGAGOQVDCSGYPH-HOTUBEGUSA-N 283.284 -0.291 5 10 CBBE NC[C@H](CO)C(=O)N[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 2234124923 VYXMSLKJZBXDJP-GHMZBOCLSA-N 279.296 -0.255 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@H]2C[C@@H](O)[C@@H](O)C[C@H]2C1 2236987229 ATOQOOQGKRWEBH-SPJNRGJMSA-N 283.288 -0.709 5 10 CBBE O=[N+]([O-])c1ccc(CNCC2(O)CS(=O)(=O)C2)s1 2256070682 BFVICMHJOVMFRI-UHFFFAOYSA-N 292.338 -0.095 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(O)C[C@H]3C2)n1 2265185524 JCBKDLNAZZLFGA-CPCISQLKSA-N 266.257 -0.075 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCCCC2(O)CC2)[nH]1 2270195573 KDSQPUYYBASYMD-UHFFFAOYSA-N 267.289 -0.013 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2C[C@H]3C[C@H]2[C@@H](O)[C@H]3O)n1 2271062448 APZNBIXIMOJQAJ-GOZTYBTRSA-N 266.257 -0.376 5 10 CBBE Cc1ncc([N+](=O)[O-])c(OCCN2CCNCC2)n1 2271071302 KCSFLSGPPHBYPZ-UHFFFAOYSA-N 267.289 -0.023 5 10 CBBE CO[C@H]1[C@@H](Nc2ncnc(NN)c2[N+](=O)[O-])C[C@H]1O 2271180518 BHNNTCNQLLDSHG-BFHQHQDPSA-N 270.249 -0.770 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N2C[C@H](O)C[C@@H](O)C2)n1 2286634969 YUMVOPFVNFLTLG-HTQZYQBOSA-N 284.272 -0.537 5 10 CBBE CN(CC1(O)CNC1)c1cc(C(N)=O)ccc1[N+](=O)[O-] 2287323296 RVLPREILTJRLRZ-UHFFFAOYSA-N 280.284 -0.536 5 10 CBBE COCCN(C[C@@H](C)O)C(=O)Cn1cc([N+](=O)[O-])cn1 2287962970 BYKPJLDEVPTNJW-SECBINFHSA-N 286.288 -0.353 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2COC(=O)C2)[nH]1 2296243506 MPJBSPBFWVEQJB-ZETCQYMHSA-N 281.272 -0.304 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@@H]2CC[C@@H]2S(C)(=O)=O)[nH]1 2319827392 SNPUTWDXHAWPCL-SVRRBLITSA-N 274.302 -0.262 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCN[C@@H]3CC[C@@H]23)nc1[N+](=O)[O-] 2321762677 CBQSDQWZFSOSHH-BWZBUEFSSA-N 252.278 -0.302 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1C[C@@H]2NCCO[C@H]2C1 2343105879 AFNOTKCYGAEYMG-CSMHCCOUSA-N 268.277 -0.924 5 10 CBBE CC(C)S(=O)(=O)C[C@H](C)N=c1nc([N+](=O)[O-])n(C)[nH]1 2344957117 GKZXIFMOOJPKHU-ZETCQYMHSA-N 291.333 -0.231 5 10 CBBE Cn1cc(C[C@](C)(C(=O)O)N2CC([N+](=O)[O-])C2)cn1 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283.240 -0.361 5 10 CBBE C[C@H](CC(N)=O)NC(=O)c1ccc(NN)cc1[N+](=O)[O-] 312930323 FKKWDXVBBCGZAU-ZCFIWIBFSA-N 281.272 -0.126 5 10 CBBE COC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCCO1 578755234 SGDALKMZLKQTBV-RKDXNWHRSA-N 299.287 -0.504 5 10 CBBE CC1(C(N)=O)CN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 591960789 UENSPZREFRUDQR-UHFFFAOYSA-N 276.256 -0.051 5 10 CBBE CNCCCNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599098432 UMUHEPLUVVIFAG-UHFFFAOYSA-N 277.306 -0.784 5 10 CBBE CC(C)[C@H](O)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599243944 WSAVWNSOEMJVCS-MRVPVSSYSA-N 292.317 -0.377 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCO[C@@H]2CNC[C@@H]21 686532327 BQERVNKZTVJHQC-WDEREUQCSA-N 281.316 -0.228 5 10 CBBE C[C@@H](Nc1ncc(C(=O)O)cc1[N+](=O)[O-])[C@@H](O)CO 698952861 FXGOGPDHJOHVIB-XRGYYRRGSA-N 271.229 -0.158 5 10 CBBE CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CNC1 702034835 FUBWGQSACIXZAE-UHFFFAOYSA-N 253.262 -0.388 5 10 CBBE Cc1nn(C)c(NC[C@H]2CNC[C@H]2O)c1[N+](=O)[O-] 702797268 QLWMKJMXPGTLTC-HTQZYQBOSA-N 255.278 -0.371 5 10 CBBE 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2223034029 BSVNGVUUWILCNI-APPZFPTMSA-N 255.278 -0.680 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2C[C@H](O)C[C@@H]2CN)n1 2223050984 BPLWZMYRCRNUAB-HTQZYQBOSA-N 255.278 -0.291 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N(CCO)C[C@@H](C)O 2223815908 XDUBRZQGTVIBOX-MRVPVSSYSA-N 258.278 -0.009 5 10 CBBE N[C@H]1CC(=O)N(Oc2ncc(F)cc2[N+](=O)[O-])C1 2224088596 ZLQRNBHAUKQYPT-LURJTMIESA-N 256.193 -0.018 5 10 CBBE Nc1nc[nH]c(=NCCS(=O)(=O)C(F)F)c1[N+](=O)[O-] 2224284764 FAAFPEDQEFCRDF-UHFFFAOYSA-N 297.243 -0.562 5 10 CBBE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1cccnc1[N+](=O)[O-] 2225517263 HSEJODNFYHELMU-OPRDCNLKSA-N 269.257 -0.453 5 10 CBBE O=[N+]([O-])c1ccccc1CN1CC[C@@](O)(CO)[C@H](O)C1 2234105117 ITEWHXGGRBTCLF-CHWSQXEVSA-N 282.296 -0.115 5 10 CBBE NNc1cccc(CN2C[C@@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 2236884881 QKMDWYAXOCQREH-ZJUUUORDSA-N 282.300 -0.192 5 10 CBBE Nc1ccc(=NCc2[nH]ccc(=O)c2O)[nH]c1[N+](=O)[O-] 2239276523 MSGCPAPZVVMHIF-UHFFFAOYSA-N 277.240 0.000 5 10 CBBE CN1C(=O)C(Cl)=C(NCc2nn(C)cc2[N+](=O)[O-])C1=O 2240634800 VYOFPCYXDYLWOY-UHFFFAOYSA-N 299.674 -0.133 5 10 CBBE N=c1nc(N2CC[C@@]3(O)C[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2254099839 VQZUTUFVXWASIY-LHLIQPBNSA-N 251.246 -0.242 5 10 CBBE O=[N+]([O-])c1cccc(CNCC2(O)CS(=O)(=O)C2)c1 2267890781 CFRCRHHOEHRZJR-UHFFFAOYSA-N 286.309 -0.156 5 10 CBBE NNc1cccc(N2CC[C@H]2[C@H](O)CO)c1[N+](=O)[O-] 2270701772 RQGFQVVAJDEDKH-WCBMZHEXSA-N 268.273 -0.188 5 10 CBBE CNC[C@@]1(O)CCCN(c2ncncc2[N+](=O)[O-])C1 2270834744 KXDZHBRYPLKCPW-NSHDSACASA-N 267.289 -0.065 5 10 CBBE NC[C@H](CO)N=c1[nH]c(C2CCC2)ncc1[N+](=O)[O-] 2271096010 JZTSCVRZTAPVFA-MRVPVSSYSA-N 267.289 -0.194 5 10 CBBE O=C(O)[C@@H](CCO)N=c1[nH]c(C2CC2)ncc1[N+](=O)[O-] 2286611762 ROHMEDVDSPYFRJ-SSDOTTSWSA-N 282.256 -0.068 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=Nc2cn(C)nc2OC)[nH]1 2287281680 DOSYTIHGRDPFAQ-UHFFFAOYSA-N 279.260 -0.244 5 10 CBBE COC(=O)c1ccnc(-n2cnc([N+](=O)[O-])n2)n1 2318626740 QNTJFXMWIPHHPA-UHFFFAOYSA-N 250.174 -0.248 5 10 CBBE Cn1nc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)nc1[N+](=O)[O-] 2321707264 JYPWFHXFLIIXNF-XLPZGREQSA-N 253.262 -0.212 5 10 CBBE Cn1[nH]c(=NC[C@H]2COC(C)(C)O2)nc1[N+](=O)[O-] 2321708282 UGWKNTMJBIZTFF-LURJTMIESA-N 257.250 -0.291 5 10 CBBE CN(C)C[C@H]1C[C@H](N=c2nc([N+](=O)[O-])n(C)[nH]2)C1 2321757704 WZPSTALDDKNAQW-ZKCHVHJHSA-N 254.294 -0.103 5 10 CBBE COc1nc(N2CC([C@@H](O)CO)C2)ncc1[N+](=O)[O-] 2336783900 UXQBUMUBLUVCOK-QMMMGPOBSA-N 270.245 -0.817 5 10 CBBE O=Cc1cc([N+](=O)[O-])ccc1N1C[C@H](O)[C@H](O)C1 33592589 WJOJVLKRCQYOEQ-PHIMTYICSA-N 252.226 -0.051 5 10 CBBE Cc1ccc(S(=O)(=O)NCc2nnn[nH]2)cc1[N+](=O)[O-] 44930694 BEJAKSIFZAOQSF-UHFFFAOYSA-N 298.284 -0.105 5 10 CBBE NNc1ccc(C(=O)NC[C@@H]2CCC(=O)N2)cc1[N+](=O)[O-] 79938677 ICWSUOQEAZTIIW-QMMMGPOBSA-N 293.283 -0.111 5 10 CBBE CNC(=O)CS(=O)(=O)c1ncccc1[N+](=O)[O-] 121322711 SJDABHMCVIUOCK-UHFFFAOYSA-N 259.243 -0.491 5 10 CBBE CNc1cccc(C(=O)N2C[C@@H](O)[C@H](O)C2)c1[N+](=O)[O-] 234504557 LHGGXIGFCZZKEK-NXEZZACHSA-N 281.268 -0.186 5 10 CBBE C[C@@H](CN(C)C)Oc1nc(NN)ncc1[N+](=O)[O-] 304397920 AXLSIABZPWRKQM-LURJTMIESA-N 256.266 -0.001 5 10 CBBE NC(=O)c1ccn(-c2cnc([N+](=O)[O-])cc2C(=O)O)n1 312374394 ZSQFZJJRDWYIDL-UHFFFAOYSA-N 277.196 -0.027 5 10 CBBE CNC(=O)C[C@H](C)Nc1nc(N)ncc1[N+](=O)[O-] 322714394 QPVLZYYPNUXGHX-YFKPBYRVSA-N 254.250 -0.097 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2COC[C@@H]2O)c1 323124334 MRGRMEWGESPFHB-SCZZXKLOSA-N 267.241 -0.135 5 10 CBBE COC(=O)c1cnc(N2C[C@@H](O)C[C@@H](O)C2)c([N+](=O)[O-])c1 616374566 KRBFQPDBEKDJNZ-DTORHVGOSA-N 297.267 -0.292 5 10 CBBE O=C(N[C@H]1CNC[C@@H]1O)c1cc([N+](=O)[O-])cs1 699920469 CQKZVGNKKDDOJU-BQBZGAKWSA-N 257.271 -0.281 5 10 CBBE O=C(Cn1ccnc1[N+](=O)[O-])NC[C@@H]1CCCNC1 702736590 KPEQMAPHWHUJEW-SECBINFHSA-N 267.289 -0.093 5 10 CBBE O=C(N[C@@H]1COCC[C@@H]1O)c1cc([N+](=O)[O-])c[nH]1 710864060 CVEKWWKNOJRTOC-BDAKNGLRSA-N 255.230 -0.198 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1CCN2C[C@H](O)C[C@H]2C1 894430155 RMUXZWFUYXBLAD-DTWKUNHWSA-N 267.289 -0.417 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CN(C2CC2)[C@@H]2CCNC2)c1 923329936 SHLRUWMCTSVWNS-DGCLKSJQSA-N 295.343 -0.022 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CC([C@@H]2CCOC2)C1 1321492078 LZQRKSTZKLVNDZ-MRVPVSSYSA-N 281.272 -0.319 5 10 CBBE C[C@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1=O 1445730894 BCXNAEMIYGHTLI-NSHDSACASA-N 281.272 -0.566 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1C[C@@H](O)C[C@@H](O)C1 1459634497 MKGFMCZQUVARNT-AOOOYVTPSA-N 270.289 -0.473 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1C2CCC1(C(N)=O)CC2 1472174137 XSQHJOLNHOSESL-UHFFFAOYSA-N 293.283 -0.049 5 10 CBBE CC(=O)c1ccc(N2CC(O)(C(N)=O)C2)c([N+](=O)[O-])c1 1559257935 LCEMVCCAPWLNIJ-UHFFFAOYSA-N 279.252 -0.166 5 10 CBBE O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1569667425 LGCYNPAANYTGGT-JIGDXULJSA-N 252.230 -0.372 5 10 CBBE NC(=O)c1cc(N2CCN(C(N)=O)CC2)ccc1[N+](=O)[O-] 1612196076 DEMBBCHMELLDID-UHFFFAOYSA-N 293.283 -0.106 5 10 CBBE O=[N+]([O-])c1cnc(N2CC(NC3COC3)C2)nc1 1643230621 YBKMEQUSULTZNX-UHFFFAOYSA-N 251.246 -0.438 5 10 CBBE O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(N2CCCC2=O)C1 1645428297 HSBDZNLFMVQJGL-UHFFFAOYSA-N 279.256 -0.235 5 10 CBBE Cn1c(C(=O)OC[C@@H]2CNC(=O)C2)cnc1[N+](=O)[O-] 1849123996 UYVMCFDEBPCZSP-LURJTMIESA-N 268.229 -0.379 5 10 CBBE COC(=O)c1cncn1CC(=O)N1CC([N+](=O)[O-])C1 1876165473 NUHOKEWEQXVEPJ-UHFFFAOYSA-N 268.229 -0.843 5 10 CBBE O=C(O)c1ccnc(N(CCO)C2COC2)c1[N+](=O)[O-] 1915678029 YCLURTWTIZKSKM-UHFFFAOYSA-N 283.240 -0.115 5 10 CBBE O=C(NC1(CO)CNC1)c1cc(F)c(F)cc1[N+](=O)[O-] 1918430900 HGFMVJQBVPZEST-UHFFFAOYSA-N 287.222 -0.063 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCN(CCO)CC2)n1 1964106274 XDAULQVZEKIIDP-UHFFFAOYSA-N 269.305 -0.562 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCC2(C)OCCO2)c1[N+](=O)[O-] 1981873800 LZLUBKDQEBDLAS-UHFFFAOYSA-N 269.261 -0.297 5 10 CBBE Nc1nc(OC[C@H]2COC[C@@H]2N)ccc1[N+](=O)[O-] 2029852673 YIKVJJOMTATNGW-RQJHMYQMSA-N 254.246 -0.076 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCC1(C(=O)O)CCC1 2041248380 ZPDYOTZBKNNKCL-UHFFFAOYSA-N 255.234 -0.188 5 10 CBBE Nc1[nH]c(=NC[C@H](O)CC(=O)O)ccc1[N+](=O)[O-] 2047741536 VBQBBIDHCGADJK-RXMQYKEDSA-N 256.218 -0.759 5 10 CBBE O=C1CCCN1C[C@@H](O)Cn1ccnc1[N+](=O)[O-] 2050541226 YWXHPDAVHPMVLF-MRVPVSSYSA-N 254.246 -0.225 5 10 CBBE Nc1ccnc(NCCC2(O)CNC2)c1[N+](=O)[O-] 2053556124 WSEPPYFVFPBMIM-UHFFFAOYSA-N 253.262 -0.292 5 10 CBBE NCC1(C(=O)Nc2ncccc2[N+](=O)[O-])COC1 2082424594 KOZBKFZXWATBSS-UHFFFAOYSA-N 252.230 -0.096 5 10 CBBE COc1ncnc(N[C@H]2COC[C@@H]2CN)c1[N+](=O)[O-] 2097854632 OFTRLBIEVLOUSK-BQBZGAKWSA-N 269.261 -0.221 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2C[C@@H](O)CCO2)c1[N+](=O)[O-] 2097955861 PGXZJWXWRHKRDP-BQBZGAKWSA-N 269.261 -0.659 5 10 CBBE C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1C(=O)O 2099500584 TZZQKKORGQCQOT-HZGVNTEJSA-N 268.229 -0.277 5 10 CBBE COC[C@]1(Oc2nc([N+](=O)[O-])nn2C)CCCNC1 2102939834 WVTTVRAYIIDVGE-JTQLQIEISA-N 271.277 -0.129 5 10 CBBE CNc1nc[nH]c(=NCc2nc(=O)o[nH]2)c1[N+](=O)[O-] 2116185004 UAJUUGFDZPHSNJ-UHFFFAOYSA-N 267.205 -0.863 5 10 CBBE Nc1[nH]c(=NC[C@@H]2C[C@H](N)[C@@H](O)C2)ccc1[N+](=O)[O-] 2116210210 AVIDVVGOFIVONZ-FJXKBIBVSA-N 267.289 -0.496 5 10 CBBE CN=c1[nH]c(=NCCOCCCN)[nH]cc1[N+](=O)[O-] 2117201617 HWJVCSRQZYACAO-UHFFFAOYSA-N 270.293 -0.952 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2COCC[C@@H]2N)n1 2129979207 JJPHDKYISLLJOM-BQBZGAKWSA-N 269.261 -0.826 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2CCN[C@@H]3COC[C@H]32)[nH]1 2132578133 BKWXLDDBMPGJAG-VXNVDRBHSA-N 265.273 -0.421 5 10 CBBE O=[N+]([O-])c1c[nH]ccc1=NS(=O)(=O)CC1CC(O)C1 2137716861 WIKPOLZZXDCXSL-UHFFFAOYSA-N 287.297 -0.076 5 10 CBBE O=C(Nc1cc([N+](=O)[O-])ccn1)[C@H]1CNC[C@@H](O)C1 2137726573 CHNNKHZCLFKOSO-APPZFPTMSA-N 266.257 -0.101 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@@H]2CNCCN2C)[nH]n1C 2142481946 RUROYDYPVMMOFA-VIFPVBQESA-N 268.321 -0.626 5 10 CBBE NC(=O)CO[C@H]1CCN(c2nc(F)ncc2[N+](=O)[O-])C1 2145378208 WSDOWWHPXGJGNS-LURJTMIESA-N 285.235 -0.396 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@@H]1C[C@H]2COC[C@@H]2N1 2162369566 JYWRWYQJYVQCGL-FXQIFTODSA-N 283.263 -0.265 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@]2(O)CCCOC2)[nH]1 2168087743 KOQUDMYSINEUJE-NSHDSACASA-N 283.288 -0.776 5 10 CBBE Cc1[nH]c(=N)nc(N2CC(=O)N[C@@H]3CC[C@@H]32)c1[N+](=O)[O-] 2168362867 MJNFKPUXXLXIDA-RQJHMYQMSA-N 278.272 -0.427 5 10 CBBE NCC12CC(CN=c3ccc(N)c([N+](=O)[O-])[nH]3)(CO1)C2 2173817468 ABGQWHOERNPYLJ-UHFFFAOYSA-N 279.300 -0.086 5 10 CBBE CCO[C@@H]1C[C@@H](N)[C@H]1Nc1ncc([N+](=O)[O-])c(=NC)[nH]1 2173821169 DNDDMXPMNGBLAY-FTLITQJKSA-N 282.304 -0.235 5 10 CBBE CN=c1[nH]c(N[C@@H]2CCO[C@@H](CN)C2)ncc1[N+](=O)[O-] 2173846296 OQJJSDIBIVDIBG-HTQZYQBOSA-N 282.304 -0.233 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@]2(C)CCNC2)[nH]1 2174010254 HSGIYNIYOVOONQ-LBPRGKRZSA-N 280.332 -0.010 5 10 CBBE C[C@H](O)[C@H](CO)NC(=O)COc1ccc([N+](=O)[O-])cc1 2174123149 IQUBWBKERSJYIZ-KWQFWETISA-N 284.268 -0.169 5 10 CBBE C[C@H](O)[C@H]1CN(c2nc(NN)ncc2[N+](=O)[O-])CCO1 2174171090 JQSMDYRMLODNLA-POYBYMJQSA-N 284.276 -0.744 5 10 CBBE N[C@@H]1C[C@H](O)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1 2174775930 NFCWQCBWCQWWPH-APPZFPTMSA-N 281.268 -0.166 5 10 CBBE NC(=O)C1(CNC(=O)c2cc([N+](=O)[O-])ncc2N)CC1 2177594734 ZZHSQDDXBPXXGV-UHFFFAOYSA-N 279.256 -0.433 5 10 CBBE O=[N+]([O-])c1cccc(CN[C@@H]2C[C@H](CO)[C@H](O)[C@H]2O)c1 2177944454 MGMODEKMLAGYDL-XEZLXBQYSA-N 282.296 -0.213 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1C[C@@H]2[C@H](CO)CO[C@H]2C1 2178097249 GBLQJVAZYQAKSA-PRJMDXOYSA-N 284.247 -0.033 5 10 CBBE Cn1c(C(=O)N2CCC[C@H]2[C@@H](O)CO)ccc1[N+](=O)[O-] 2179739510 AFOQOFOYUFQNOG-WPRPVWTQSA-N 283.284 -0.109 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1[C@@H](O)CO 2179739776 CTTBHQOHNDOYQM-ONGXEEELSA-N 283.284 -0.109 5 10 CBBE CN=c1[nH]c(N2CCC[C@H]2[C@@H](O)CO)ncc1[N+](=O)[O-] 2179799336 NRUKLBBZAZZCBU-CBAPKCEASA-N 283.288 -0.830 5 10 CBBE O=C(N[C@H]1CNCC[C@H]1O)c1ccc([N+](=O)[O-])c(O)c1 2183271201 QXUGAKVMSLXOGG-WCBMZHEXSA-N 281.268 -0.247 5 10 CBBE O=C1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CCN1 2186335820 MDSZBCYGEUAUFL-LURJTMIESA-N 280.240 -0.296 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CO[C@@H]2CNC[C@H]12 2186531180 JQQAIOWJVVMOAW-ZXFLCMHBSA-N 281.272 -0.955 5 10 CBBE O=C(O)[C@@H]1C[C@@H]2OCC[C@H]2N1C(=O)N1CC([N+](=O)[O-])C1 2191516423 HCEKPMQXAHCJES-VGMNWLOBSA-N 285.256 -0.616 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=NC[C@]23CCOC[C@@H]2C3)[nH]1 2194535032 IDCOCYMVGNMBBJ-WRWORJQWSA-N 280.288 -0.069 5 10 CBBE CN=c1nc(N2C[C@@H]3C[C@@H]3[C@H]2CN)c([N+](=O)[O-])c(C)[nH]1 2198965347 IOIRVKXWTBCTGX-XHNCKOQMSA-N 278.316 -0.060 5 10 CBBE Cc1nc(NN)nc(N2C[C@@H]3C[C@H]3[C@@H]2CO)c1[N+](=O)[O-] 2198997897 VKANPEMXSPTTGZ-RNJXMRFFSA-N 280.288 -0.204 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2C[C@H]3[C@@H](C2)[C@@H]3C(N)=O)[nH]1 2201290183 VMBHEULMCCDZDK-MTBHXBHISA-N 277.284 -0.379 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCc2ncnn2C)[nH]1 2223025767 IOADMBQPLKXHMI-UHFFFAOYSA-N 251.250 -0.026 5 10 CBBE CCn1ncc([N+](=O)[O-])c1NCc1nnnn1C 2223844387 UCJXQFJDOLIWQX-UHFFFAOYSA-N 252.238 -0.053 5 10 CBBE O=[N+]([O-])c1cncnc1N1CC[C@H]2OCCN[C@@H]2C1 2226996467 IIKPULRCCFMTCL-PSASIEDQSA-N 265.273 -0.048 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@H]1[C@H](O)CO 2258343325 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Cn1c(C(=O)N2C[C@@H](O)[C@@H]3COC[C@@H]32)ccc1[N+](=O)[O-] 2354369064 MECNDJDNYRANPT-FKTZTGRPSA-N 281.268 -0.235 5 10 CBBE Nc1cc(N2CC[C@@H]3C[C@H]2[C@H](O)[C@H]3O)ncc1[N+](=O)[O-] 2357596912 ODDSLTLMWVKPDZ-IVYYIHNJSA-N 280.284 -0.108 5 10 CBBE NC(=O)CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 35452933 XWETXJOASNWKDQ-UHFFFAOYSA-N 266.213 -0.177 5 10 CBBE C[C@H](NC(=O)CCn1cnc([N+](=O)[O-])c1)c1nnn[nH]1 44888665 UZQDMIZGOVHWJC-LURJTMIESA-N 280.248 -0.428 5 10 CBBE O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H](O)C(=O)O 90263961 XYUSBAIMPNFFCC-SNVBAGLBSA-N 297.267 -0.118 5 10 CBBE Nc1cccc(C(=O)N[C@@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 157069232 PIVYZIFUOYELOE-MRVPVSSYSA-N 292.251 -0.288 5 10 CBBE CCNc1ncnc(N2CCOC[C@@H]2C(N)=O)c1[N+](=O)[O-] 159136429 DDTHIGJFRLWARY-SSDOTTSWSA-N 296.287 -0.493 5 10 CBBE Cc1nc(NN)nc(NCCS(C)(=O)=O)c1[N+](=O)[O-] 235789370 JHRSWEQHPMTFRR-UHFFFAOYSA-N 290.305 -0.565 5 10 CBBE Cn1cnnc1Sc1nc(NN)ncc1[N+](=O)[O-] 236095308 ISTYFZGWKUCXCI-UHFFFAOYSA-N 268.262 -0.050 5 10 CBBE 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282.304 -0.317 5 10 CBBE COc1ncnc(NC[C@@H]2C[C@H](N)[C@@H](O)C2)c1[N+](=O)[O-] 2172851356 PCWSZJOBHRIURZ-CSMHCCOUSA-N 283.288 -0.097 5 10 CBBE COc1ncnc(N2CCO[C@H]([C@H](C)O)C2)c1[N+](=O)[O-] 2174148220 CLKVUQJJECCUNV-YUMQZZPRSA-N 284.272 -0.021 5 10 CBBE Nc1cc(N[C@H]2CCn3nnnc3C2)ncc1[N+](=O)[O-] 2175911240 BCOATQUFZCTDKX-LURJTMIESA-N 276.260 -0.015 5 10 CBBE Cc1[nH]ccc(=NC2(C(N)=O)CCNCC2)c1[N+](=O)[O-] 2183316683 XYQHFIGGTOPWMO-UHFFFAOYSA-N 279.300 -0.260 5 10 CBBE O=C(O)[C@@]1(O)CCN(c2cc([N+](=O)[O-])ccn2)C[C@H]1O 2197473688 XGLMXEUSVJFYDT-LDYMZIIASA-N 283.240 -0.624 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2CC[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)[nH]1 2199526934 MMQKJHSYUXXBLF-QRPIXLCVSA-N 280.284 -0.277 5 10 CBBE Cc1c(NC(=O)[C@@H]2NC[C@H](O)[C@@H]2O)cccc1[N+](=O)[O-] 2201150302 SCLYAAQJOAZICT-AXFHLTTASA-N 281.268 -0.465 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2C[C@@H]3NCC[C@@H]32)[nH]1 2205645833 XCFFMARKFRUUCD-YIZRAAEISA-N 278.316 -0.320 5 10 CBBE Cn1cc([N+](=O)[O-])c(C[S@](=O)[C@@H]2CCNC2)n1 2217232391 PLCVUGYJWJDSJK-GJEGPGMTSA-N 258.303 -0.061 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=N[C@@H]2CC[C@@H]2CO)[nH]1 2218448173 YZVBSVKIDQKZGS-PHDIDXHHSA-N 254.250 -0.725 5 10 CBBE Cc1cc([N+](=O)[O-])c(=O)n(CC(CO)(CO)CO)c1 2232063219 YTLRHCXUFYNYGG-UHFFFAOYSA-N 272.257 -0.972 5 10 CBBE Nc1ccc([N+](=O)[O-])c(N2CC[C@@](O)(CO)[C@@H](O)C2)c1 2234104641 JOYMVVDOGVUBMG-NWDGAFQWSA-N 283.284 -0.529 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCCN2C[C@H](C)NC2=O)[nH]n1C 2239262023 HPVDKOMAUGNALD-ZETCQYMHSA-N 282.304 -0.116 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=NC[C@](C)(O)CO)[nH]1 2258646326 ITLQWFVWUZKABX-JTQLQIEISA-N 256.262 -0.476 5 10 CBBE Nc1ccc(N2CCOC3(CNC3)C2)nc1[N+](=O)[O-] 2272936568 BYXPVHXSQSSARJ-UHFFFAOYSA-N 265.273 -0.249 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H](O)C[C@@H]1CO 2278153017 KTIMYOKFIFAGDO-RKDXNWHRSA-N 267.241 -0.443 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)C23CC(N)(CO2)C3)n1 2280657710 KIDMCHVAFMRSEE-UHFFFAOYSA-N 281.272 -0.795 5 10 CBBE NC(CO)(CO)CNc1ccc([N+](=O)[O-])c2nonc12 2286180825 PJFLIWGLOBXEIC-UHFFFAOYSA-N 283.244 -0.775 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N(CCO)C[C@@H](C)O)n1 2286640978 GXKIZOUKGBXHDB-MRVPVSSYSA-N 286.288 -0.289 5 10 CBBE CN[C@H]1COC[C@@H]1Oc1nc(COC)ncc1[N+](=O)[O-] 2286726944 AQGBPYPGVRFEGB-CBAPKCEASA-N 284.272 -0.103 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N2CCNC[C@@H]2CO)n1 2286734132 KYKBREQZHNJMED-MRVPVSSYSA-N 283.288 -0.698 5 10 CBBE CC[C@]1(NC(=O)c2c([N+](=O)[O-])cnn2C)CCNC1=O 2288920667 ABERWWKPZIXHBA-NSHDSACASA-N 281.272 -0.273 5 10 CBBE COCC[C@@H](N)CN=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2295924946 KZTNSSPPEULUFK-MRVPVSSYSA-N 280.288 -0.165 5 10 CBBE O=[N+]([O-])c1cnc(Cl)nc1N1C[C@@H](O)[C@@H](O)[C@@H]1CF 2333241600 YLBYOYWGMMBTQV-JHYUDYDFSA-N 292.654 -0.082 5 10 CBBE O=C(O)[C@]1(N2CC([N+](=O)[O-])C2)CN[C@@H]2CCCC[C@H]21 2347722180 WWOXVWIWRCSVFZ-FOGDFJRCSA-N 269.301 -0.067 5 10 CBBE COc1nc(OC)nc(OCC(F)([N+](=O)[O-])[N+](=O)[O-])n1 31429712 XSDYWUHPATXNBR-UHFFFAOYSA-N 293.167 -0.556 5 10 CBBE CCNC(=O)[C@H]1CNCCN1C(=O)c1ccc([N+](=O)[O-])o1 89089343 TYOXCCLPVFOTJG-MRVPVSSYSA-N 296.283 -0.262 5 10 CBBE O=[N+]([O-])c1n[nH]c(/C=C/c2nc([N+](=O)[O-])n[nH]2)n1 102418188 FGIZHSIAWRFFGF-OWOJBTEDSA-N 252.150 -0.090 5 10 CBBE CNc1ncccc1Cn1c(=O)c([N+](=O)[O-])cn(C)c1=O 111545473 VRFZNSWGPRIRTP-UHFFFAOYSA-N 291.267 -0.060 5 10 CBBE Cc1nn(CC(=O)N[C@@H]2CCNC2)c(C)c1[N+](=O)[O-] 126547471 CRJYTCWGSQQDEE-SECBINFHSA-N 267.289 -0.114 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1[C@H]2COC[C@H]21 357935232 UFIQFPIHYSLINK-VROVMSAKSA-N 266.257 -0.139 5 10 CBBE CN1CCN(S(=O)(=O)c2ncccc2[N+](=O)[O-])CC1 594745108 XKQPMWALXCWDMA-UHFFFAOYSA-N 286.313 -0.074 5 10 CBBE CO[C@@]1(CO)CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 597997644 LXVAMUYNNUUXRF-NSHDSACASA-N 284.272 -0.069 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCN(C)[C@H](CO)C1 687591237 VHXYEQALXIIYKC-NSHDSACASA-N 283.332 -0.292 5 10 CBBE Cc1c(C(=O)N[C@@H]2CNC[C@@H]2O)cccc1[N+](=O)[O-] 699912925 BJQFPPGQQXZBEN-KOLCDFICSA-N 265.269 -0.034 5 10 CBBE Cc1nc(N)nc(N(C)[C@H]2COC[C@@H]2O)c1[N+](=O)[O-] 708123765 IHPKLIRZJNVNQF-BQBZGAKWSA-N 269.261 -0.529 5 10 CBBE CCc1nn(C)c(N2CC(O)(C(=O)OC)C2)c1[N+](=O)[O-] 714504848 VOZQRCHGMDCCCR-UHFFFAOYSA-N 284.272 -0.385 5 10 CBBE CN(C)C[C@@H](O)CNc1nc(NN)ncc1[N+](=O)[O-] 717296832 WTYULKBBJNTCHR-LURJTMIESA-N 271.281 -0.995 5 10 CBBE CN(C)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 717415914 FQTWJLQBHHSSME-SSDOTTSWSA-N 256.262 -0.425 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@@H]3C[C@H]2CO3)n1 718320714 LGECCPAREMHZMK-WDSKDSINSA-N 252.234 -0.352 5 10 CBBE C[C@H]1CNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 721862188 OLQWFYZUKPTXGV-IONNQARKSA-N 253.262 -0.485 5 10 CBBE Cn1ncc(CNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 806380494 VZDVDOWUUSESCJ-UHFFFAOYSA-N 277.244 -0.138 5 10 CBBE COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccnn1C 843713310 OIUGQNGFMKKCEJ-FTLITQJKSA-N 282.256 -0.584 5 10 CBBE COC[C@@H]1COCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1134215287 YUBIXQLPWNFWEM-MRVPVSSYSA-N 285.260 -0.940 5 10 CBBE CN1C[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C(=O)N1 1137826338 BZTIFLVGEJJKMQ-UWVGGRQHSA-N 294.267 -0.910 5 10 CBBE CCOC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1138070819 DAQHAZKGIKKDKS-BRDIYROLSA-N 260.246 -0.918 5 10 CBBE NCCOCCOCCNc1ncc([N+](=O)[O-])cn1 1170505710 QNCJKKHIWIZCOM-UHFFFAOYSA-N 271.277 -0.211 5 10 CBBE CC[S@@](=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319984941 RKGJWNYEBRUXTQ-GOSISDBHSA-N 274.302 -0.173 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1N1CC(O)(C(N)=O)C1 1472853398 BDRWHTAECMQTLA-UHFFFAOYSA-N 269.261 -0.844 5 10 CBBE O=C(N[C@H]1C[C@H](CNCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1506883400 GFOWNXZRKFRRBS-ZYUZMQFOSA-N 257.290 -0.872 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCC(=O)NC2=O)n1 1532377759 FVMRVJQQRWGCSC-QMMMGPOBSA-N 292.251 -0.167 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CO)c1cccnc1 1557085407 LIAXXFKDXKZJPS-VIFPVBQESA-N 292.255 -0.569 5 10 CBBE Nc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](O)C[C@H]1CO 1617105584 NRMVKKSGDFGQJK-DTWKUNHWSA-N 281.268 -0.255 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2C(N)=O)n1 1636661259 NOMFPLMYGOGVRZ-ZCFIWIBFSA-N 267.245 -0.582 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)NCCn1ccnn1 1639233299 XMNZQXZOQYUSFS-UHFFFAOYSA-N 279.260 -0.492 5 10 CBBE CN(CCNC(=O)c1ccn(C)n1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1688330343 WRTBDABHRKSMAY-PSASIEDQSA-N 295.299 -0.727 5 10 CBBE O=C(O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 1866357376 HBZVVTTYHMCWSS-CBAPKCEASA-N 296.235 -0.040 5 10 CBBE O=C(O)[C@H]1C[C@H](NC(=O)N2CC([N+](=O)[O-])C2)CCO1 1880021082 QIAIIFMCOLPVPQ-HTRCEHHLSA-N 273.245 -0.711 5 10 CBBE NNc1ncnc(N2CC3(CCOC3)C2)c1[N+](=O)[O-] 1915565810 AZMOILQSMQUJLM-UHFFFAOYSA-N 266.261 -0.103 5 10 CBBE C[C@H]1NC(=O)CC[C@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 1963158214 BJUQCJOVYKKMLW-RNFRBKRXSA-N 281.272 -0.275 5 10 CBBE CN1C[C@H](O)[C@H](Nc2ccnc(O)c2[N+](=O)[O-])C1 2029867532 QHKZCXOCPCRFIS-SFYZADRCSA-N 254.246 -0.218 5 10 CBBE CN1C[C@H](O)[C@@H](Nc2ncnc(F)c2[N+](=O)[O-])C1 2029886161 BUJNXSBXRVPIRR-WDSKDSINSA-N 257.225 -0.389 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O=C(O)[C@]1(C(=O)N2CC([N+](=O)[O-])C2)CCCCO1 2071558499 NNZQYTQFABLSJX-SNVBAGLBSA-N 258.230 -0.502 5 10 CBBE O=[N+]([O-])c1cccnc1NS(=O)(=O)N1CC(O)C1 2082421739 LNXFGFLMPRPGOJ-UHFFFAOYSA-N 274.258 -0.677 5 10 CBBE Cc1c([N+](=O)[O-])c(OC[C@H]2COC[C@@H]2N)nn1C 2086315123 PCLNHVPHXRVJGX-SFYZADRCSA-N 256.262 -0.011 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2CCCNC2=O)[nH]1 2087740697 MVFWIAHKTQUQPK-LURJTMIESA-N 266.261 -0.843 5 10 CBBE COC(=O)[C@@H](Cn1cc([N+](=O)[O-])nc1C)NC(C)=O 2088922867 DEMFAQVAPSYZDB-MRVPVSSYSA-N 270.245 -0.223 5 10 CBBE CCN=c1nc(N2CC[C@@H]2C(N)=O)c([N+](=O)[O-])c[nH]1 2089360716 ZSGAGPKZRYOORE-ZCFIWIBFSA-N 266.261 -0.698 5 10 CBBE CCCN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]2CO)[nH]1 2101303033 JNFROGICQKRKPC-HTQZYQBOSA-N 267.289 -0.157 5 10 CBBE CN(C)c1nc(NN2CCNCC2)ncc1[N+](=O)[O-] 2101463936 QIMCZTCIKRZWEO-UHFFFAOYSA-N 267.293 -0.317 5 10 CBBE O=C(NC[C@H]1CNCCOC1)c1ccc([N+](=O)[O-])[nH]1 2102332668 KXNIXWBOHVKJBZ-MRVPVSSYSA-N 268.273 -0.111 5 10 CBBE C[C@H]1C[C@H]1N(CCO)c1nc(NN)ncc1[N+](=O)[O-] 2110786092 GTFBPZKLBHHTST-NKWVEPMBSA-N 268.277 -0.123 5 10 CBBE Nc1ccc(N2C[C@H](N)[C@H]3COC[C@@H]32)nc1[N+](=O)[O-] 2117180704 VQHGVOYUPXKFTG-YEPSODPASA-N 265.273 -0.266 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(NC[C@H]2CNCCO2)[nH]1 2117263579 OIAYYFGTHFZMJQ-MRVPVSSYSA-N 267.289 -0.146 5 10 CBBE C[C@@H](O)[C@H](CO)Nc1cc(C(N)=O)ccc1[N+](=O)[O-] 2117487170 SSZUGURODPVCHX-MUWHJKNJSA-N 269.257 -0.153 5 10 CBBE C[C@H](O)[C@@H]1CN(c2ncnc(N)c2[N+](=O)[O-])CCO1 2117543762 DITPSYOWGAPRPD-BQBZGAKWSA-N 269.261 -0.447 5 10 CBBE O=C(NCC(CO)CO)c1cc(O)ccc1[N+](=O)[O-] 2123160444 GREQTQWCCMGBMB-UHFFFAOYSA-N 270.241 -0.369 5 10 CBBE CN(C[C@]1(O)CCOC1)c1cc([N+](=O)[O-])cc(=N)[nH]1 2129434719 ZLOGEAJJXDKWMG-LLVKDONJSA-N 268.273 -0.010 5 10 CBBE CN(CCOCCN)C(=O)c1nn(C)cc1[N+](=O)[O-] 2129976656 DXGCNYYSZSFGER-UHFFFAOYSA-N 271.277 -0.624 5 10 CBBE CCc1nn(C)c(NCC2(CO)CNC2)c1[N+](=O)[O-] 2137084148 NTWCLZPWWGBJGQ-UHFFFAOYSA-N 269.305 -0.116 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCCO[C@H]2CCOC2)c1[N+](=O)[O-] 2143839969 KDRKCCZLINLLFO-QMMMGPOBSA-N 283.288 -0.255 5 10 CBBE C[C@@H]1CC[C@@H](CN=c2[nH]c(NN)ncc2[N+](=O)[O-])N1C 2151630959 GGSMPDZYLVKNFH-SFYZADRCSA-N 281.320 -0.013 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2C[C@H]3OCC[C@H]23)c1[N+](=O)[O-] 2151826213 PVGPDYKHHVTSMS-BWZBUEFSSA-N 280.288 -0.010 5 10 CBBE CN=c1[nH]c(=NCCN2C[C@H]3C[C@@H]3C2)[nH]cc1[N+](=O)[O-] 2157679934 HFRABOXWHWRDAB-RKDXNWHRSA-N 278.316 -0.366 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@H]2CN3CC[C@H]2C3)c1[N+](=O)[O-] 2158733641 GXXXWHFWPFJMEF-YUMQZZPRSA-N 279.304 -0.483 5 10 CBBE CN1C[C@H]2C[C@H]1CN(c1ncnc(NN)c1[N+](=O)[O-])C2 2160651913 JMHZNIUEDZZEJM-SFYZADRCSA-N 279.304 -0.189 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC[C@@H](OCCO)C2)n1 2165427973 WBWPGTUQXMOXKJ-MRVPVSSYSA-N 283.288 -0.137 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNCc2nnnn2C2CC2)n1 2169371283 JAFJXWZUXLHFOH-UHFFFAOYSA-N 278.276 -0.061 5 10 CBBE CN=c1[nH]c(N2CCC[C@@](N)(CO)C2)ncc1[N+](=O)[O-] 2173809585 BRHVZHOHBVKDNX-NSHDSACASA-N 282.304 -0.862 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(NCCN2CCNCC2)[nH]1 2173898700 VSJOQWYNEDEZNN-UHFFFAOYSA-N 280.332 -0.230 5 10 CBBE Nc1ncnc(N[C@H]2CN[C@@]3(CCOC3)C2)c1[N+](=O)[O-] 2174033601 SLURJMSKPZIXMU-HQJQHLMTSA-N 280.288 -0.100 5 10 CBBE CN(CC1[C@H]2COC[C@H]12)c1ncnc(NN)c1[N+](=O)[O-] 2174658165 ZFXPEINWOYZNFZ-HTQZYQBOSA-N 280.288 -0.001 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N[C@@H]1C[C@H](CO)[C@H](O)[C@@H]1O 2177944742 OCAYPPRNVOUCQR-HXOWADHMSA-N 288.235 -0.962 5 10 CBBE N=c1cc(C(=O)N[C@H]2CCNC(=O)C2)c([N+](=O)[O-])c[nH]1 2186329980 NHCQKZPUHJDIPG-LURJTMIESA-N 279.256 -0.589 5 10 CBBE CCOc1nc(=NC(=O)c2nn(C)cc2[N+](=O)[O-])[nH][nH]1 2186533074 SPWKGDDRFKQWLQ-UHFFFAOYSA-N 281.232 -0.481 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@]3(C(=O)O)C[C@@H]23)n1 2186548352 OOSHPVIDDIGQPV-WGDKSQQYSA-N 280.240 -0.079 5 10 CBBE CO[C@@H]1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1O 2187239737 WGJHTJBXSSIVAP-HRDYMLBCSA-N 284.272 -0.554 5 10 CBBE O=C(O)[C@@]1(n2cnc([N+](=O)[O-])n2)C[C@H]2CC[C@@H](N2)[C@@H]1F 2190657896 RTEKASFKTJWAQD-QGOVLLJGSA-N 285.235 -0.171 5 10 CBBE CCN(Cc1cnnn1C)c1ncc([N+](=O)[O-])c(=N)[nH]1 2196704585 PUQCNJLUCLRZSI-UHFFFAOYSA-N 278.276 -0.048 5 10 CBBE NCCn1cc(C(=O)Nc2ccc([N+](=O)[O-])cn2)nn1 2202440949 GEWPHSDASUUQFQ-UHFFFAOYSA-N 277.244 -0.208 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2COCC[C@@H]2C(=O)O)[nH]n1C 2207486015 RDBRUSJVRUFVSI-JGVFFNPUSA-N 284.272 -0.040 5 10 CBBE CC1(C)[C@@H](O)[C@H](O)CN1c1ncncc1[N+](=O)[O-] 2219812502 BDRFSZJAOJCRBI-SFYZADRCSA-N 254.246 -0.295 5 10 CBBE NC(=O)[C@@H]1OCC[C@H]1Nc1ncncc1[N+](=O)[O-] 2219821768 AYCVYPGIGCRQKN-IYSWYEEDSA-N 253.218 -0.561 5 10 CBBE C[C@H](N)[C@H](C)C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2223851741 BTISLPDXBDIIGJ-BQBZGAKWSA-N 255.278 -0.072 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@@H]1C[C@@H]2OCC[C@@H]2N1 2227002115 MGKGGTBDZKNBPD-NRPADANISA-N 265.273 -0.262 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@@H](CO)C[C@@H](CO)C1 2228401650 HAVQCACBTZSKFG-OCAPTIKFSA-N 271.277 -0.850 5 10 CBBE CC1CC(Nc2nc(NN)ncc2[N+](=O)[O-])(C(N)=O)C1 2240629744 XKGVEDORSVEPJU-UHFFFAOYSA-N 281.276 -0.264 5 10 CBBE CC(=O)N[C@@H](Cn1cc(C)cc([N+](=O)[O-])c1=O)C(=O)O 2240786562 SLVOPJGCDJSVFR-QMMMGPOBSA-N 283.240 -0.346 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(O)C[C@@H]3C2)n1 2265185526 JCBKDLNAZZLFGA-RDDDGLTNSA-N 266.257 -0.075 5 10 CBBE COc1n[nH]cc1CN=c1[nH]cnc(N)c1[N+](=O)[O-] 2268590240 PTCZPFZIKYHYLL-UHFFFAOYSA-N 265.233 -0.267 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCCNC(N)=O)[nH]1 2271092101 UWZZWRMKBBEYQW-UHFFFAOYSA-N 270.249 -0.967 5 10 CBBE O=[N+]([O-])c1cnc(C2CCC2)[nH]c1=NC[C@H](O)CO 2271100725 DHBCDKGKUZQASK-QMMMGPOBSA-N 268.273 -0.161 5 10 CBBE CC(C)c1ncc([N+](=O)[O-])c(=NC[C@@H]2CNC[C@H]2O)[nH]1 2281189252 MRBDISZVHUXQIE-WCBMZHEXSA-N 281.316 -0.078 5 10 CBBE Cc1cccc(NC(=O)[C@@H]2NC[C@@H](O)[C@@H]2O)c1[N+](=O)[O-] 2282824692 ISGVJNWHDRFQMQ-KKZNHRDASA-N 281.268 -0.465 5 10 CBBE O=C(c1cccc([N+](=O)[O-])c1O)N1CC(O)(CCO)C1 2286177914 SCSCURQZCZKFTG-UHFFFAOYSA-N 282.252 -0.130 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N[C@H]1CO[C@@H]2CNC[C@@H]21 2310020859 JCDHSBPUYPPFHU-GJMOJQLCSA-N 253.262 -0.273 5 10 CBBE Cn1nc(N2CCCC3(CNC3)C2)nc1[N+](=O)[O-] 2321761589 UQTKMEISNYYAMQ-UHFFFAOYSA-N 252.278 -0.087 5 10 CBBE C[C@@H]1NCC[C@@H](C)[C@@H]1N=c1nc([N+](=O)[O-])n(C)[nH]1 2321765246 TXKYUMNDWDXTNT-CSMHCCOUSA-N 254.294 -0.056 5 10 CBBE Nc1nc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)ccc1[N+](=O)[O-] 2329327912 FXCLVVZKEBHMPJ-ZGDSCGAWSA-N 266.257 -0.498 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@]23C[C@H](N)[C@@H]2C3)n1 2333960004 KPPCBNKOKAGERI-HFJPGXAFSA-N 265.273 -0.318 5 10 CBBE CO[C@H]1C[C@H](N)CN(Cc2nn(C)cc2[N+](=O)[O-])C1 2344691258 BBNRDYLHTODTPJ-IUCAKERBSA-N 269.305 -0.124 5 10 CBBE Cn1[nH]c(=NCC[C@]23CC[C@H]2CNC3)nc1[N+](=O)[O-] 2345004606 MSJQEOBPPVFQOS-KWQFWETISA-N 266.305 -0.053 5 10 CBBE COC(=O)[C@H](CCN)Oc1nn(C)c(C)c1[N+](=O)[O-] 2351544456 WTJLEUTVISQBDP-ZETCQYMHSA-N 272.261 -0.094 5 10 CBBE N[C@@H](CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)O 1571296 NDGWMNVGXXMEAE-QMMMGPOBSA-N 274.254 -0.220 5 10 CBBE CNC(=O)[C@@H](C)NC[C@@H](O)Cn1nc(C)c([N+](=O)[O-])c1C 69369673 FKXPBYRHNGBCJG-PSASIEDQSA-N 299.331 -0.507 5 10 CBBE NS(=O)(=O)c1ccc(CC(=O)O)c([N+](=O)[O-])c1 128548699 SCCAJVZCUXYEFK-UHFFFAOYSA-N 260.227 -0.131 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CNC2(CO)CC2)c1 143010564 SJUKQNOTTVVEDG-VIFPVBQESA-N 256.262 -0.733 5 10 CBBE CN1CCO[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 194618925 JDIUIMVSYRFDEZ-SNVBAGLBSA-N 283.288 -0.762 5 10 CBBE NC(=O)[C@@H](N)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 217008634 VTHBIYLAGRZXPV-QMMMGPOBSA-N 273.270 -0.819 5 10 CBBE NC(=O)[C@@H](O)CNCc1cc(F)ccc1[N+](=O)[O-] 228683063 VFWPWLKJPVMSFH-VIFPVBQESA-N 257.221 -0.330 5 10 CBBE COC1CC(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 234687378 SLFMSWMOZRHMRC-LDGBHUKOSA-N 270.289 -0.081 5 10 CBBE COc1ccc([N+](=O)[O-])c(NC(CO)(CO)CO)n1 234879699 CCIWUVJLDIKWPW-UHFFFAOYSA-N 273.245 -0.874 5 10 CBBE Cc1nn(C)c(C(=O)N2CC(=O)N(C)[C@H](C)C2)c1[N+](=O)[O-] 282479250 VJSAAOREQXWULW-SSDOTTSWSA-N 295.299 -0.061 5 10 CBBE O=C(O)c1cc([N+](=O)[O-])ncc1NC[C@H](O)CO 305961277 OONAKUIFKUMIKS-YFKPBYRVSA-N 257.202 -0.547 5 10 CBBE NC(=O)CCCCn1cc([N+](=O)[O-])c(O)nc1=O 306108337 UKXXZVHIGHELIC-UHFFFAOYSA-N 256.218 -0.487 5 10 CBBE COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2COC[C@H]2O)n1 322972171 KDDZXEANSUPCJE-VXNVDRBHSA-N 283.240 -0.052 5 10 CBBE C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCN1CCO 331151487 JLLXBZAPRQAWEZ-VIFPVBQESA-N 297.315 -0.533 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@@H](O)C[C@@H](C(=O)O)C2)n1 401923966 PSRVQZUCOFZVHC-RQJHMYQMSA-N 270.245 -0.400 5 10 CBBE C[C@@H](N)[C@H](CO)Oc1ccc(C(N)=O)cc1[N+](=O)[O-] 403501790 FLCRAEUIANXNFC-LDWIPMOCSA-N 269.257 -0.219 5 10 CBBE C[C@@]1(CO)C[C@H](O)CN1c1cc([N+](=O)[O-])cc(NN)n1 703826298 PKRAATNCFXMAAC-KWQFWETISA-N 283.288 -0.403 5 10 CBBE C[C@@H](Nc1nc(C(=O)O)ccc1[N+](=O)[O-])[C@H](O)CO 705039800 SAOYRDWKJTTZAV-SVGQVSJJSA-N 271.229 -0.158 5 10 CBBE CN(C(=O)c1cc(N)ncc1[N+](=O)[O-])[C@@H]1COC[C@@H]1O 708141747 WIVMQBYLIALXGH-BDAKNGLRSA-N 282.256 -0.596 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NCCc1cc[nH]n1 714560354 WHENZDKLPCZEPA-UHFFFAOYSA-N 264.245 -0.127 5 10 CBBE COc1ncnc(NCC2(CO)COC2)c1[N+](=O)[O-] 717665466 GTKFSFHPPJGYRQ-UHFFFAOYSA-N 270.245 -0.186 5 10 CBBE CC1(C)CNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 721901601 WLMLOIOMWRJTQY-SECBINFHSA-N 267.289 -0.095 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1COCC[C@@H]1N 722079151 IUNUPBDIWXXIDC-IUCAKERBSA-N 268.273 -0.221 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2CCC(=O)N2)n1 845143817 JOZRAAYNDXCIRB-LURJTMIESA-N 268.229 -0.236 5 10 CBBE Nc1n[nH]c(C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)n1 854502972 HGJDHAAFKHCXSK-HTQZYQBOSA-N 280.288 -0.242 5 10 CBBE CO[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@](C)(CO)C1 870528109 VAGDUHGMUYIVPM-TURQNECASA-N 258.274 -0.350 5 10 CBBE CCO[C@H]1COCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 1116594646 LEJRJMNFTLEIKN-BDAKNGLRSA-N 299.287 -0.504 5 10 CBBE Cn1nnnc1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1138541081 LGPDXDBGJCHHCC-JTQLQIEISA-N 292.255 -0.532 5 10 CBBE CCCN(CC(N)=O)C(=O)c1c[nH]nc1[N+](=O)[O-] 1141503619 VATRRIJTZVNOTQ-UHFFFAOYSA-N 255.234 -0.345 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1[C@H](CO)CC[C@H]1CO 1163517822 IUUPMAMGSBFCCE-YUMQZZPRSA-N 284.272 -0.714 5 10 CBBE CNC(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 1163546176 YIVUANHLMFQNIH-ZETCQYMHSA-N 293.283 -0.339 5 10 CBBE O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(Cc2cnsn2)CC1 1313445193 QHVHMTUMXNXLTE-NXEZZACHSA-N 297.340 -0.153 5 10 CBBE COC(=O)[C@]1(O)CCN(c2ncc([N+](=O)[O-])c(C)n2)C1 1458544141 FZMAHPGOBVYONB-NSHDSACASA-N 282.256 -0.193 5 10 CBBE CNC(=O)N[C@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1466739006 JKTHARXBCRMYJF-ZETCQYMHSA-N 296.287 -0.528 5 10 CBBE O=C(NCCn1cnnc1)c1cnc(O)c([N+](=O)[O-])c1 1556669824 VBXAZBWHJNUQKU-UHFFFAOYSA-N 278.228 -0.283 5 10 CBBE CN1CC[C@@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)CC1=O 1557126607 ZSMLNBXWLLPNPG-MRVPVSSYSA-N 296.287 -0.829 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CCNC1=O 1626090373 FGVDDONTACWYAL-UHFFFAOYSA-N 281.272 -0.312 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N(C)CC(N)=O)n1 1629966583 WRBUXHVJUSMWJZ-UHFFFAOYSA-N 255.234 -0.632 5 10 CBBE O=[N+]([O-])c1cnc(N2CCN3CCOC[C@@]3(CO)C2)nc1 1643226277 UIVZYMPRLQAROC-LBPRGKRZSA-N 295.299 -0.732 5 10 CBBE CC(C)N1CC(CCO)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1675076982 WOMBPWCKOULNIR-NXEZZACHSA-N 271.317 -0.387 5 10 CBBE Cc1nnc(CNCCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1699507252 VFMFCJXFFGTCJY-NXEZZACHSA-N 297.315 -0.019 5 10 CBBE CCOCCN1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1723760442 FUSRQRFUJYZPOZ-GHMZBOCLSA-N 271.317 -0.169 5 10 CBBE CCN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)CCOC 1737797278 GFQJMDXPQRJNJC-NXEZZACHSA-N 287.316 -0.347 5 10 CBBE CN(C)CC[C@](C)(C(=O)O)n1cnc([N+](=O)[O-])n1 2030188467 IAJVVDGZYAMXKJ-SECBINFHSA-N 257.250 -0.062 5 10 CBBE N=c1[nH]c(N[C@H]2COCC[C@@H]2O)ncc1[N+](=O)[O-] 2039898707 BGFMSUXIGUABIX-FSPLSTOPSA-N 255.234 -0.641 5 10 CBBE CC[C@H](CO)CN=c1[nH]cc([N+](=O)[O-])c(=NC)[nH]1 2039929512 HHZZBLCPMQRKCT-ZETCQYMHSA-N 255.278 -0.299 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1[C@H]2NCCCC[C@H]21 2041254853 HSWNUYUZJXEOBL-GJMOJQLCSA-N 252.278 -0.302 5 10 CBBE CNC(=O)CCCN=c1cc(N)c([N+](=O)[O-])c[nH]1 2047197980 DOGPERWXLZDRNG-UHFFFAOYSA-N 253.262 -0.068 5 10 CBBE Nc1ccc(N2CCNC[C@@H](O)C2)nc1[N+](=O)[O-] 2053517378 RBAADVUEDOSQBP-SSDOTTSWSA-N 253.262 -0.658 5 10 CBBE CN=c1[nH]c(NCC2(C)CNC2)ncc1[N+](=O)[O-] 2053534090 XQGKJGWKXIKYIZ-UHFFFAOYSA-N 252.278 -0.130 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NCC2CCNCC2)[nH]1 2053605463 VWNXGGCXCZGKCJ-UHFFFAOYSA-N 252.278 -0.369 5 10 CBBE N=c1nc(N2CC3(CC(N)C3)C2)c([N+](=O)[O-])c[nH]1 2053616699 DDDVVAJHPDEZGG-UHFFFAOYSA-N 250.262 -0.275 5 10 CBBE CCNc1nc[nH]c(=NC[C@@H]2C[C@H]2N)c1[N+](=O)[O-] 2053648033 RPVOCASBWBOHKP-NKWVEPMBSA-N 252.278 -0.002 5 10 CBBE C[C@@H](N)C[S@@](C)(=O)=Nc1nc(=N)[nH]cc1[N+](=O)[O-] 2053648268 UWLPTXNVRUJZBQ-JXJLEFFBSA-N 274.306 -0.126 5 10 CBBE NC[C@@H](CO)Nc1cnc([N+](=O)[O-])cc1C(=O)O 2062363003 VULONBNZKZHQMO-YFKPBYRVSA-N 256.218 -0.581 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[C@H]1N 2066470299 QCQVRJVKNRFXHA-RNFRBKRXSA-N 253.262 -0.205 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@H](N)C1 2095858824 BPPDJRZSJBWREX-MRVPVSSYSA-N 268.273 -0.267 5 10 CBBE NC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])c2nsnc12 2099667182 LEYNCDIJGVGGGT-ZCFIWIBFSA-N 283.269 -0.142 5 10 CBBE Cc1nccnc1CN=c1[nH]cc([N+](=O)[O-])c(=N)[nH]1 2101438404 XKSKPXNTWUSSBG-UHFFFAOYSA-N 261.245 -0.070 5 10 CBBE CN=c1[nH]c(N2CCS[C@@H](CO)C2)ncc1[N+](=O)[O-] 2101465949 VXXSBFPMVGYVRW-SSDOTTSWSA-N 285.329 -0.238 5 10 CBBE O=[N+]([O-])c1c(N2C[C@H](O)[C@H]3COC[C@H]32)ccnc1O 2102191021 TXLCVODZYVBUAY-ZQARSLAVSA-N 267.241 -0.109 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCC12COC(CN)(C1)C2 2103318945 SHXADIMCLMIWFJ-UHFFFAOYSA-N 268.277 -0.935 5 10 CBBE COCCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C1CNC1 2103932463 YERVSYLLXOMMCP-UHFFFAOYSA-N 268.273 -0.017 5 10 CBBE 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NNc1ncnc(N2CC(=O)N[C@@H]3CC[C@H]32)c1[N+](=O)[O-] 2168358393 CRJIDFQROICAPZ-PHDIDXHHSA-N 279.260 -0.862 5 10 CBBE Cn1cnc([N+](=O)[O-])c1OCc1nnc2n1CCNC2 2171789840 OJDPOBSTUMPTSA-UHFFFAOYSA-N 279.260 -0.398 5 10 CBBE CNc1ncnc(N2CCNC[C@H]2COC)c1[N+](=O)[O-] 2173808882 TYAGLRUMSYDFDI-QMMMGPOBSA-N 282.304 -0.149 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@@H]2COC[C@H]2OC)[nH]1 2177282329 GCXLWYKINACABG-HTQZYQBOSA-N 283.288 -0.596 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@@H]2[C@@H](CO)CO[C@H]2C1 2178098677 POLFQRLYHUYRCO-OOZYFLPDSA-N 284.247 -0.033 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CO)[C@H](N)C1 2178910015 HCXJOTFVSSSRGV-WCBMZHEXSA-N 282.300 -0.285 5 10 CBBE C[C@@H]1CNC(=O)CN1C(=O)c1cc([N+](=O)[O-])ncc1N 2181166785 DAXGIFGJOCOUIJ-ZCFIWIBFSA-N 279.256 -0.468 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CNCC[C@@H]2O)c1 2183270756 OUQFEFVCSJOJHA-KOLCDFICSA-N 280.284 -0.172 5 10 CBBE CN1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])[C@@H](CN)C1 2186528676 KOAGBSHVYWEHRF-QMMMGPOBSA-N 282.304 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CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H](C)CNC(=O)OC)[nH]1 2286122564 YTLCRLATTVHXHL-LURJTMIESA-N 284.276 -0.573 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=NCCOCCCO)[nH]1 2286648222 IEMPMLQAUADUBF-UHFFFAOYSA-N 286.288 -0.236 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@H](CC(=O)O)C(=O)O)[nH]1 2286667132 VVWCFAFFIXSLND-RXMQYKEDSA-N 284.228 -0.291 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@H]2CNCCOC2)[nH]1 2286736513 XLMWZGYSWPATIJ-QMMMGPOBSA-N 283.288 -0.647 5 10 CBBE N=c1[nH]c(N[C@H](CCCCN)C(=O)O)ncc1[N+](=O)[O-] 2289803730 VTEROPBTXRUDQQ-ZCFIWIBFSA-N 284.276 -0.209 5 10 CBBE NC[C@@H]1CC(F)(F)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 2296371454 DPZDGZICPPHBQM-ZETCQYMHSA-N 289.242 -0.014 5 10 CBBE Cn1[nH]c(=NCCN2CCOC2=O)nc1[N+](=O)[O-] 2321693513 HMPACJRJCXSSFR-UHFFFAOYSA-N 256.222 -0.991 5 10 CBBE CC[C@H](C)[C@H](N=c1nc([N+](=O)[O-])n(C)[nH]1)C(N)=O 2321698090 ZUICTMHEZHNBJL-WDSKDSINSA-N 256.266 -0.543 5 10 CBBE Cn1nc(N2CC(F)(F)[C@@](C)(N)C2)nc1[N+](=O)[O-] 2321757582 VJPNCGIQQKWDQP-ZETCQYMHSA-N 262.220 -0.104 5 10 CBBE Cn1[nH]c(=N[C@@H]2CNCC(C)(C)C2)nc1[N+](=O)[O-] 2321766644 ZZSAUGHERBRWAF-ZETCQYMHSA-N 254.294 -0.055 5 10 CBBE O=[N+]([O-])c1cnn2ccc(=N[C@@H]3[C@H]4CN[C@@H]3C4)[nH]c12 2335082506 CSIGRFKDJADFTO-BRDIYROLSA-N 260.257 -0.168 5 10 CBBE O=C(CN1CCS(=O)(=O)CC1)c1cc([N+](=O)[O-])c[nH]1 37339386 SIRWIHKRDLUMIG-UHFFFAOYSA-N 287.297 -0.164 5 10 CBBE CN(C)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 37881373 JPMQKSDNYCHQPR-LLVKDONJSA-N 271.321 -0.307 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[C@@H](C(=O)O)O1 94558234 VTYIPVVGWADSOD-IUCAKERBSA-N 298.255 -0.460 5 10 CBBE COc1ncnc(N[C@@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 94739732 PZIZPHNKMXOENU-RXMQYKEDSA-N 281.228 -0.437 5 10 CBBE NC(=O)[C@H]1COCCN1CC(=O)c1cc([N+](=O)[O-])c[nH]1 158990792 SQWBPKNYTXPWGK-SECBINFHSA-N 282.256 -0.708 5 10 CBBE NC(=O)[C@@H](O)CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 228521368 HLLBMXIBBFXTNZ-QMMMGPOBSA-N 289.194 -0.551 5 10 CBBE CN1CC[C@H](n2cc([N+](=O)[O-])c(C(=O)O)n2)C1=O 229734348 XTRPAOMWEYLZDY-YFKPBYRVSA-N 254.202 -0.107 5 10 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294.267 -0.746 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1CCNC(=O)[C@@H]1CC(=O)O 1916407637 GVEXOXBTNACIKP-LURJTMIESA-N 283.244 -0.892 5 10 CBBE C[C@](C(=O)O)([C@H]1CNCCO1)n1ccc([N+](=O)[O-])n1 1919708898 ICMUHJSLRCXENT-GMSGAONNSA-N 270.245 -0.421 5 10 CBBE Cc1cc(=NCC(O)(CO)CO)c([N+](=O)[O-])c(C)[nH]1 1921387063 AJSIFMFETXCZIV-UHFFFAOYSA-N 271.273 -0.844 5 10 CBBE CCNS(=O)(=O)c1ncc([N+](=O)[O-])c(OC)n1 2006569125 SEBCWGCYDYAKIY-UHFFFAOYSA-N 262.247 -0.308 5 10 CBBE N=c1nc(N2C[C@H]3C(CO)[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2030269639 PJIYWRDAXURIIK-PHDIDXHHSA-N 251.246 -0.528 5 10 CBBE CN=c1[nH]c(N(C)CC[S@@](C)=O)ncc1[N+](=O)[O-] 2039931952 SAVBKIOINRLPIB-GOSISDBHSA-N 273.318 -0.337 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC[C@@H]2CCC(=O)N2)n1 2041184700 BSDIAGGVWBEVNY-ZETCQYMHSA-N 253.262 -0.304 5 10 CBBE CNC(=O)CCCNCc1nn(C)cc1[N+](=O)[O-] 2041196549 RZRJELVOOMHGIS-UHFFFAOYSA-N 255.278 -0.056 5 10 CBBE C[C@@H]1CNC[C@H]1CCN=c1nc([N+](=O)[O-])[nH]n1C 2041251845 ABUPGTXWDTWLRN-HTQZYQBOSA-N 254.294 -0.197 5 10 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FQEMGNQKINFHQC-UHFFFAOYSA-N 268.273 -0.061 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1[C@H]2CN[C@@H]1C2 2311830507 OFDFFGQLXOUKBJ-BRDIYROLSA-N 251.246 -0.732 5 10 CBBE Cc1nn(C)c(N2CC([C@H](O)CO)C2)c1[N+](=O)[O-] 2315143610 HMLJWOPRIHIXFY-MRVPVSSYSA-N 256.262 -0.574 5 10 CBBE C[C@@H]1OCCO[C@H]1CN=c1nc([N+](=O)[O-])n(C)[nH]1 2321707656 NVGWEQIGGXYBPM-BQBZGAKWSA-N 257.250 -0.639 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1[C@H]2CC[C@@H]1C[C@H](O)[C@H]2O 2331974543 LFLNOZQSAMLLMX-KVPKETBZSA-N 269.261 -0.814 5 10 CBBE N=c1[nH]c(N2C[C@@H]3C[C@H](N)[C@@H](C3)C2)ncc1[N+](=O)[O-] 2333674261 QPYCAWWYXWTBEB-FXQIFTODSA-N 264.289 -0.029 5 10 CBBE COC(=O)[C@H]1C[C@@H](Oc2nc([N+](=O)[O-])n(C)n2)CN1 2344959748 GDSJYGAOBIBLMA-PHDIDXHHSA-N 271.233 -0.994 5 10 CBBE Cn1nc(N2CC[C@@H]([C@@](C)(O)CO)C2)nc1[N+](=O)[O-] 2345018942 LCJHYJDPTHTVAX-XCBNKYQSSA-N 271.277 -0.707 5 10 CBBE Cn1nc(N2C[C@H](O)CC[C@H]2C(=O)O)nc1[N+](=O)[O-] 2345024157 PJFGHIARBAGZER-RITPCOANSA-N 271.233 -0.862 5 10 CBBE C[C@@H](N)[C@](C)(NCc1nn(C)cc1[N+](=O)[O-])C(=O)O 2349551114 XKJZTUMAACUGBA-LDWIPMOCSA-N 271.277 -0.392 5 10 CBBE O=C(NC[C@H](O)C(=O)O)c1cc([N+](=O)[O-])ccc1F 90261260 QMJQBVKZWJTQIQ-QMMMGPOBSA-N 272.188 -0.091 5 10 CBBE CCCn1cc([N+](=O)[O-])c(=O)n(C/C=C/C(=O)O)c1=O 111544054 NCCCAHYPPBZLBI-ONEGZZNKSA-N 283.240 -0.031 5 10 CBBE Nc1ncnc(NCC(=O)NC2CC2)c1[N+](=O)[O-] 129609915 ZYWLKQYPSFJLMA-UHFFFAOYSA-N 252.234 -0.343 5 10 CBBE CC(C)NC(=O)[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 229012727 RVCRQERBAUOHKR-MWLCHTKSSA-N 299.331 -0.345 5 10 CBBE COC[C@@H](CO)Nc1ncnc(OC)c1[N+](=O)[O-] 229039774 NATACDOVWGMKOH-ZCFIWIBFSA-N 258.234 -0.187 5 10 CBBE C[C@H](C[S@](C)=O)Nc1ncnc(NN)c1[N+](=O)[O-] 229098116 OUMFAYGKFDZMQL-OYGCIMKHSA-N 274.306 -0.151 5 10 CBBE COC[C@@H](CCO)NC(=O)CCn1cnc([N+](=O)[O-])c1 229797047 BYNHRZBHGHNCFQ-SECBINFHSA-N 286.288 -0.305 5 10 CBBE CN(c1nc(NN)ncc1[N+](=O)[O-])[C@@H]1CCOC1 234307591 VAEBYDBYTQWKOD-ZCFIWIBFSA-N 254.250 -0.105 5 10 CBBE CNc1cc([N+](=O)[O-])cc(N2CCNC(=O)C2)n1 234515652 OQILKNRFGYWNPO-UHFFFAOYSA-N 251.246 -0.032 5 10 CBBE Nc1nc(N2CC[C@@]3(CNC(=O)C3)C2)ncc1[N+](=O)[O-] 279197906 XAYSMGPDMRSCQH-LLVKDONJSA-N 278.272 -0.317 5 10 CBBE Cc1nc([N+](=O)[O-])c(NC(C(=O)O)C(=O)O)n1C 311132754 RGYDVJZDHUYHKM-UHFFFAOYSA-N 258.190 -0.414 5 10 CBBE CC[C@](C)(Nc1nc(NN)ncc1[N+](=O)[O-])C(N)=O 311778754 CZPQJZZWAXBIPZ-VIFPVBQESA-N 269.265 -0.264 5 10 CBBE CN([C@H]1CCNC1)S(=O)(=O)c1cncc([N+](=O)[O-])c1 311894917 ZANWBSNZDQNKDO-QMMMGPOBSA-N 286.313 -0.028 5 10 CBBE COC(=O)C[C@@H](C)Nc1nc(NN)nc(C)c1[N+](=O)[O-] 380178425 BSACORVVIKQZMX-RXMQYKEDSA-N 284.276 0.342 5 10 CBBE Nc1nc(S[C@@H]2CCNC2=O)ncc1[N+](=O)[O-] 563440427 RMWIDLMZGORCLM-RXMQYKEDSA-N 255.259 -0.052 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H](CO)C2CCC2)c1 595617945 VRSYTGVUNIILKH-NEPJUHHUSA-N 284.316 -0.097 5 10 CBBE CO[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCOC1 597410910 SJTFIHXFABRHLC-MWLCHTKSSA-N 298.299 -0.041 5 10 CBBE C[C@@]12COC[C@@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 598232357 PRGCJMVLAZOMAF-GZMMTYOYSA-N 281.272 -0.319 5 10 CBBE Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCCN2)n1 599096887 AEARSUNJUJSBCJ-ZETCQYMHSA-N 289.317 -0.641 5 10 CBBE Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCCN2CCC2)n1 599266702 QFWBOZJCHODJAK-UHFFFAOYSA-N 289.317 -0.688 5 10 CBBE O=C(NC[C@@H](O)[C@@H]1CCCO1)c1cc([N+](=O)[O-])cnc1O 600838953 SXFXNSOKMHEHJO-ZJUUUORDSA-N 297.267 -0.035 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)NN1CCC1 686797653 BBDQFNSGWMLFAI-UHFFFAOYSA-N 252.234 -0.374 5 10 CBBE O=C(O)CS(=O)(=O)Cc1ccc([N+](=O)[O-])cn1 699119942 LXRGZUXGBXBBCU-UHFFFAOYSA-N 260.227 -0.011 5 10 CBBE O=C1Cc2cc([N+](=O)[O-])c(N[C@H]3CNC[C@H]3O)cc2N1 699923757 OSNWQVMYMOBOSY-GXSJLCMTSA-N 278.268 -0.166 5 10 CBBE Cc1nn(CC(=O)N[C@@H]2[C@@H]3C[C@@H]2CN3)c(C)c1[N+](=O)[O-] 700740443 QEAAQSDWACKSCA-YWVKMMECSA-N 279.300 -0.115 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H]2CCOC[C@@H]2O)n1 707030925 SHVHKGYEPVUBDH-SVRRBLITSA-N 269.261 -0.163 5 10 CBBE C[C@H]1C[C@H]1C(=O)NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 1118856933 CREAJWVKPNNTHB-NTSWFWBYSA-N 288.285 -0.211 5 10 CBBE CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)c1ccnnc1 1284521705 IAYFMNVVSNRWHR-NXEZZACHSA-N 293.283 -0.670 5 10 CBBE C[C@@H]1CC(=O)NN1C(=O)Cn1ccc([N+](=O)[O-])n1 1542586366 QANWWEORNIEFOS-ZCFIWIBFSA-N 253.218 -0.557 5 10 CBBE O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@@H](O)[C@@H](O)C1 1557961956 OMILAYRZXDYGDF-ZJUUUORDSA-N 282.252 -0.132 5 10 CBBE COC(=O)[C@H](C)NC(=O)Cn1c([N+](=O)[O-])cnc1C 1629335445 SUGATWKHASWFKJ-LURJTMIESA-N 270.245 -0.223 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H](CO)CN(C)C)n1 1635993917 VKLPIGFAZBBJCR-SECBINFHSA-N 282.300 -0.049 5 10 CBBE CN1C(=O)CN(c2c([N+](=O)[O-])cnn2C)CC1=O 1639817513 YHZSEQSXZVMTRV-UHFFFAOYSA-N 253.218 -0.867 5 10 CBBE O=C1NC[C@H](O)CC12CN(c1ncccc1[N+](=O)[O-])C2 1651418345 DFNHTXPPEBQHFC-MRVPVSSYSA-N 278.268 -0.323 5 10 CBBE O=C(NC/C=C/CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 1689187505 OGRXUNBMNBTEBL-UFLMBTITSA-N 267.285 -0.150 5 10 CBBE COC(=O)C[C@@H](N)C(=O)Nc1ncc([N+](=O)[O-])s1 1865965891 PNZGYQYEPBBPDU-SCSAIBSYSA-N 274.258 -0.120 5 10 CBBE O=C(NCCS(=O)(=O)O)c1ccc(O)c([N+](=O)[O-])c1 1866090864 DOHNUDHXWNMTOS-UHFFFAOYSA-N 290.253 -0.082 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCC1(CO)CO 1879987471 TXBJTJSJAYOIGI-UHFFFAOYSA-N 270.289 -0.471 5 10 CBBE C[C@@H](O)CN(CCO)c1ccc([N+](=O)[O-])cc1C(N)=O 1917262465 VBBOFWZLIBXIGT-MRVPVSSYSA-N 283.284 -0.127 5 10 CBBE O=[N+]([O-])c1cc(O)cc([C@@H]2CS(=O)(=O)NCCN2)c1 1952495294 NEOUILKTIWPEIG-JTQLQIEISA-N 287.297 -0.136 5 10 CBBE O=C(COc1cccc([N+](=O)[O-])c1)NCC[C@H](O)CO 1963574402 HMEMZHYJMODRPR-JTQLQIEISA-N 284.268 -0.167 5 10 CBBE O=[N+]([O-])C1CN(S(=O)(=O)[C@@H]2CCCC[C@H]2O)C1 2016887679 ODHISGCQARJWIR-RKDXNWHRSA-N 264.303 -0.419 5 10 CBBE O=[N+]([O-])c1ccc(NS(=O)(=O)C2CNC2)nc1 2023728356 HOJFGVZCGUIUIV-UHFFFAOYSA-N 258.259 -0.297 5 10 CBBE NC[C@@H]1COC[C@H]1N=c1ccc([N+](=O)[O-])c(N)[nH]1 2036605080 KPYPFOCAAQPSHN-RNFRBKRXSA-N 253.262 -0.621 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1C[C@@H]1C(=O)O 2039779258 FCSVFPWKBKQPRK-NTSWFWBYSA-N 254.202 -0.619 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CNCC2(CC2)C1 2041255901 RXTCEOYTTJDFNZ-SSDOTTSWSA-N 252.278 -0.301 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@@]12CNC[C@@H]1C2 2044047297 ROXXANXTTNZISD-QUBYGPBYSA-N 253.237 -0.033 5 10 CBBE N[C@@H]1C[C@@H](O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 2049116711 KMFFRXJKABFGLE-RNFRBKRXSA-N 254.246 -0.543 5 10 CBBE CN=c1[nH]c(N2CCNC[C@@H]2C)ncc1[N+](=O)[O-] 2053521845 FIUVHDUUFYYEJX-ZETCQYMHSA-N 252.278 -0.354 5 10 CBBE CN(CCC1CNC1)c1nc(=N)[nH]cc1[N+](=O)[O-] 2056829761 STCPGAFBPYNYGP-UHFFFAOYSA-N 252.278 -0.157 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@](C)(N)C2)n1 2066470475 SQLULXHWHLFCQC-JTQLQIEISA-N 253.262 -0.108 5 10 CBBE CCc1nn(C)c(N[C@H]2CN(C)C[C@@H]2O)c1[N+](=O)[O-] 2090337846 VULPIEAFYBPFIS-IUCAKERBSA-N 269.305 -0.023 5 10 CBBE NNc1ccc(C(=O)N2CC(CO)C2)cc1[N+](=O)[O-] 2092550397 ZFUZTMIVZBMILH-UHFFFAOYSA-N 266.257 -0.055 5 10 CBBE O=[N+]([O-])c1ccc([S@](=O)C[C@]2(O)CNC[C@@H]2O)cc1 2100933888 YOWLVDJATSCXSX-ZDCWMAILSA-N 286.309 -0.602 5 10 CBBE COc1nc(N[C@H](CO)CCCO)ncc1[N+](=O)[O-] 2101473654 GKVVIVUNXXVLRN-ZETCQYMHSA-N 272.261 -0.061 5 10 CBBE Nc1ncnc(N[C@H]2CCNC[C@H]2CO)c1[N+](=O)[O-] 2117124621 AUPPNYOWMWFDJJ-BQBZGAKWSA-N 268.277 -0.651 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2CCNC23CC3)c1[N+](=O)[O-] 2117335454 OBYLORFAPFGLKO-ZETCQYMHSA-N 264.289 -0.057 5 10 CBBE C[C@H](O)[C@@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1 2117477087 AXPOOVNYMFQUQZ-POYBYMJQSA-N 291.285 -0.990 5 10 CBBE C[C@@H](O)[C@H](CO)Nc1ncc([N+](=O)[O-])c(N(C)C)n1 2117479176 VOMUICMQNWFYPG-RQJHMYQMSA-N 271.277 -0.396 5 10 CBBE C[C@@H](O)[C@@H]1CN(c2ncnc(N)c2[N+](=O)[O-])CCO1 2117543765 DITPSYOWGAPRPD-RQJHMYQMSA-N 269.261 -0.447 5 10 CBBE COCC(CN)(COC)Oc1ncc([N+](=O)[O-])cn1 2119330104 MIUXFMROQAYDTK-UHFFFAOYSA-N 272.261 -0.246 5 10 CBBE O=[N+]([O-])c1cccc(N2CC3(C2)OC[C@H](O)[C@H]3O)n1 2127329131 HCFVYSJICWFNFS-OIBJUYFYSA-N 267.241 -0.699 5 10 CBBE Nc1ccc(O[C@@H]2CN[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 2128108009 GFLOLAANVICXEH-CAHLUQPWSA-N 268.229 -0.234 5 10 CBBE N[C@@H]1CS(=O)(=O)C[C@H]1Oc1ncnc(F)c1[N+](=O)[O-] 2128224447 AGQMFASAYCIGRS-RFZPGFLSSA-N 292.248 -0.973 5 10 CBBE NC(=O)C1(Oc2ccc([N+](=O)[O-])c(N)c2F)CNC1 2128256498 QWAIYSIRSNZUQH-UHFFFAOYSA-N 270.220 -0.478 5 10 CBBE CN1CC[C@@](CN)(Oc2cc(N)c([N+](=O)[O-])cn2)C1 2128258547 QAXISZUCQHWHSZ-NSHDSACASA-N 267.289 -0.016 5 10 CBBE CN(C[C@]1(O)CCOC1)c1ncnc(N)c1[N+](=O)[O-] 2129437248 QAFWEDPYKKEZHB-SNVBAGLBSA-N 269.261 -0.445 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CCN3)C2)n1 2129974057 ZVEXTHGTVGGARY-LLVKDONJSA-N 265.273 -0.094 5 10 CBBE C[C@@H](N)C[S@@](C)(=O)=NC(=O)c1nn(C)cc1[N+](=O)[O-] 2129977206 IFDNMXXGVGOGNX-ZLWQNGGKSA-N 289.317 -0.087 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](CO)[C@@H](F)C2)n1 2129999458 VMPRURUNLIMJHH-BQBZGAKWSA-N 272.236 -0.269 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CC[C@H]3C[C@H]2[C@@H](O)[C@H]3O)n1 2134814231 CMVMXJMCHPLVJY-ZRUAGYDASA-N 268.273 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Cn1[nH]c([N+](=O)[O-])nc1=NCC1(O)CCSCC1 2041247734 PVIQVFZDSYRVQR-UHFFFAOYSA-N 273.318 -0.185 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1C[C@H]2CC[C@H]1NC2 2041250635 JCNCCSMYDPPRNK-PRJMDXOYSA-N 252.278 -0.302 5 10 CBBE NC[C@H]1COCCN1c1ncnc(F)c1[N+](=O)[O-] 2044441613 MVCAZLCKMNIAIL-LURJTMIESA-N 257.225 -0.312 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1CCNC[C@H](O)C1 2044478816 KKNNSMLDEHRAEY-LURJTMIESA-N 257.225 -0.706 5 10 CBBE C[C@@H]1CCNC[C@H]1N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2053603440 HJBQMVYNNWOUJV-RNFRBKRXSA-N 252.278 -0.371 5 10 CBBE Nc1nc[nH]c(=NCCCNC2CC2)c1[N+](=O)[O-] 2053605239 SLFMFWLRTVRIGR-UHFFFAOYSA-N 252.278 -0.057 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]2[C@H](C)O)[nH]1 2061889335 ZHWHLTQOXWAMCX-RRKCRQDMSA-N 253.262 -0.549 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C)(CO)C1 2066490469 IULBBBJSHDZGEB-UHFFFAOYSA-N 254.246 -0.217 5 10 CBBE NC[C@H](CO)C(=O)Nc1c(O)cccc1[N+](=O)[O-] 2067740067 NBOBIUPOPNVELG-ZCFIWIBFSA-N 255.230 -0.194 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N(CCO)CCO)c1 2085769690 UFVMGEFCYMYQJC-UHFFFAOYSA-N 256.262 -0.329 5 10 CBBE CN(C)[C@H]1CN(c2nccc(N)c2[N+](=O)[O-])C[C@H]1O 2089923146 MVXWJJOFHMJYPE-DTWKUNHWSA-N 267.289 -0.317 5 10 CBBE CCN=c1nc(N2C[C@H](F)[C@H](O)C2)c([N+](=O)[O-])c[nH]1 2092832707 NHGLHEXFWHJWLN-POYBYMJQSA-N 271.252 -0.243 5 10 CBBE CN(CCN1CCNCC1)c1nc([N+](=O)[O-])nn1C 2102933086 STMQBIPFCWPHRC-UHFFFAOYSA-N 269.309 -0.935 5 10 CBBE CN1C[C@@H](CCN=c2nc([N+](=O)[O-])[nH]n2C)CC1=O 2102937277 QEEJPRDJEPXQMS-ZETCQYMHSA-N 268.277 -0.575 5 10 CBBE CN(C)C(=O)C1(Nc2ncnc(N)c2[N+](=O)[O-])CC1 2103576523 XVWSFACAKTVWDP-UHFFFAOYSA-N 266.261 0.000 5 10 CBBE O=[N+]([O-])c1ccc(Cl)nc1N[C@@H]1C[C@H](O)[C@H](O)[C@H]1O 2108826409 VRCTWOZYKFPKAP-OEOXLLKZSA-N 289.675 -0.090 5 10 CBBE CCN=c1nc(N(C)C2CNC2)c([N+](=O)[O-])c(C)[nH]1 2117227101 GNHPVWPTBNAJDH-UHFFFAOYSA-N 266.305 -0.045 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCCC[C@H]2N)[nH]1 2117264111 VNZOQWQMCXVKAS-HTQZYQBOSA-N 266.305 -0.048 5 10 CBBE C[C@@H](O)[C@H]1CN(c2ncnc(N)c2[N+](=O)[O-])CCO1 2117543764 DITPSYOWGAPRPD-RNFRBKRXSA-N 269.261 -0.447 5 10 CBBE Nc1[nH]c(=NC2[C@@H]3CS(=O)(=O)C[C@@H]23)ccc1[N+](=O)[O-] 2118018874 RLDGMTNGYVLQTR-PHDIDXHHSA-N 284.297 -0.551 5 10 CBBE Nc1ccnc(N2CC[C@@H](CO)[C@@H](N)C2)c1[N+](=O)[O-] 2122329798 COZKSCGYMAOVAG-CBAPKCEASA-N 267.289 -0.282 5 10 CBBE C[C@@H]1CNC[C@@H](CCN=c2[nH]n(C)cc2[N+](=O)[O-])O1 2124753541 XNSUZICPVGRVPC-RKDXNWHRSA-N 269.305 -0.071 5 10 CBBE Cc1nccc(O[C@@]2(C(N)=O)CCNC2)c1[N+](=O)[O-] 2126954469 AZYJXQUFNNSSMF-NSHDSACASA-N 266.257 -0.106 5 10 CBBE CN=c1[nH]c(OC[C@H]2COCCN2)ncc1[N+](=O)[O-] 2128111138 WXHSPCLCYLDRSA-SSDOTTSWSA-N 269.261 -0.784 5 10 CBBE COc1ncnc(OC[C@@]23CO[C@@H](CN2)C3)c1[N+](=O)[O-] 2151057599 CUXMRMDNRONCKR-RDDDGLTNSA-N 282.256 -0.097 5 10 CBBE Cn1c(=O)n(C)n(Cc2ccc([N+](=O)[O-])c(N)c2)c1=O 2155867807 VSUPMZVCFPBSQL-UHFFFAOYSA-N 279.256 -0.576 5 10 CBBE C[C@H](N=c1[nH]c(F)ncc1[N+](=O)[O-])C1(O)CCNCC1 2162372307 YDVQDRVOJLPGLX-ZETCQYMHSA-N 285.279 -0.139 5 10 CBBE NNc1ncnc(N2CC(=O)N[C@H]3CC[C@@H]32)c1[N+](=O)[O-] 2168358395 CRJIDFQROICAPZ-WDSKDSINSA-N 279.260 -0.862 5 10 CBBE CO[C@@H]1C[C@H](CN)N(c2nc(=N)[nH]c(C)c2[N+](=O)[O-])C1 2173803555 FFAJOKXEYOLXQB-HTQZYQBOSA-N 282.304 -0.342 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2CCNC[C@H]2F)[nH]1 2173891783 ICOXEKCBRRUSHV-SFYZADRCSA-N 284.295 -0.309 5 10 CBBE COCC[C@@]1(Nc2nc(=N)[nH]cc2[N+](=O)[O-])CCNC1 2174042893 XUOFTQPIJLXZAT-NSHDSACASA-N 282.304 -0.022 5 10 CBBE CO[C@H]1C[C@@H](CN=c2nc([N+](=O)[O-])[nH]n2C)C[C@H]1OC 2174852794 YOELZHZZKXRLHR-AYMMMOKOSA-N 285.304 -0.003 5 10 CBBE O=C1N[C@@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@H]2O1 2176920587 MEWURHDHDUTQCB-HTQZYQBOSA-N 281.228 -0.890 5 10 CBBE CO[C@@H]1COC[C@H]1N=c1[nH]c(NN)nc(C)c1[N+](=O)[O-] 2177273905 GECJSEHRNJSXSR-RNFRBKRXSA-N 284.276 -0.774 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)N[C@]1(CO)CCNC1 2190272657 DIDIKWGLXHKMLO-GFCCVEGCSA-N 282.300 -0.130 5 10 CBBE Cn1c(C(=O)N2C[C@H](O)[C@H](O)[C@@H]2CF)ccc1[N+](=O)[O-] 2205607895 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GVJFXXAOYMYOJE-UHFFFAOYSA-N 253.262 -0.064 5 10 CBBE CCCc1ncc([N+](=O)[O-])c(=N[C@H](CN)CO)[nH]1 2258647456 XYQUXZHULSCCGD-SSDOTTSWSA-N 255.278 -0.509 5 10 CBBE CO[C@@H]1[C@@H](O)C[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 2271155936 LUULISDPQFFPEN-FWWHASMVSA-N 270.245 -0.944 5 10 CBBE Cc1[nH]c(=N)nc(OCCCS(C)(=O)=O)c1[N+](=O)[O-] 2278334886 BMRYBGBIGIUNEN-UHFFFAOYSA-N 290.301 -0.081 5 10 CBBE COCc1ncc([N+](=O)[O-])c(O[C@@H]2COC[C@@H]2CN)n1 2286639850 RRFQVFTUCMOXKK-IONNQARKSA-N 284.272 -0.116 5 10 CBBE O=C1COC2(CN1)CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)C2 2289725058 NXOGJKHTAQHZET-UHFFFAOYSA-N 280.240 -0.736 5 10 CBBE CN1C[C@H](O)[C@@H](N=c2ccn3ncc([N+](=O)[O-])c3[nH]2)C1 2295917863 KCLMEELXQONFKJ-CBAPKCEASA-N 278.272 -0.854 5 10 CBBE Cn1[nH]c(=NCCCn2cnnc2)nc1[N+](=O)[O-] 2321694959 WHAJJGUXAKEPQD-UHFFFAOYSA-N 252.238 -0.761 5 10 CBBE C[C@@H]1CNCC[C@@](C(=O)O)(N2CC([N+](=O)[O-])C2)C1 2323716022 ASOQANYVVKQBJP-GZMMTYOYSA-N 257.290 -0.210 5 10 CBBE CN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H]1CNC[C@@H]1F 2343618825 QWZCVDIUGUTWEX-BQBZGAKWSA-N 271.252 -0.290 5 10 CBBE NNc1cc([N+](=O)[O-])cc(=NCC[C@@H](O)CCO)[nH]1 2351733925 CKEVHIRUTDHQRA-MRVPVSSYSA-N 271.277 -0.757 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H]2[C@@H]3CCOC[C@@H]32)[nH]1 2355946405 DSSJPQSIQYIVGI-CIUDSAMLSA-N 279.300 -0.035 5 10 CBBE O=C(NCCO)C(=O)Nc1ccccc1[N+](=O)[O-] 5251396 IDOCQEBXUDNDIS-UHFFFAOYSA-N 253.214 -0.358 5 10 CBBE COC(=O)CN(C)C(=O)CCn1cnc([N+](=O)[O-])c1 35221212 FVYIUDRTVMMNKI-UHFFFAOYSA-N 270.245 -0.187 5 10 CBBE Cc1nn(CC(=O)N[C@@H](C)C(=O)O)c(C)c1[N+](=O)[O-] 37417976 FULQVUZWRFAXNR-LURJTMIESA-N 270.245 -0.003 5 10 CBBE C[C@H](NC(=O)[C@H](N)CC(N)=O)c1cccc([N+](=O)[O-])c1 37766570 HNFAMWLENGGYGE-OIBJUYFYSA-N 280.284 -0.025 5 10 CBBE Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC(CO)CO 87752421 BNSGBYMONAXIFE-UHFFFAOYSA-N 290.297 -0.465 5 10 CBBE Cn1c(C(=O)N(CC(=O)O)CC(=O)O)ccc1[N+](=O)[O-] 110967064 YNUAUIYFAZMKLP-UHFFFAOYSA-N 285.212 -0.455 5 10 CBBE CC[C@@H]1C(=O)NC(=O)CN1c1nc(NN)ccc1[N+](=O)[O-] 161134764 CQQROPYTSMDZSY-ZCFIWIBFSA-N 294.271 -0.483 5 10 CBBE O=C1CC[C@@H](Nc2ncc(C(=O)O)cc2[N+](=O)[O-])C(=O)N1 162450350 KYKNKGPOFYSEEF-ZCFIWIBFSA-N 294.223 -0.095 5 10 CBBE NC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1C(=O)O 228772552 QDDDNMOBEJOICQ-MRVPVSSYSA-N 269.213 -0.449 5 10 CBBE CC(C)N(CC(N)=O)c1nc(NN)ncc1[N+](=O)[O-] 232650303 JRFAOVUOKWVCQU-UHFFFAOYSA-N 269.265 -0.630 5 10 CBBE O=C1CN(C(=O)c2cc(Cl)ncc2[N+](=O)[O-])CC(=O)N1 236071617 STCXPJWMKAACFS-UHFFFAOYSA-N 298.642 -0.258 5 10 CBBE O=C(NC(C(=O)O)C(=O)O)c1cccc([N+](=O)[O-])c1 311498806 WJHSCGUKGKIVGR-UHFFFAOYSA-N 268.181 -0.138 5 10 CBBE C[C@@](N)(CO)COc1ccc(C(N)=O)cc1[N+](=O)[O-] 404100380 WODXQBWMKNBTOG-LLVKDONJSA-N 269.257 -0.218 5 10 CBBE CCC(=O)N1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 425038588 QCQKBWOSKZEYQZ-UHFFFAOYSA-N 281.272 -0.020 5 10 CBBE C[C@H]1C(=O)N(C)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 592190770 RBWGTTBXNPHISY-WCBMZHEXSA-N 283.288 -0.728 5 10 CBBE CN(C[C@H]1COCCO1)c1ncc([N+](=O)[O-])cc1C(N)=O 596460473 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5 10 CBBE C[C@@]1(O)CCN(c2cc([N+](=O)[O-])cc(=N)[nH]2)C[C@H]1O 1893310918 HDELLRZIGNUHAR-LDYMZIIASA-N 268.273 -0.276 5 10 CBBE CNc1cc(NCC(O)(CO)CO)cc([N+](=O)[O-])c1 1913800621 MGCMXOULIUPIEK-UHFFFAOYSA-N 271.273 -0.236 5 10 CBBE Cc1ccc([N+](=O)[O-])cc1C(=O)NC1(CO)CNC1 1918429418 KOKCITHKJQNIER-UHFFFAOYSA-N 265.269 -0.033 5 10 CBBE CN(C)[C@@H]1COC[C@H]1N=c1[nH]n(C)cc1[N+](=O)[O-] 1921769352 PZJGMNJPOKFUJR-VXNVDRBHSA-N 255.278 -0.509 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@@H]2COC[C@H]2N(C)C)c1[N+](=O)[O-] 1922027284 ISTRGFVCNOCSQB-HTQZYQBOSA-N 282.304 -0.731 5 10 CBBE CN(C)[C@@H]1COC[C@@H]1N=c1ccc(N)c([N+](=O)[O-])[nH]1 1922039425 JQWCZEJCYGVEEY-DTWKUNHWSA-N 267.289 -0.265 5 10 CBBE O=C(NN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@@H]1[N+](=O)[O-] 1923196257 VGYNQYDEZSJBTR-BDAKNGLRSA-N 275.220 -0.021 5 10 CBBE O=[N+]([O-])c1cnc(Cl)[nH]c1=NCC1(O)CNC1 1998988808 CEVCGLYRUINQSC-UHFFFAOYSA-N 259.653 -0.794 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)C[C@H]2OCC[C@H]21 2029331234 VWIPTAOFHLIWOM-KCRUCZTKSA-N 254.202 -0.225 5 10 CBBE Cc1cc([N+](=O)[O-])nn1C[C@@]1(O)CNCCOC1 2039075807 NMNLHWWMDFHKHG-JTQLQIEISA-N 256.262 -0.549 5 10 CBBE Cn1nc([N+](=O)[O-])nc1O[C@@H]1CCO[C@@H](CN)C1 2041250198 CAOIIRRAJXDMCO-RNFRBKRXSA-N 257.250 -0.392 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=NCCCN)[nH]1 2053600020 OZLQNBHYEXBMPF-UHFFFAOYSA-N 254.294 -0.270 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@H]1[C@H]2CS(=O)(=O)C[C@H]21 2054300597 BSNLVCUSCCTFKT-UQWHLADISA-N 272.286 -0.217 5 10 CBBE NC(=O)C1(Oc2ncc([N+](=O)[O-])cc2Cl)CNC1 2056346160 KLLOFBJVLTUEQY-UHFFFAOYSA-N 272.648 -0.151 5 10 CBBE CN=c1[nH]c(N2CC[C@@H]2[C@@H](C)O)ncc1[N+](=O)[O-] 2061818874 UBWGENKNUKAWKP-RNFRBKRXSA-N 253.262 -0.192 5 10 CBBE Cc1c([N+](=O)[O-])c(O[C@H]2COC[C@@H]2CN)nn1C 2086316674 KJJLBFXEQRYDEC-YUMQZZPRSA-N 256.262 -0.011 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCCc2ccon2)[nH]1 2090420119 DLKJJKIMBTWFJT-UHFFFAOYSA-N 264.245 -0.087 5 10 CBBE Cn1cc([N+](=O)[O-])c(CSc2nc(=N)[nH]c(=N)[nH]2)n1 2102862340 XOGYUNVLUHGARG-UHFFFAOYSA-N 282.289 -0.369 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC[C@](CO)(C(=O)O)C1 2103681329 XEVJTNHMKUKHPK-JTQLQIEISA-N 270.245 -0.398 5 10 CBBE COC(=O)[C@@H]1C[C@H](Oc2ncc([N+](=O)[O-])cn2)CN1 2110860615 HTGXPDLOXCPFOW-YUMQZZPRSA-N 268.229 -0.333 5 10 CBBE Nc1cc[nH]c(=NCC[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 2111336280 NIQXKRAGXZMISZ-APPZFPTMSA-N 268.273 -0.197 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1CC[C@@]12C[C@@H]2C(=O)O 2115865417 VHINIJADMFDCMK-DGAHNEANSA-N 267.245 -0.190 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC[C@]2(F)C[C@H](CN)C2)[nH]1 2117126053 RZZWZSCTKAVWOG-HDKIZWTHSA-N 270.268 -0.292 5 10 CBBE NC[C@H]1C[C@](F)(CN=c2[nH]cnc(N)c2[N+](=O)[O-])C1 2117126491 BAMRLAKSIFSTML-XGAOUMNUSA-N 270.268 -0.122 5 10 CBBE C[C@@]1(CO)CNCCN1c1ccc(N)c([N+](=O)[O-])n1 2117172171 FQMXLGAOJHIMIC-NSHDSACASA-N 267.289 -0.267 5 10 CBBE COc1cc(O[C@H](CN)C(N)=O)c(F)cc1[N+](=O)[O-] 2119763243 HCVUQYXDQOLILP-SECBINFHSA-N 273.220 -0.066 5 10 CBBE NS(=O)(=O)NCCNCc1cc([N+](=O)[O-])ccc1F 2120386465 LILYQXSSCMGPHI-UHFFFAOYSA-N 292.292 -0.383 5 10 CBBE O=C(O)c1nn(CCN2CCNCC2)cc1[N+](=O)[O-] 2123093400 DAMHSGSVOULPSG-UHFFFAOYSA-N 269.261 -0.605 5 10 CBBE NC(=O)c1ccc(NCC[C@H](O)CO)c([N+](=O)[O-])c1 2125814634 AYMGCAKZOFCVKT-QMMMGPOBSA-N 269.257 -0.151 5 10 CBBE Cc1nn(C)c(N2C[C@H](O)CC23CNC3)c1[N+](=O)[O-] 2130059727 BPAINOKXQXMVFL-MRVPVSSYSA-N 267.289 -0.450 5 10 CBBE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cn1)N1CC(N)C1 2137722031 SDHCUNDMRGZNNP-SSDOTTSWSA-N 265.273 -0.040 5 10 CBBE Nc1ccnc(N2C[C@@H](CO)[C@H](CCO)C2)c1[N+](=O)[O-] 2149912471 DHBFFAIRGAJEHZ-BDAKNGLRSA-N 282.300 -0.001 5 10 CBBE CN(c1nc(NN)ncc1[N+](=O)[O-])[C@@H]1CN2CC[C@H]1C2 2158725300 FMZCLDYNJCMDGY-IONNQARKSA-N 279.304 -0.189 5 10 CBBE CN=c1[nH]c(N2CC[C@@H](C3CNC3)C2)ncc1[N+](=O)[O-] 2173846759 SUODJSPNAAXDFM-MRVPVSSYSA-N 278.316 -0.106 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2CNC[C@H]2C)[nH]1 2174007571 VUSSIMLDASCQFP-APPZFPTMSA-N 280.332 -0.011 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=N[C@H]2CCC[C@H]2C(N)=O)[nH]1 2174110891 RGOSZDRNXGJNEI-RITPCOANSA-N 281.276 -0.842 5 10 CBBE COc1ccc(OCC(CO)(CO)CO)cc1[N+](=O)[O-] 2179739827 DFJNUMKWZBRRBH-UHFFFAOYSA-N 287.268 -0.055 5 10 CBBE CO[C@@H]1CCN(c2nc([N+](=O)[O-])nn2C)[C@@H](C(=O)O)C1 2187838489 QBVFSUXFQGRFOZ-RNFRBKRXSA-N 285.260 -0.208 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](C(=O)O)C(C)(C)O 2188035691 DTUYRCTVIHNPHH-SSDOTTSWSA-N 286.244 -0.718 5 10 CBBE NC(=O)[C@H]1C[C@@H](N)CN(c2ccc([N+](=O)[O-])cc2N)C1 2191583785 PRMIZBVMZOHJQN-JGVFFNPUSA-N 279.300 -0.184 5 10 CBBE NC(=O)N1C[C@H]2C[C@H]1CN2c1ncnc(F)c1[N+](=O)[O-] 2192237343 YQHZVARKYGLJPF-RITPCOANSA-N 282.235 -0.135 5 10 CBBE CN1C(=O)O[C@H]2CN(Cc3nn(C)cc3[N+](=O)[O-])C[C@@H]21 2196036342 HAOCCYOTZWTVFH-UWVGGRQHSA-N 281.272 -0.037 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](O)[C@H](O)[C@@H]1CO 2200871903 GFBKOPPJQPXCSU-XHNCKOQMSA-N 286.288 -0.978 5 10 CBBE CCn1ncc([N+](=O)[O-])c1NC[C@H](C)S(N)(=O)=O 2223835447 KZEXNPBNIPAAPD-LURJTMIESA-N 277.306 -0.100 5 10 CBBE CCNCc1nnnn1Cc1nn(C)cc1[N+](=O)[O-] 2231921401 TWXUKDAICKCKOC-UHFFFAOYSA-N 266.265 -0.527 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC2(C(N)=O)CCNCC2)[nH]1 2239045901 NIHUNVAHTPCGAG-UHFFFAOYSA-N 282.304 -0.748 5 10 CBBE CCn1ncc([N+](=O)[O-])c1OC1CNCCNC1 2259379123 DWQYBLOFWHNREL-UHFFFAOYSA-N 255.278 -0.249 5 10 CBBE CN1CCN(C)[C@H](Cc2ncc([N+](=O)[O-])c(O)n2)C1 2271073238 SIBLQPHXEGQXSC-MRVPVSSYSA-N 267.289 -0.121 5 10 CBBE CO[C@@H]1[C@H](O)C[C@H]1Nc1ncnc(NN)c1[N+](=O)[O-] 2271180520 BHNNTCNQLLDSHG-XAHCXIQSSA-N 270.249 -0.770 5 10 CBBE C[C@@H](O)[C@@H](CO)N=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2278407246 QUKBADOBUYULFW-RNFRBKRXSA-N 267.245 -0.787 5 10 CBBE CN=c1[nH]c(N2CC[C@H](O)[C@H](O)CC2)ncc1[N+](=O)[O-] 2284558390 UYDODSKZQMDFMP-DTORHVGOSA-N 283.288 -0.830 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@H](C)C(=O)N(C)C)[nH]1 2286648275 INSCHJYNPCCGTR-SSDOTTSWSA-N 283.288 -0.158 5 10 CBBE CO[C@@H](C)[C@H](N=c1nc([N+](=O)[O-])n(C)[nH]1)C(=O)O 2321762858 FISACBODHIBDPK-WHFBIAKZSA-N 259.222 -0.955 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@@H]2C[C@@H]3CN[C@H]2C3)c1[N+](=O)[O-] 2330450080 DBIAQQSJVAYXNY-GJMOJQLCSA-N 264.289 -0.310 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)C[C@H]2C[C@@H]2CN)n1 2335802085 YZILNVHBVPZRCE-HTQZYQBOSA-N 267.289 -0.071 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2C[C@@H]3[C@H](C2)CS3(=O)=O)[nH]1 2336397623 NVXKCOJXYTYRMJ-HTRCEHHLSA-N 284.297 -0.364 5 10 CBBE COC1CN(CCN=c2ccc(N)c([N+](=O)[O-])[nH]2)C1 2340014643 RKWSIFYQRMGRAU-UHFFFAOYSA-N 267.289 -0.264 5 10 CBBE NC(=O)C[C@H]1CNCCN1c1cccc([N+](=O)[O-])n1 2343303240 VEIUKYGLUSLYSP-QMMMGPOBSA-N 265.273 -0.357 5 10 CBBE Cn1[nH]c(=N[C@H]2CCc3nccn3C2)nc1[N+](=O)[O-] 2344960542 NJYZFSZKHIZDMW-ZETCQYMHSA-N 263.261 -0.231 5 10 CBBE Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H](O)C1 61713784 HQPFVJNUVUQAOR-QMMMGPOBSA-N 287.297 -0.068 5 10 CBBE CN(Cc1nc[nH]n1)C(=O)CCn1cnc([N+](=O)[O-])c1 80523893 CGKDMVWWWDRBJI-UHFFFAOYSA-N 279.260 -0.042 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1CN1CC(=O)NC(=O)C1 97270725 YIDJMNQIPKQYNY-UHFFFAOYSA-N 279.256 -0.661 5 10 CBBE Nc1c(C(=O)N2C[C@@H](O)[C@H](O)C2)cc(F)cc1[N+](=O)[O-] 222970370 LBNVKOMZCBHEKA-RKDXNWHRSA-N 285.231 -0.506 5 10 CBBE O=C(NC[C@@H](O)CO)c1cc([N+](=O)[O-])cnc1Cl 236514548 FVRXXKHOEDGNCF-ZCFIWIBFSA-N 275.648 -0.274 5 10 CBBE O=C(NC[C@H]1CNC[C@@H]1O)c1cccc([N+](=O)[O-])c1 262260122 MDUZPJPXRDBHJX-KOLCDFICSA-N 265.269 -0.095 5 10 CBBE CN(c1nc(Cl)ncc1[N+](=O)[O-])C(CO)CO 310368187 WEQLWRNUPOSEQE-UHFFFAOYSA-N 262.653 -0.172 5 10 CBBE NC(=O)[C@]1(O)CCN(c2ccc([N+](=O)[O-])c(N)c2)C1 311539618 NBDYWIYJGWARER-NSHDSACASA-N 266.257 -0.397 5 10 CBBE Cc1cc(N)c([N+](=O)[O-])cc1C(=O)N[C@H]1COC[C@H]1O 323195158 IWTYIVNSMRXLNK-GXSJLCMTSA-N 281.268 -0.025 5 10 CBBE COc1c(C(=O)NC[C@H](N)C(=O)O)cccc1[N+](=O)[O-] 323352586 AYQPWURIPIUIRK-ZETCQYMHSA-N 283.240 -0.255 5 10 CBBE Nc1ncnc(N2CCN3C[C@@H](O)C[C@H]3C2)c1[N+](=O)[O-] 405310560 ONDZMSORRDONBS-YUMQZZPRSA-N 280.288 -0.778 5 10 CBBE O=C(N[C@@H]1C[C@H]1CO)c1cc([N+](=O)[O-])cnc1O 562492408 OWZMUPBQDNMXPE-YLWLKBPMSA-N 253.214 -0.194 5 10 CBBE O=[N+]([O-])c1cccnc1S(=O)(=O)N[C@H](CO)CCF 594793981 GSYOKQKFWBZZES-ZETCQYMHSA-N 293.276 -0.011 5 10 CBBE NS(=O)(=O)CCCNc1nc(F)ncc1[N+](=O)[O-] 689027839 YHGCSGXPXAQYII-UHFFFAOYSA-N 279.253 -0.386 5 10 CBBE CN1CCN(c2ccnc(O)c2[N+](=O)[O-])[C@H](CN)C1 695447919 FBZKHNADSWPMJL-MRVPVSSYSA-N 267.289 -0.226 5 10 CBBE NCC(CN)NC(=O)COc1ccc([N+](=O)[O-])cc1 700647104 WTEQPXKEOZKZNO-UHFFFAOYSA-N 268.273 -0.624 5 10 CBBE CN(C)C[C@H](CO)Nc1ncnc(F)c1[N+](=O)[O-] 716774855 JLKGMKJKVVIMNW-ZCFIWIBFSA-N 259.241 -0.142 5 10 CBBE CO[C@@H]1CC[C@@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 724209781 NMFUPUJIVRKSMD-OUAUKWLOSA-N 270.289 -0.081 5 10 CBBE CCOC(=O)[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839690068 BYSUMVZOLJGKIQ-IWSPIJDZSA-N 272.257 -0.558 5 10 CBBE COC(=O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1290575544 SSIJOFLCIZFAFC-UHFFFAOYSA-N 269.213 -0.954 5 10 CBBE C[C@H](CO)CCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1319531275 NCEPBGHNNWZMFO-QMMMGPOBSA-N 271.277 -0.289 5 10 CBBE 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CBBE COCCOCCN(C)c1ncnc(NN)c1[N+](=O)[O-] 313515236 MZGKYMSNFQOHTN-UHFFFAOYSA-N 286.292 -0.230 5 10 CBBE NNc1ccc(CN2CC[C@@](O)(CO)C2)cc1[N+](=O)[O-] 314105927 DPXOBQKTIAGDCJ-LBPRGKRZSA-N 282.300 -0.191 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H](O)[C@H](CO)C1 317333835 CPBFISHALDMCOF-POYBYMJQSA-N 255.230 -0.652 5 10 CBBE NNc1c(C(=O)N[C@@H]2COC[C@@H]2O)cccc1[N+](=O)[O-] 323214571 OMCUTRFCCSQRKM-APPZFPTMSA-N 282.256 -0.630 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[C@@H]1O 323739478 QXSCWGIVJHCOTM-APPZFPTMSA-N 281.272 -0.081 5 10 CBBE CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 344578152 INEHIJIIPLPQIS-HTQZYQBOSA-N 299.287 -0.110 5 10 CBBE COC(=O)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 362670282 MTPXLYYVSSWWIX-MRVPVSSYSA-N 283.244 -0.746 5 10 CBBE O=[N+]([O-])c1sc(CO)cc1N1C[C@@H](O)[C@@H](CO)C1 404509109 OGYWBSRSPMAQCO-HZGVNTEJSA-N 274.298 -0.062 5 10 CBBE O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN2C[C@@H](O)C[C@@H]2C1 405303587 JUIQRXQUZXIXBQ-ZJUUUORDSA-N 280.284 -0.186 5 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O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1C[C@H](O)C2(CC2)C1 1320776615 ZDZMDWXVLYNRSC-NSHDSACASA-N 293.279 -0.260 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](CO)C1 1466636124 XQOAYDYUJKSAIJ-ZETCQYMHSA-N 254.246 -0.217 5 10 CBBE CCOCC(=O)N1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1536354524 BETWVCYUPLQHNL-NXEZZACHSA-N 285.300 -0.643 5 10 CBBE C[C@@]1(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCNC1=O 1558548452 XLQNCTDFCCVAON-GFCCVEGCSA-N 294.267 -0.849 5 10 CBBE COc1nn(C)cc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1558743677 MLASADWBRBJLBD-UHFFFAOYSA-N 280.244 -0.010 5 10 CBBE Cc1[nH]nc(C(=O)N2CC(=O)N[C@@H](C)C2)c1[N+](=O)[O-] 1641000171 KSUCELVMOZTCGO-YFKPBYRVSA-N 267.245 -0.413 5 10 CBBE O=C1NC(=O)[C@H]2CN(c3ccncc3[N+](=O)[O-])C[C@@H]12 1651081989 TUQJOGMNXLSSDB-KNVOCYPGSA-N 262.225 -0.301 5 10 CBBE NC(=O)[C@@H]1CN(CC(=O)c2ccc([N+](=O)[O-])cc2)CCO1 1849138942 MUPVIYGVIXFRNJ-LBPRGKRZSA-N 293.279 -0.036 5 10 CBBE O=C(O)Cn1cc(CN=c2cccc([N+](=O)[O-])[nH]2)nn1 1925593378 JHRLACLTOSLJRN-UHFFFAOYSA-N 278.228 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O=C(O)[C@@H]1C[C@@H](NC(=O)N2CC([N+](=O)[O-])C2)[C@@H]2C[C@H]12 2332126019 RPWTUBHJBLBFEQ-JQCXWYLXSA-N 269.257 -0.234 5 10 CBBE Cc1nc(N2C[C@@H](O)[C@@H](O)[C@@H]2CO)ccc1[N+](=O)[O-] 2332888663 HNBIQCIEVNCZPZ-NGZCFLSTSA-N 269.257 -0.799 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCCC[C@H]2C(N)=O)nc1[N+](=O)[O-] 2344956406 AKNRTEYANSNTHB-RNFRBKRXSA-N 268.277 -0.399 5 10 CBBE Cn1nc(OC2CCN(CCN)CC2)nc1[N+](=O)[O-] 2344958353 RVZZSCXOFHTUBX-UHFFFAOYSA-N 270.293 -0.475 5 10 CBBE Cn1[nH]c(=N[C@@H]2CC[C@@H]3CNC[C@@H]3C2)nc1[N+](=O)[O-] 2345007093 WCKPNTDCHUTKPL-HRDYMLBCSA-N 266.305 -0.055 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H](O)[C@H]2COC[C@H]21 2354369267 NCIIFNOSEDWMML-DJLDLDEBSA-N 282.256 -0.991 5 10 CBBE O=C1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C(=O)N1 89754567 BOVHXJBWUIPFRD-YFKPBYRVSA-N 267.197 -0.277 5 10 CBBE Cn1cc([N+](=O)[O-])c(=O)n(Cc2cccc(N)n2)c1=O 92372322 RMTSGJYGDADOSS-UHFFFAOYSA-N 277.240 -0.519 5 10 CBBE COc1ncnc(N2CCOC[C@H]2C(=O)O)c1[N+](=O)[O-] 94738480 UAOFHSDYMKDWCK-LURJTMIESA-N 284.228 -0.317 5 10 CBBE NNc1c(C(=O)NCC(=O)NC2CC2)cccc1[N+](=O)[O-] 161557300 QKNCCWJFGZSCRY-UHFFFAOYSA-N 293.283 -0.111 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1C(=O)NCCn1ccnn1 168030624 JYKFKJOWOXIXAT-UHFFFAOYSA-N 291.271 -0.098 5 10 CBBE CNc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)C(N)=O 234604777 KOROHXXHQDUZGR-RXMQYKEDSA-N 267.245 -0.365 5 10 CBBE O=C(O)CNS(=O)(=O)c1cncc([N+](=O)[O-])c1 310300284 QDUJZRSAVNMXQK-UHFFFAOYSA-N 261.215 -0.647 5 10 CBBE NCC(=O)NCC(=O)Nc1ccc([N+](=O)[O-])c(F)c1 311257521 ZLBJHCRGXHUUQD-UHFFFAOYSA-N 270.220 -0.253 5 10 CBBE O=C(Cc1ccccc1[N+](=O)[O-])N1CCNC[C@H](O)C1 312488729 VTLZIPABOFTVCI-NSHDSACASA-N 279.296 -0.070 5 10 CBBE Nc1nc(N2C[C@H](O)C3(CC3)C2)ncc1[N+](=O)[O-] 368800590 PTHBMFPQPPFDFO-ZETCQYMHSA-N 251.246 -0.072 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCNC(=O)CC1 602772693 NJRZQUAMWQKRQU-UHFFFAOYSA-N 267.289 -0.078 5 10 CBBE Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)nn1 611956474 KRFVJRKNTIVIJG-UHFFFAOYSA-N 250.218 -0.019 5 10 CBBE CNc1ncnc(N2C[C@H](CO)[C@@H](CO)C2)c1[N+](=O)[O-] 704801733 KQIKXFHQNVKAGS-HTQZYQBOSA-N 283.288 -0.537 5 10 CBBE Cc1nc(NN)nc(N[C@@H]2CCOC[C@@H]2O)c1[N+](=O)[O-] 707037942 UHDVGLLKDIHGHX-RQJHMYQMSA-N 284.276 -0.459 5 10 CBBE Cc1nc(NN)nc(N(C)[C@H]2COC[C@@H]2O)c1[N+](=O)[O-] 708216782 QVKFWMHBSPOTJK-BQBZGAKWSA-N 284.276 -0.825 5 10 CBBE O=[N+]([O-])c1c(N[C@H]2CCNC[C@@H]2O)ccnc1O 710494988 ZIHDPMPHAIUKCE-XPUUQOCRSA-N 254.246 -0.170 5 10 CBBE Nc1nc(NCC2(S(N)(=O)=O)CC2)ccc1[N+](=O)[O-] 713999268 FHRKRBURWDUMBU-UHFFFAOYSA-N 287.301 -0.195 5 10 CBBE O=[N+]([O-])c1ncccc1CN(CCO)CCOCCO 1171018114 MWANBSKBZWVVEG-UHFFFAOYSA-N 285.300 -0.207 5 10 CBBE COC(=O)[C@@]1(O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 1175669346 MXOGDTFKTHCPEN-LLVKDONJSA-N 284.272 -0.599 5 10 CBBE COC(CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)OC 1181379208 OWHAWCKMUVYEMS-UHFFFAOYSA-N 270.245 -0.079 5 10 CBBE C[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC(=O)N1 1307122711 KBUMWLPZMQCZAG-LURJTMIESA-N 279.256 -0.587 5 10 CBBE CC(=O)OC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cn1 1321216083 MYHLRTOKILNKGT-MRVPVSSYSA-N 283.240 -0.356 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NCC2(C)OCCO2)n1 1323304069 UAKIVZQYGQGFNF-UHFFFAOYSA-N 270.245 -0.179 5 10 CBBE C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCN1C 1543430240 HSJRXMJHIAKOOX-VIFPVBQESA-N 267.289 -0.046 5 10 CBBE CS(=O)(=O)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1545351414 RVMSNFNZYYKZFV-RKDXNWHRSA-N 276.314 -0.313 5 10 CBBE O=C(NCCn1cc([N+](=O)[O-])cn1)c1cnncc1O 1566321103 IUBBWPLHQGHSCQ-UHFFFAOYSA-N 278.228 -0.283 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2COCCC2=O)n1 1586557582 XVGKVCBZHLDVKM-ZCFIWIBFSA-N 268.229 -0.584 5 10 CBBE O=C1C[C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CN1 1626526718 NGFVRXBAMXVMMJ-YFKPBYRVSA-N 253.218 -0.816 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)NCCC(=O)NC)n1 1628194311 SYEWCEDHUBRNMT-UHFFFAOYSA-N 269.261 -0.323 5 10 CBBE O=C(NCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cc[nH]c1 1720273357 VZUDFMDJEMUNIM-NXEZZACHSA-N 280.284 -0.084 5 10 CBBE COC1CN(C(=O)c2cc([N+](=O)[O-])c(=O)n(C)c2)C1 1890076464 JBQGTUFQNCHGMU-UHFFFAOYSA-N 267.241 -0.236 5 10 CBBE C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)C1(O)CNC1 1918666741 GXQUUYVVGFWHNX-VIFPVBQESA-N 279.296 -0.024 5 10 CBBE Cc1nc([N+](=O)[O-])cn1[C@@]1(C(=O)O)COC[C@@H]1N 1919719483 JLOWRFUFGUBGAL-RCOVLWMOSA-N 256.218 -0.763 5 10 CBBE CN(C)[C@@H]1COC[C@@H]1CN=c1[nH]c(F)ncc1[N+](=O)[O-] 1924951462 HULJXEWDNCTCDZ-IONNQARKSA-N 285.279 -0.066 5 10 CBBE COC[C@@](C)(CO)CN=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 1926980290 VAEXXKQNVYSSDF-SNVBAGLBSA-N 271.277 -0.724 5 10 CBBE CN1C[C@H](O)[C@@H](Nc2cc([N+](=O)[O-])cc(=N)[nH]2)C1 2029887304 LSHZVOUNVITXHD-YUMQZZPRSA-N 253.262 -0.511 5 10 CBBE CO[C@H]1C[C@H](CN)N(c2ncc([N+](=O)[O-])cn2)C1 2030288667 QAEVJEKGOZMHNU-APPZFPTMSA-N 253.262 -0.063 5 10 CBBE NC(=O)N1CC(Nc2cc(N)c([N+](=O)[O-])cn2)C1 2047192799 BSCVHWAHLWUCHQ-UHFFFAOYSA-N 252.234 -0.253 5 10 CBBE O=C(O)[C@H]1C[C@@H](Oc2ncc([N+](=O)[O-])cn2)CN1 2048289347 HNUYQWQCIFDXID-RNFRBKRXSA-N 254.202 -0.421 5 10 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253.258 -0.131 5 10 CBBE C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(NN)c1)c1nnn[nH]1 54415684 ZKPCWHNPFVBWAU-YFKPBYRVSA-N 292.259 -0.116 5 10 CBBE Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCc1nc[nH]n1 80651509 PVUQYZYXLRBVOT-UHFFFAOYSA-N 298.284 -0.226 5 10 CBBE COc1ccc(C(=O)NC[C@@H](O)CO)cc1[N+](=O)[O-] 90280084 NYUMDKOWKGGLPA-MRVPVSSYSA-N 270.241 -0.314 5 10 CBBE CC(C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cnc1=O 128686691 XQHZDJBCYOCFJE-SECBINFHSA-N 256.262 -0.490 5 10 CBBE Cn1c(=O)nc2n(CCO)c3ccccc3nc-2c1=O 137646439 CTKAYBMAXADMMS-UHFFFAOYSA-N 272.264 -0.413 5 10 CBBE CNC(=O)CONS(=O)(=O)c1ccccc1[N+](=O)[O-] 169876027 RGBBQLCYHBEXRB-UHFFFAOYSA-N 289.269 -0.449 5 10 CBBE NC(=O)[C@H](N)CN1C(=O)CCc2cc([N+](=O)[O-])ccc21 217013018 WEIJFMXMLJZQNQ-SECBINFHSA-N 278.268 -0.313 5 10 CBBE NC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1Cl 228499600 GWUDBUQZQBGNBT-ZETCQYMHSA-N 287.659 -0.176 5 10 CBBE CNc1ncc([N+](=O)[O-])cc1C(=O)NCCNC(C)=O 234594231 QADHYEQIUDMMFO-UHFFFAOYSA-N 281.272 -0.103 5 10 CBBE CO[C@H]1CN(c2ncnc(NN)c2[N+](=O)[O-])C[C@H]1OC 234769651 QSGKOEKUVOUUFV-KNVOCYPGSA-N 284.276 -0.480 5 10 CBBE CCN(CCNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 354875679 ANSJEDXOMDVTTI-UHFFFAOYSA-N 282.304 -0.213 5 10 CBBE O=C(N[C@@H]1CC[C@H]1O)c1cnc(O)c([N+](=O)[O-])c1 425044899 ISTZNMAQOJFFMM-HTRCEHHLSA-N 253.214 -0.052 5 10 CBBE O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])cn1 532143244 OSMVGRTXHRXQOO-SSDOTTSWSA-N 285.281 -0.093 5 10 CBBE Cc1nn(C)c(N2CCO[C@H](CC(N)=O)C2)c1[N+](=O)[O-] 599186612 HTDGFIOWKRJRDL-MRVPVSSYSA-N 283.288 -0.283 5 10 CBBE NC(=O)c1ccc(N[C@@H]2CCNC2=O)cc1[N+](=O)[O-] 693906347 HFGYHBMPJCZCAK-MRVPVSSYSA-N 264.241 -0.006 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@H]2CO)c1 698187336 WRPQZVZBXKHJOA-IUCAKERBSA-N 281.268 -0.374 5 10 CBBE C[C@@H](O)[C@@H](O)CNc1ccc(C(N)=O)c([N+](=O)[O-])c1 717304120 HXXJPYHZUOTSJF-LDWIPMOCSA-N 269.257 -0.153 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N[C@@H]1CNOC1 722475668 NIQQRIASHABFMM-SSDOTTSWSA-N 255.234 -0.799 5 10 CBBE NNc1ncnc(N[C@H]2CC23CC(O)C3)c1[N+](=O)[O-] 724994215 FZBWTSHOPUWOOM-YTWBLMGLSA-N 266.261 -0.004 5 10 CBBE CN1C[C@@H]2CC[C@H](C1)N2C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 931394956 JHLYBEKAZCKSPJ-LOWVWBTDSA-N 295.343 -0.069 5 10 CBBE Cc1nn(C)c(C(=O)N[C@@H]2CCO[C@@H]2C(=O)O)c1[N+](=O)[O-] 1261631514 VWXPVQHBRSFBES-MUWHJKNJSA-N 298.255 -0.391 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCc2nc[nH]c2C1 1324129665 XKKZKEFKSGTFAB-ZETCQYMHSA-N 291.271 -0.417 5 10 CBBE NC(=O)c1ccc(N2CCC(CO)(CO)C2)c([N+](=O)[O-])c1 1328585653 MZLDFOWAYZTZBI-UHFFFAOYSA-N 295.295 -0.125 5 10 CBBE Cn1cc(NC(=O)Cn2ccc([N+](=O)[O-])n2)nn1 1334275216 BHGOOSYTOHPSSA-UHFFFAOYSA-N 251.206 -0.442 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1C[C@@H]2C[C@]2(CO)C1 1466967503 JRIRYZUNBJKOQP-TVQRCGJNSA-N 293.279 -0.403 5 10 CBBE CC(C)NC(=O)CNC/C=C/CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1497584130 OKROWMSVGDPSQN-YIZUVKHSSA-N 298.343 -0.562 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H](CO)[C@@H](CO)C1 1643098207 GUHWITHVVWSXGE-DTORHVGOSA-N 281.268 -0.337 5 10 CBBE O=C(Nn1ccc(O)nc1=O)c1ccc([N+](=O)[O-])cn1 1647997470 SQRRUBXRKHERPC-UHFFFAOYSA-N 277.196 -0.364 5 10 CBBE O=C(O)[C@H]1COCCN(C(=O)N2CC([N+](=O)[O-])C2)C1 1876137288 POLZJMNUIFINHD-SSDOTTSWSA-N 273.245 -0.900 5 10 CBBE NC(=O)N1CC(Nc2cc(C(=O)O)c([N+](=O)[O-])cn2)C1 1917786501 GQEWDWXSHBOUTO-UHFFFAOYSA-N 281.228 -0.137 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[C@@H](O)[C@H]3C2)n1 1965164864 NUEJXEHBAVQILE-ACLDMZEESA-N 266.257 -0.219 5 10 CBBE CN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H](N)CO 2034503734 CZOWPLOLQGHQCZ-JTQLQIEISA-N 253.258 -0.127 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCCO[C@@H]1CC1(F)F 2041249414 QDFPUWZSULWGGT-RXMQYKEDSA-N 263.204 -0.019 5 10 CBBE O=[N+]([O-])c1c(Cl)nc[nH]c1=NC[C@]1(O)CCNC1 2044038652 SLRACUPRLOLAQI-VIFPVBQESA-N 273.680 -0.404 5 10 CBBE NC(=O)C1(N)CN(C(=O)c2csc([N+](=O)[O-])c2)C1 2047095670 PTSVSHJIGMBBSH-UHFFFAOYSA-N 270.270 -0.705 5 10 CBBE N=c1nc(N2CCN[C@@H]3CC[C@H]32)c([N+](=O)[O-])c[nH]1 2053465957 SWWMVNYRNAQABO-RNFRBKRXSA-N 250.262 -0.262 5 10 CBBE Nc1ccc(N2C[C@@H](N)C[C@@H](O)C2)nc1[N+](=O)[O-] 2053546323 JCQACGDYJPICRX-NKWVEPMBSA-N 253.262 -0.530 5 10 CBBE N=c1[nH]c(N[C@@H]2COCC[C@@H]2N)ncc1[N+](=O)[O-] 2053547299 VJLQHBLPJMZCKQ-NTSWFWBYSA-N 254.250 -0.675 5 10 CBBE CNC[C@@H](CN(C)C)Oc1nc([N+](=O)[O-])nn1C 2056218376 KJUYCDWHOCDRNQ-ZETCQYMHSA-N 258.282 -0.748 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(NC[C@](C)(N)CO)[nH]1 2060803689 HEWZLVNHCQYVSR-JTQLQIEISA-N 255.278 -0.425 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC2CC3(COC3)C2)[nH]1 2061786398 YNJPLBROAYLPMT-UHFFFAOYSA-N 251.246 -0.190 5 10 CBBE O=C(N[C@H]1CNCC[C@@H]1O)c1cc([N+](=O)[O-])c[nH]1 2063328274 GHAWUSIOGKSYIS-IUCAKERBSA-N 254.246 -0.625 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1C[C@@H]1CNCCOC1 2079166712 SEUDGCAXQCPADG-QMMMGPOBSA-N 254.246 -0.613 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@H](CO)C2CC2)[nH]1 2089969620 AOAATXNECFMYAE-MRVPVSSYSA-N 267.289 -0.299 5 10 CBBE CCO[C@@H]1CNCC[C@@H]1N=c1[nH]n(C)cc1[N+](=O)[O-] 2090581105 VNXTVYZTSHULPJ-WCBMZHEXSA-N 269.305 -0.071 5 10 CBBE COc1ccc(S(=O)(=O)NNCCO)cc1[N+](=O)[O-] 2092740806 VZMZDCMGGLVPQZ-UHFFFAOYSA-N 291.285 -0.621 5 10 CBBE Nc1[nH]c(=NC2CC(N)(C(=O)O)C2)ccc1[N+](=O)[O-] 2094868539 QOBSDRBQBMKIRB-UHFFFAOYSA-N 267.245 -0.650 5 10 CBBE N=c1nc(N2CCOC[C@@H](CO)C2)c([N+](=O)[O-])c[nH]1 2098208051 PMQOAWTVPFCPCM-SSDOTTSWSA-N 269.261 -0.758 5 10 CBBE CN=c1[nH]c(=NCCCC[S@](C)=O)[nH]cc1[N+](=O)[O-] 2110339827 OKNZENTVNGMAOL-IBGZPJMESA-N 287.345 -0.159 5 10 CBBE Cc1nc(N[C@@H]2CS(=O)(=O)C[C@H]2O)ccc1[N+](=O)[O-] 2121330091 OHOKEYFQSPESDY-VXNVDRBHSA-N 287.297 -0.132 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)NCC[C@@H](O)CO)c1 2125812277 GVZFFYOQAHIYFT-MRVPVSSYSA-N 291.285 -0.989 5 10 CBBE COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](CN)CO 2126185582 LZSPYEAGOOUPCB-SSDOTTSWSA-N 269.257 -0.347 5 10 CBBE NNc1ccc([N+](=O)[O-])c(NC[C@@H]2CNC(=O)O2)n1 2129930734 AWGBAMCHDXRGLS-RXMQYKEDSA-N 268.233 -0.204 5 10 CBBE CC1(C)OC[C@@H](N)[C@@]1(C(=O)O)n1ccc([N+](=O)[O-])n1 2136999849 RAXWKYBPWXBHRM-LDWIPMOCSA-N 270.245 -0.293 5 10 CBBE CN=c1nc(N2C[C@H]3OCCO[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2149780924 MUIQNJIFCZJJNR-RKDXNWHRSA-N 281.272 -0.548 5 10 CBBE N=c1nc(N2CC[C@@H]3OCCO[C@H]3C2)c([N+](=O)[O-])c[nH]1 2151758117 BVICTQBWXKYTQF-IUCAKERBSA-N 281.272 -0.209 5 10 CBBE O=C(Cc1cccc([N+](=O)[O-])c1)NC1(C(=O)O)CNC1 2152323102 NXLOWVKJCWCKKN-UHFFFAOYSA-N 279.252 -0.320 5 10 CBBE COC[C@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCNC1 2157554154 QTPLGERZSPUQTH-NSHDSACASA-N 283.288 -0.714 5 10 CBBE N=c1[nH]c(N2CCN3C[C@@H](O)C[C@@H]3C2)ncc1[N+](=O)[O-] 2157648016 FEPNHGKIEVSLPW-SFYZADRCSA-N 280.288 -0.947 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@@H]1Cc2nncn2C1 2167658782 SPWIHOFTVPRFRG-LURJTMIESA-N 279.235 -0.178 5 10 CBBE N=c1nc(N2CC(C(=O)NC3CC3)C2)c([N+](=O)[O-])c[nH]1 2168042278 HGVGSORUNREOTE-UHFFFAOYSA-N 278.272 -0.488 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[C@@H](N)[C@H](O)C1 2172843729 PMJXUKBNIBLKPD-BCMRRPTOSA-N 282.300 -0.239 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CCNC[C@@H]2C(=O)O)[nH]1 2173848292 KCOFCQICHXBAFJ-MRVPVSSYSA-N 281.272 -0.684 5 10 CBBE COc1ncnc(N2CC[C@H](N)[C@H](CO)C2)c1[N+](=O)[O-] 2178909888 GLUPGNYVBNTDFT-YUMQZZPRSA-N 283.288 -0.461 5 10 CBBE COc1nc(N2CC[C@H](N)[C@@H](CO)C2)ncc1[N+](=O)[O-] 2178911763 RBLJOPBLIIKWHY-SFYZADRCSA-N 283.288 -0.461 5 10 CBBE CC1(C)CNC[C@@H](COc2ncc([N+](=O)[O-])c(=N)[nH]2)O1 2184552579 PPHGAWRITDIDEA-ZETCQYMHSA-N 283.288 -0.057 5 10 CBBE O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@H](O)[C@@H](O)C1 2188681707 OMILAYRZXDYGDF-UWVGGRQHSA-N 282.252 -0.132 5 10 CBBE O=C(c1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)[C@@H]1CO 2200880337 ZRLAFIHESBQPLD-DCAQKATOSA-N 282.252 -0.867 5 10 CBBE COC[C@@](O)(CO)CNc1ccc([N+](=O)[O-])cc1CO 2205285057 TWOZYAZUCGAQBR-LBPRGKRZSA-N 286.284 -0.131 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCc2nnn(C)n2)[nH]1 2223014487 SUWFYBGDRWMXDT-UHFFFAOYSA-N 252.238 -0.631 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC[C@H](O)CN(C)C)[nH]1 2223032795 KLIQBGHEZKYMOC-QMMMGPOBSA-N 257.294 -0.433 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@H]1[C@@H]2CS(=O)(=O)C[C@H]12 2227003147 ZTYGSDXBCLAILV-WHUPJOBBSA-N 284.297 -0.491 5 10 CBBE N=c1nnc(=N[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[nH][nH]1 2234540534 FYMBGBVEWFOCMK-QMMMGPOBSA-N 273.256 -0.411 5 10 CBBE Nc1ccc(=NC[C@@]23CNC[C@@H]2CCO3)[nH]c1[N+](=O)[O-] 2237823886 NTLTVWOUGIGPAF-UFBFGSQYSA-N 279.300 -0.216 5 10 CBBE CCNS(=O)(=O)c1ccn2ncc([N+](=O)[O-])c2n1 2263872745 JBEBWTMCESILHJ-UHFFFAOYSA-N 271.258 -0.064 5 10 CBBE CCc1ncc([N+](=O)[O-])c(N2CC[C@H]2[C@H](O)CO)n1 2271103292 LGQJTOFVZRIZBL-IONNQARKSA-N 268.273 -0.121 5 10 CBBE C[C@@H](O)CNCCNC(=O)c1ccc([N+](=O)[O-])cn1 2278223273 ZSUWURMRQJOEQV-MRVPVSSYSA-N 268.273 -0.310 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)CN[C@H]2CCOC2)n1 2288207349 XYTTWOZCCRAEIS-QMMMGPOBSA-N 283.288 -0.677 5 10 CBBE Cn1[nH]c(=NCC[C@H]2COCCO2)nc1[N+](=O)[O-] 2321697187 RNQWILLFQILLPK-ZETCQYMHSA-N 257.250 -0.637 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCN[C@@H]2C[C@H]12 2331666089 PSPYUJFRTVEGJA-GJMOJQLCSA-N 265.273 -0.192 5 10 CBBE O=C(N[C@@H]1[C@@H]2CN[C@H]1C2)c1cc([N+](=O)[O-])cnc1O 2333051776 MBSFUHOJJXYSMR-WLGLDCGKSA-N 264.241 -0.215 5 10 CBBE Nc1cc(CN2CC([C@@H](O)CO)C2)ccc1[N+](=O)[O-] 2336774241 PQYGDOHUWNSYQO-LBPRGKRZSA-N 267.285 -0.038 5 10 CBBE CO[C@H]1C[C@H](C(=O)O)N(c2nc([N+](=O)[O-])n(C)n2)C1 2345005355 XNALIPMWPXQMSI-NTSWFWBYSA-N 271.233 -0.598 5 10 CBBE Cn1nc(N2CCN(CCCN)CC2)nc1[N+](=O)[O-] 2345019394 QOIHHPXLJAJLQH-UHFFFAOYSA-N 269.309 -0.806 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCO[C@H](C(=O)O)C1 43703605 CGHBNFKOBZCJCA-VIFPVBQESA-N 284.272 -0.115 5 10 CBBE Nc1cc(C(=O)NCc2nnn[nH]2)ccc1[N+](=O)[O-] 54415111 CDBJCZOYCRWOAW-UHFFFAOYSA-N 263.217 -0.380 5 10 CBBE Cn1c(C(=O)NC[C@@H](O)C(=O)O)ccc1[N+](=O)[O-] 90260791 JXEJLLYHIKYMMU-ZCFIWIBFSA-N 257.202 -0.891 5 10 CBBE Cc1nn(C)c(N2CCN(C3CNC3)CC2)c1[N+](=O)[O-] 90308007 XRLZAACXRWKEGM-UHFFFAOYSA-N 280.332 -0.269 5 10 CBBE NNc1ncnc(NCCCn2ccnn2)c1[N+](=O)[O-] 128409103 RVQQTPLWJZXKEQ-UHFFFAOYSA-N 279.264 -0.236 5 10 CBBE 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NNc1cccc(CN2C[C@H](O)C[C@@H](O)C2)c1[N+](=O)[O-] 2236892433 JWXBWBCNUSJYEL-NXEZZACHSA-N 282.300 -0.192 5 10 CBBE O=[N+]([O-])c1cnc(C2CC2)[nH]c1=NC[C@H](O)CO 2258628864 YUCXZGOQEVAQSA-ZETCQYMHSA-N 254.246 -0.551 5 10 CBBE COC(=O)N[C@@H](C)CN=c1[nH]cncc1[N+](=O)[O-] 2261464080 NBKQOJSJXONZRY-LURJTMIESA-N 255.234 -0.037 5 10 CBBE NC[C@H](O)CN=c1[nH]c(C2CCC2)ncc1[N+](=O)[O-] 2271104122 WXPIVHAIQACAGN-QMMMGPOBSA-N 267.289 -0.194 5 10 CBBE O=[N+]([O-])c1cccc(N2C[C@H](O)[C@@H](O)[C@@H](CO)C2)c1 2273717702 ZLADRDCYBGNDLB-ZHAHWJHGSA-N 268.269 -0.255 5 10 CBBE O=[N+]([O-])c1ccc(CN2C[C@H](O)[C@H](O)[C@H](CO)C2)o1 2273803118 LHYNVKPTWYJMIZ-OVYXKVPISA-N 272.257 -0.666 5 10 CBBE CN(c1ccn2ncc([N+](=O)[O-])c2n1)C(CO)CO 2278447516 JCFSVRANQXRDSY-UHFFFAOYSA-N 267.245 -0.573 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCC(F)(F)C2(O)CNC2)[nH]n1C 2288528641 WAZJWIRTWKXEAK-UHFFFAOYSA-N 291.258 -0.560 5 10 CBBE Cn1[nH]c(=NC[C@]2(F)C[C@@H](CN)C2)nc1[N+](=O)[O-] 2321763756 LKCGWXMMEYNYCJ-KZCWHLCOSA-N 258.257 -0.366 5 10 CBBE Nc1ccc(N2C[C@@H]3CS(=O)(=O)[C@H]3C2)nc1[N+](=O)[O-] 2336555775 HSVCUZLUQVUBRQ-SVRRBLITSA-N 284.297 -0.195 5 10 CBBE C[C@H](N=c1nc([N+](=O)[O-])n(C)[nH]1)C(=O)N1CCCC1 2344963909 VKXKOOJGASZKTF-ZETCQYMHSA-N 268.277 -0.432 5 10 CBBE C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 63767969 HVGYAAPEGMUKRU-RKDXNWHRSA-N 295.299 -0.096 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC(N2CCNCC2)C1 90308862 ZLNFFMQNQBYLIB-UHFFFAOYSA-N 279.300 -0.348 5 10 CBBE NNc1cc(C(=O)N[C@H]2CCC(=O)NC2)ccc1[N+](=O)[O-] 111025502 COGAIOPHNARAHT-QMMMGPOBSA-N 293.283 -0.111 5 10 CBBE C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1N)C(N)=O 222911576 IOLDIYZFVVVVRL-BYPYZUCNSA-N 270.220 -0.080 5 10 CBBE CNc1ncnc(N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 225822489 FNFWPEUVRRGCNH-YFKPBYRVSA-N 252.234 -0.273 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1CCNC[C@H]1CCOC1 228597045 PEIUZYLQRMRWFK-SECBINFHSA-N 268.273 -0.222 5 10 CBBE N[C@]1(C(=O)O)CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 229256182 AYDVQJHRLSJCEV-SNVBAGLBSA-N 268.229 -0.449 5 10 CBBE NNc1c(CN2C[C@@H](O)[C@H](O)C2)cccc1[N+](=O)[O-] 229835839 KHXGODLWBDVPLM-NXEZZACHSA-N 268.273 -0.582 5 10 CBBE COC(=O)Cn1nnnc1Sc1nn(C)cc1[N+](=O)[O-] 231666081 JIYYKAOOSURPQW-UHFFFAOYSA-N 299.272 -0.361 5 10 CBBE CCNc1ncc([N+](=O)[O-])c(NCC(=O)NC)n1 233683870 BNDBSAAJAXOGEO-UHFFFAOYSA-N 254.250 -0.026 5 10 CBBE CCN(C)C(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 274756824 JBTRFDDPYZAZHS-UHFFFAOYSA-N 281.272 -0.021 5 10 CBBE C[C@](O)(CO)CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 338623609 FFRZLLNLFMXVEZ-GFCCVEGCSA-N 298.251 -0.203 5 10 CBBE CO[C@]1(CO)CCCN(c2ncnc(N)c2[N+](=O)[O-])C1 402753920 BOQXONDTODMPOA-LLVKDONJSA-N 283.288 -0.055 5 10 CBBE C[C@](N)(COc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)O 403036299 SWTLOMYOQLUWDC-NSHDSACASA-N 283.240 -0.126 5 10 CBBE COC(=O)C[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 435283257 WYAPXLAHWHNSBL-QMMMGPOBSA-N 297.271 -0.260 5 10 CBBE C[C@@H]1CN(CCO)CCN1c1ncc([N+](=O)[O-])c(N)n1 450952012 HIQLUAQDZAEKDC-MRVPVSSYSA-N 282.304 -0.530 5 10 CBBE 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O=[N+]([O-])c1cnc(Cl)nc1N1C[C@@H](O)[C@H](O)C1 236536038 XHVJJAKRGKFPJB-PHDIDXHHSA-N 260.637 -0.420 5 10 CBBE C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCS1(=O)=O 343720763 JYCLJBFMGKFYSZ-LURJTMIESA-N 288.285 -0.423 5 10 CBBE CCNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 353568362 UJOYGQJQYBGZJI-UHFFFAOYSA-N 267.245 -0.474 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN2CCC[C@H]2C1 408087474 BBDDRQMZOYJMLF-VIFPVBQESA-N 280.288 -0.507 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN2CCC1CC2 408278557 XDZPIEDSSKXQHH-UHFFFAOYSA-N 280.288 -0.507 5 10 CBBE COCCNC(=O)CNc1nc(F)ncc1[N+](=O)[O-] 688985901 NXUMQXBEMWRPCY-UHFFFAOYSA-N 273.224 -0.302 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@]23COC[C@@H]2C3)c1 689213763 MVMBBSRNVAXKJS-MVWJERBFSA-N 282.300 -0.222 5 10 CBBE CNC[C@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])c[nH]1 708836186 GXGDFNXXTRYPNB-QMMMGPOBSA-N 256.262 -0.425 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N[C@@H]2COCC[C@@H]2O)n1 710925399 UXMFUAMTGFIVHB-VDTYLAMSSA-N 270.249 -0.768 5 10 CBBE 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IENPHXMNVRZVHB-UHFFFAOYSA-N 272.217 -0.213 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCC[C@H](O)[C@@H]1O 2232549520 VCVHVMDUGIRIKB-VHSKPIJISA-N 284.272 -0.818 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@@H]2CN[C@@H](CO)[C@@H]2C1 2235571297 AAAWSBFNBXIYKV-RNJXMRFFSA-N 283.263 -0.460 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NC[C@@H](C)S(N)(=O)=O)[nH]1 2258616425 RACARDFWWNRHCM-RXMQYKEDSA-N 275.290 -0.796 5 10 CBBE O=[N+]([O-])c1ccc2nc([C@@H]3NC[C@H](O)[C@H]3O)[nH]c2c1 2270454827 ZVLNOLDHTSGJCA-IVZWLZJFSA-N 264.241 -0.163 5 10 CBBE O=[N+]([O-])c1cncnc1N1CC(O)(C(F)(F)CO)C1 2272848026 ZHBZAEADSXXDSN-UHFFFAOYSA-N 276.199 -0.437 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H]1[C@@H](O)CO 2286206091 ABFNDEAOZFPSDY-BDAKNGLRSA-N 282.256 -0.979 5 10 CBBE NC[C@@]12C[C@@H]1CN(S(=O)(=O)c1ccc([N+](=O)[O-])nc1)C2 2288246267 AOVWHJFRFHXLIL-LDYMZIIASA-N 298.324 -0.041 5 10 CBBE COC(=O)[C@@H](N)CCNC(=O)c1ccc([N+](=O)[O-])cn1 2295667546 XPPBEOAPWAOOEL-QMMMGPOBSA-N 282.256 -0.390 5 10 CBBE CSC1(C(=O)O)CN(C(=O)N2CC([N+](=O)[O-])C2)C1 2315375016 PTXAQYVIVDAYCL-UHFFFAOYSA-N 275.286 -0.431 5 10 CBBE Cn1nc(OC(C)(C)COCCN)nc1[N+](=O)[O-] 2321700367 MLQMUWOBMGOGRR-UHFFFAOYSA-N 259.266 -0.144 5 10 CBBE Cn1[nH]c(=NC2CC(CC(N)=O)C2)nc1[N+](=O)[O-] 2321704057 DACFIDSHMTYZGZ-UHFFFAOYSA-N 254.250 -0.789 5 10 CBBE Cn1[nH]c(=N[C@@H]2CC[C@H](C(N)=O)C2)nc1[N+](=O)[O-] 2321712166 DFVFVJYPGZWZPS-NTSWFWBYSA-N 254.250 -0.789 5 10 CBBE Cn1[nH]c(=N[C@H]2CC[C@@H]3C[C@]23CO)nc1[N+](=O)[O-] 2321759456 SKGWAHWPGZBRJR-MATHAZKKSA-N 253.262 -0.282 5 10 CBBE Cn1nc(N2C[C@H]3C[C@H](O)[C@@H](O)[C@H]2C3)nc1[N+](=O)[O-] 2344952680 MRAMGXKKJHCSBF-NGJRWZKOSA-N 269.261 -0.956 5 10 CBBE C[C@@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)C(N)=O 119375919 AWXQNOHJNXSXGS-SCSAIBSYSA-N 279.299 -0.192 5 10 CBBE O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)NCCO 122472303 GEWKRQFXKIWGJM-UHFFFAOYSA-N 291.267 -0.038 5 10 CBBE CC[C@H]1C(=O)NCCN1c1ncnc(NN)c1[N+](=O)[O-] 160264106 BRIUVXRPNBBKHT-LURJTMIESA-N 281.276 -0.615 5 10 CBBE NC(=O)[C@H](O)CNC(=O)c1cc(F)ccc1[N+](=O)[O-] 228516350 HOHZWAXJIZLETN-MRVPVSSYSA-N 271.204 -0.690 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H]2CNC(=O)C2)n1 229395984 GPZPWBCFURATMI-YFKPBYRVSA-N 252.234 -0.424 5 10 CBBE CC(C)[C@@H](Nc1ncnc(N)c1[N+](=O)[O-])C(N)=O 231063625 FFYPIFRRVLYCEE-RXMQYKEDSA-N 254.250 -0.111 5 10 CBBE COC[C@@H](CO)NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 234825413 DWHGNMCEBSROEO-SECBINFHSA-N 286.288 -0.468 5 10 CBBE Cc1nc(N)nc(N2CCNC(=O)[C@@H]2C)c1[N+](=O)[O-] 235362704 OXQVSZHMOZCGPL-LURJTMIESA-N 266.261 -0.400 5 10 CBBE NNc1ncc([N+](=O)[O-])c(NC[C@@H]2COCCO2)n1 236287492 KXNXCQTXVLOVCG-ZCFIWIBFSA-N 270.249 -0.502 5 10 CBBE NC(=O)[C@@]1(O)CCN(c2ccc([N+](=O)[O-])c(N)c2)C1 311539617 NBDYWIYJGWARER-LLVKDONJSA-N 266.257 -0.397 5 10 CBBE CN(Cc1nnnn1C)c1ccc(C(N)=O)cc1[N+](=O)[O-] 342220231 KTHDIKDDLKCKLE-UHFFFAOYSA-N 291.271 -0.146 5 10 CBBE COC1(CO)CCN(c2ncnc(N)c2[N+](=O)[O-])CC1 402643489 DPVVQWQYPNIPNX-UHFFFAOYSA-N 283.288 -0.055 5 10 CBBE O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1CC(O)(CO)C1 597701830 CHIHUPLDSAGCBV-UHFFFAOYSA-N 296.235 -0.497 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)[C@H]1CCCO1 600239635 UDCAFNZKXGUQAF-RKDXNWHRSA-N 284.272 -0.553 5 10 CBBE O=C(N[C@@H]1CCOC[C@H]1O)c1cc([N+](=O)[O-])cnc1O 600839104 HMMAHXJUMUETSV-RKDXNWHRSA-N 283.240 -0.425 5 10 CBBE O=C(N[C@@H](CO)CN1CCOCC1)c1ccc([N+](=O)[O-])o1 619871083 OAFJDYCWDDMQAP-SECBINFHSA-N 299.283 -0.389 5 10 CBBE NC(=O)C(Nc1ccc([N+](=O)[O-])cc1Cl)C(N)=O 695353543 IYGZJKUGUKBDLO-UHFFFAOYSA-N 272.648 -0.001 5 10 CBBE Nc1n[nH]cc1CNC(=O)CCn1cnc([N+](=O)[O-])c1 701100053 UWBRUIIEJZVHGR-UHFFFAOYSA-N 279.260 -0.197 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)N1CC(CO)(CO)C1 720987985 WLICOPQJEQTIGN-UHFFFAOYSA-N 283.284 -0.157 5 10 CBBE Cn1c(C(=O)N[C@H]2COCC[C@H]2N)ccc1[N+](=O)[O-] 722095219 WLTRYXITWZZLTG-SFYZADRCSA-N 268.273 -0.221 5 10 CBBE C[C@]1(COC(=O)Cn2cnc([N+](=O)[O-])n2)CNC(=O)C1 802198138 CCKHMNMNKUPYSY-SNVBAGLBSA-N 283.244 -0.744 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NC[C@@H]1CC(C(N)=O)=NO1 1186185137 UOILMHLIIACWIW-YFKPBYRVSA-N 268.233 -0.630 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1CC[C@@H](O)[C@H](CO)C1 1307143840 KKQBWLQHPDSUIM-IONNQARKSA-N 256.262 -0.492 5 10 CBBE CCOCCN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1318020700 YMWCKAMQNNRDMM-NXEZZACHSA-N 257.290 -0.512 5 10 CBBE C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 1321339018 IFQFZRPIIYLRFD-YFKPBYRVSA-N 256.218 -0.221 5 10 CBBE COC(=O)[C@H](C[C@H]1CCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1537823781 KIDLVAIXBOYMBN-DOLQZWNJSA-N 286.284 -0.122 5 10 CBBE COC(=O)[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O 1653985910 GFUPLAYCMQFCQP-JTQLQIEISA-N 298.251 -0.046 5 10 CBBE COCCNCCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1699506316 INNYYGWGYDNSIL-NXEZZACHSA-N 259.306 -0.264 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCOC[C@H]2CO)[nH]1 1878770323 SLQFRPHYMKXLEW-RNFRBKRXSA-N 269.261 -0.971 5 10 CBBE N=c1[nH]c(OC[C@@H]2COCC[C@H]2N)ncc1[N+](=O)[O-] 1878778458 NVAQOJSTXNRJSA-NKWVEPMBSA-N 269.261 -0.460 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H](CO)C[C@@H]1CCOC1 1883169087 SYFAJRXEHYKRCK-YUMQZZPRSA-N 271.277 -0.655 5 10 CBBE Cn1c(C(=O)N[C@@H](CO)C2CC2)cnc1[N+](=O)[O-] 1889869252 LIWMUKZQCRZAJA-ZETCQYMHSA-N 254.246 -0.171 5 10 CBBE Cc1cc(N2CCOC[C@H]2[C@@H](O)CO)c([N+](=O)[O-])cn1 1917826871 FMRJZJLPWISTSP-RYUDHWBXSA-N 283.284 -0.143 5 10 CBBE C[C@@](CN)(Oc1ccc(C(N)=O)cc1[N+](=O)[O-])C(=O)O 1919396762 RKDBEWFYNRKMSK-NSHDSACASA-N 283.240 -0.126 5 10 CBBE O=C(NCC[C@@H](O)CO)c1ccc([N+](=O)[O-])c(O)c1 1963590248 GASJBBUYNMBZQS-MRVPVSSYSA-N 270.241 -0.227 5 10 CBBE C[C@H](CO)N1CCN(c2nn(C)cc2[N+](=O)[O-])CC1 1969297991 FQCSBROQANYGTR-SECBINFHSA-N 269.305 -0.169 5 10 CBBE O=[N+]([O-])c1cnc(N[C@@H]2C[C@H](O)[C@@H](O)[C@@H]2O)s1 2000868877 RHWIUYIMHACMTN-GFKUXRSRSA-N 261.259 -0.682 5 10 CBBE NC[C@@H]1COC[C@@H]1Oc1ccc([N+](=O)[O-])c(N)n1 2036606849 DOICQPLQIBPOBV-SVRRBLITSA-N 254.246 -0.076 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)C[C@@H]2NCC[C@H]21 2037218989 USJAEKMLPBKKGT-JHEQGTHGSA-N 253.218 -0.652 5 10 CBBE O=[N+]([O-])c1cnc(=NC[C@H]2CNCCOC2)[nH]c1 2040720945 HCGKFTCWJSZMEA-MRVPVSSYSA-N 253.262 -0.545 5 10 CBBE CNC(=O)C1(NCc2nn(C)cc2[N+](=O)[O-])CC1 2041826001 QYYBJCZTZXPFBX-UHFFFAOYSA-N 253.262 -0.304 5 10 CBBE O=[N+]([O-])c1cc(S(=O)(=O)NC2COC2)ccc1O 2046683883 SGSDTLYFNKCYTP-UHFFFAOYSA-N 274.254 -0.023 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC(O)(CC(=O)O)C1 2048110377 YSIRZNOKMKIAQJ-UHFFFAOYSA-N 256.218 -0.646 5 10 CBBE C[C@H]1CO[C@H](Cn2cc([N+](=O)[O-])cnc2=O)CN1 2048578520 WGJHANOFGQYJNW-CBAPKCEASA-N 254.246 -0.472 5 10 CBBE O=[N+]([O-])c1cnc(N[C@@H]2CCNC[C@H]2CO)nc1 2052710975 GJNFNZZZEQAAAY-IONNQARKSA-N 253.262 -0.233 5 10 CBBE CC[C@@H](N)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 2053077820 IFAHKTNZESDUEB-MRVPVSSYSA-N 255.278 -0.013 5 10 CBBE Cc1c([N+](=O)[O-])c(=NCC(C)(C)C(N)=O)[nH]n1C 2086315081 OPMULOZZBBZMSN-UHFFFAOYSA-N 255.278 -0.018 5 10 CBBE Cc1nc([N+](=O)[O-])c(N2C[C@H](N(C)C)[C@H](O)C2)n1C 2089920634 VTEIRBILBYLRKU-DTWKUNHWSA-N 269.305 -0.252 5 10 CBBE N[C@]12CC[C@H]1CN(C(=O)Cn1ccc([N+](=O)[O-])n1)C2 2095427230 RDWPTEVJZSXAQB-KWQFWETISA-N 265.273 -0.259 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]3OCC[C@@H]32)[nH]1 2095475573 MRETYNSQIJIGDI-JKMUOGBPSA-N 266.261 -0.318 5 10 CBBE CN(C[C@@H]1COCCN1)c1nc(F)ncc1[N+](=O)[O-] 2106498409 AZJRPEZSRPDDCN-SSDOTTSWSA-N 271.252 -0.052 5 10 CBBE CNc1nc[nH]c(=NC[C@@H](CCO)OC)c1[N+](=O)[O-] 2112218130 RVJOAOOWLVOWSO-SSDOTTSWSA-N 271.277 -0.342 5 10 CBBE C[S@](=O)C1CN(C(=O)c2cc(=N)[nH]cc2[N+](=O)[O-])C1 2115305426 HSGJYUXAEHONRJ-IBGZPJMESA-N 284.297 -0.395 5 10 CBBE CN=c1[nH]c(N2C[C@H]3CNC[C@@H]3C2)ncc1[N+](=O)[O-] 2117179696 OFCVJKLDVZGNQM-HTQZYQBOSA-N 264.289 -0.496 5 10 CBBE CC[C@@H]1NCC[C@@H]1N=c1[nH]c(=NC)[nH]cc1[N+](=O)[O-] 2117250338 KTWBHFGAIMHUQQ-YUMQZZPRSA-N 266.305 -0.177 5 10 CBBE CCNc1ncnc(NC2(CN)COC2)c1[N+](=O)[O-] 2117255161 NCTDIDUCNWXXCG-UHFFFAOYSA-N 268.277 -0.044 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCNC23CC3)[nH]1 2117388892 CPIWOLNQFHBNMA-QMMMGPOBSA-N 264.289 -0.423 5 10 CBBE NC(=O)[C@@]1(O)CCN(c2cc([N+](=O)[O-])cc(F)n2)C1 2126813495 JBLZOEPUFHSGIV-SNVBAGLBSA-N 270.220 -0.445 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H]2CNC[C@H]21 2132375127 NIBDVCQNLWDGGT-RKDXNWHRSA-N 265.273 -0.388 5 10 CBBE CS[C@H]1CNC[C@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 2140654769 ODVXXLHFWFGXQI-SVRRBLITSA-N 285.329 -0.239 5 10 CBBE NNc1ncnc(N2CCCNC(=O)CC2)c1[N+](=O)[O-] 2145331739 XEQQOYCSTXEZBS-UHFFFAOYSA-N 281.276 -0.613 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@@H]3C(CO)[C@H]3C2)cn1 2146869842 VURKTXKZORKQAT-IUCAKERBSA-N 299.308 -0.151 5 10 CBBE NNc1ncnc(N2CC[C@@H]3[C@@H](CO)[C@@H]3C2)c1[N+](=O)[O-] 2149505616 LFXGBGXWKPHGER-XLPZGREQSA-N 280.288 -0.265 5 10 CBBE Cc1ccc([N+](=O)[O-])c(N2C[C@@H](C(N)=O)C[C@@H](N)C2)n1 2151029094 NBJURLCAVXTUGI-DTWKUNHWSA-N 279.300 -0.063 5 10 CBBE CCNc1ncnc(N[C@H](COC)C(N)=O)c1[N+](=O)[O-] 2152367326 RYRUMSGCCZTFEA-ZCFIWIBFSA-N 284.276 -0.271 5 10 CBBE COc1nc(N(C)C[C@@H](O)CN(C)C)ncc1[N+](=O)[O-] 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COCc1ncc([N+](=O)[O-])c(=N[C@H]2C[C@@H]2CN)[nH]1 2258628695 WMLSVUPZSYVVKI-RQJHMYQMSA-N 253.262 -0.288 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NC[C@@H]2C[C@H](N)[C@@H](O)C2)[nH]1 2271118449 IDQYRSQGANXAQC-WEDXCCLWSA-N 267.289 -0.375 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2CCNC[C@@]2(C)CO)n1 2271121330 VGIJTPSCQYVOLK-NSHDSACASA-N 267.289 -0.146 5 10 CBBE O=[N+]([O-])c1ccccc1CN1C[C@H](O)[C@H](O)[C@H](CO)C1 2289414603 SCPGSWRXTPKBCF-WCFLWFBJSA-N 282.296 -0.259 5 10 CBBE Cn1[nH]c(=N[C@@H]2CC[C@@H]3C[C@@]32CO)nc1[N+](=O)[O-] 2321703056 SKGWAHWPGZBRJR-BRDIYROLSA-N 253.262 -0.282 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@@H]3C[C@H]2[C@@H]3CO)c1[N+](=O)[O-] 2333104420 UIPKRNGPYTUCPJ-RNJXMRFFSA-N 265.273 -0.077 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN(CCO)CCC(=O)O)n1 2342709484 SXFPVMWVHCUXKY-UHFFFAOYSA-N 272.261 -0.403 5 10 CBBE CO[C@H]1C[C@H](N=c2nc([N+](=O)[O-])n(C)[nH]2)C[C@H]1OC 2344952322 JDRVAWZJEVFCNH-WHUPJOBBSA-N 271.277 -0.251 5 10 CBBE CO[C@H]1CC(C(=O)O)(N2CC([N+](=O)[O-])C2)C[C@@H]1OC 2347723327 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COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCCN)c1 565478253 SSJLECVMHIKVPZ-UHFFFAOYSA-N 255.230 -0.108 5 10 CBBE CCOC(=O)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599233096 ROVUWQGOPTVXJI-UHFFFAOYSA-N 292.273 -0.830 5 10 CBBE CN1CCN(c2ncnc(N)c2[N+](=O)[O-])C[C@@H]1CO 687617296 QZCYQFITZUJDBE-SSDOTTSWSA-N 268.277 -0.920 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N[C@H]2CCNC2=O)n1 693887436 BVKZXZDPQNFBLB-LURJTMIESA-N 252.234 -0.424 5 10 CBBE COc1ncnc(N2C[C@H](O)C[C@@]2(C)CO)c1[N+](=O)[O-] 698158254 SOUUYSFWKAGZRB-HQJQHLMTSA-N 284.272 -0.285 5 10 CBBE COc1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@H]2CO)n1 698167438 KZOVSFQFWXWCRB-YUMQZZPRSA-N 269.257 -0.070 5 10 CBBE C[C@]1(CO)C[C@H](O)CN1c1nc(N)ncc1[N+](=O)[O-] 698213364 DFUUONPSZKFONO-QUBYGPBYSA-N 269.261 -0.711 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N[C@H]2CCOC[C@@H]2O)n1 707029403 BWKFHGCUZZXWGM-YUMQZZPRSA-N 269.261 -0.163 5 10 CBBE COC(=O)C1(O)CN(c2ncnc(Cl)c2[N+](=O)[O-])C1 714518142 NJYMIIUYLYXAQM-UHFFFAOYSA-N 288.647 -0.238 5 10 CBBE O=C1OC[C@H]2CN(CCn3cc([N+](=O)[O-])ccc3=O)C[C@@H]12 860166296 XNZOGSKJFYHVTQ-MWLCHTKSSA-N 293.279 -0.139 5 10 CBBE Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCCCCN)n1 1118807056 DZCPJYPJFMAYGN-UHFFFAOYSA-N 277.306 -0.655 5 10 CBBE CC(=O)N[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1142620829 SATKYUNHFLKEPK-SSDOTTSWSA-N 267.245 -0.332 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NCCCc1nnnn1C 1289684135 QYNYRYLVPQWNQI-UHFFFAOYSA-N 293.287 -0.181 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CNC(=O)C2)n1 1624469857 HFKKNBODXBHDTB-ZCFIWIBFSA-N 267.245 -0.571 5 10 CBBE CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CC(=O)NC1=O 1625982077 YGGBUMYABQMXRR-YFKPBYRVSA-N 281.228 -0.805 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@H]2CO)c1 1660328241 FODIUMNUDPUHJI-WPRPVWTQSA-N 256.262 -0.781 5 10 CBBE Cn1c(C(=O)N2C[C@H]3C[C@H]2CO3)cnc1[N+](=O)[O-] 1848828746 VWTWQXGGKKVZFA-NKWVEPMBSA-N 252.230 -0.058 5 10 CBBE NNc1ccc([N+](=O)[O-])c(NC[C@H]2CCNC2=O)n1 1887164525 FHTAGPKALKETHV-ZCFIWIBFSA-N 266.261 -0.177 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@]23CCOC3)[nH]1 1896362432 ZCFGHRCBTFGSGF-LDYMZIIASA-N 265.273 -0.139 5 10 CBBE Cc1cc(C(=O)NCC(O)(CO)CO)cc([N+](=O)[O-])c1 1913803368 QKCIZBWGRIJVOL-UHFFFAOYSA-N 284.268 -0.651 5 10 CBBE O=[N+]([O-])c1cccc(=NC[C@@H]2CN3CCN2CC3)[nH]1 1925556987 XUCQXKOMTLIPIN-SNVBAGLBSA-N 263.301 -0.177 5 10 CBBE CS(=O)(=O)c1ccc([C@H]2CNCC(=O)N2)c([N+](=O)[O-])c1 1952049072 XTSCREZGYHFHDK-SECBINFHSA-N 299.308 -0.241 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCC([C@H](O)CO)CC2)n1 1963925117 ZYCANRVHMAVHSK-SNVBAGLBSA-N 270.289 -0.102 5 10 CBBE Cc1cc(=NC[C@@H]2CCS(=O)(=O)N2)[nH]cc1[N+](=O)[O-] 1965606245 CYDCONRZZOWHHY-QMMMGPOBSA-N 286.313 -0.176 5 10 CBBE O=C(CN1CCNNCC1)Nc1ccc([N+](=O)[O-])cc1 1967623419 PEKGMBARHQQCDM-UHFFFAOYSA-N 279.300 -0.057 5 10 CBBE Cn1cc([N+](=O)[O-])c(O[C@@H]2CN[C@@H]3COC[C@H]32)n1 2040569763 MFMMHTOHSOESMB-ZXFLCMHBSA-N 254.246 -0.306 5 10 CBBE CCN1CC[C@H](CN=c2nc([N+](=O)[O-])[nH]n2C)C1 2041250976 NNPQPNJHDLYNAB-MRVPVSSYSA-N 254.294 -0.101 5 10 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CN(C)CCN(CCO)C(=O)Cn1ccc([N+](=O)[O-])n1 2155562792 CHEWTICIKFJDRR-UHFFFAOYSA-N 285.304 -0.826 5 10 CBBE CN(C)CCN(CCO)CC(=O)c1cc([N+](=O)[O-])c[nH]1 2155575670 TWJUBRPVIXNUDN-UHFFFAOYSA-N 284.316 -0.039 5 10 CBBE CN(C)c1nc(N[C@H]2CCNC[C@@H]2O)ncc1[N+](=O)[O-] 2157684607 XVLOVEIEOKGXEY-CBAPKCEASA-N 282.304 -0.415 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2CO[C@@H]3COC[C@@H]32)c1[N+](=O)[O-] 2158003920 AYHFDQPWLDRSSJ-BWZBUEFSSA-N 281.272 -0.538 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=N[C@H]1CCc2nncn2C1 2159935234 ODGGTMDVYSRIDV-LURJTMIESA-N 279.235 -0.036 5 10 CBBE Nc1ccc(C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2O)cc1[N+](=O)[O-] 2165083364 PYQTUILWMYOHGX-ZOFUNIGCSA-N 281.268 -0.209 5 10 CBBE Nc1cc(N2CCOC[C@H]2[C@H](O)CO)ncc1[N+](=O)[O-] 2165863517 FYPIOXHNCOMASE-VHSXEESVSA-N 284.272 -0.870 5 10 CBBE CC1(C)CO[C@@H](CO)CN1c1ncnc(N)c1[N+](=O)[O-] 2167488661 MFCXIPUPFYZTDO-SSDOTTSWSA-N 283.288 -0.057 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1NC1(C(=O)O)COC1 2173114689 FGBLYWVSWRILCF-UHFFFAOYSA-N 282.212 -0.646 5 10 CBBE CCN=c1ccc([N+](=O)[O-])c(N(C)C[C@@H](O)CNC)[nH]1 2173849676 YTYLXQKNUGWATB-VIFPVBQESA-N 283.332 -0.140 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2[C@H]3CCCCN[C@@H]32)[nH]1 2173887345 KYVAUAIWXAEAAN-UJNFCWOMSA-N 278.316 -0.177 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@@H]2[C@@H]3COC[C@@H]32)[nH]1 2174706985 ZATREAAUERRFGV-AYMMMOKOSA-N 279.300 -0.117 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NCc2[nH]nnc2C)[nH]1 2186475948 XRQNCDOZBXJMAR-UHFFFAOYSA-N 278.276 -0.301 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](O)[C@H](O)C2(C)C)n1 2186542218 DXILAESUCISJSW-CBAPKCEASA-N 284.272 -0.716 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C(C(=O)O)[C@H]3C2)n1 2186542442 IJEROESLPPXUAK-WDSKDSINSA-N 280.240 -0.269 5 10 CBBE Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)[C@H](O)C1 2188622581 GYXYUQLIOAAMMN-DTWKUNHWSA-N 282.256 -0.860 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC[C@H]2OCC[C@H]2C(=O)O)n1 2193293005 NCHLLAVZLLENDI-GMSGAONNSA-N 284.272 -0.092 5 10 CBBE COCC12CC(CN=c3nc([N+](=O)[O-])[nH]n3C)(CO1)C2 2206065060 KJPVGDBFESEORF-UHFFFAOYSA-N 283.288 -0.247 5 10 CBBE C[C@]1(O)CN(c2ncncc2[N+](=O)[O-])CC[C@H]1O 2219804085 PPANNZRNPJXNPR-SCZZXKLOSA-N 254.246 -0.293 5 10 CBBE CCS(=O)(=O)NCCN=c1[nH]cncc1[N+](=O)[O-] 2219827287 YVVUWMUOUPEAON-UHFFFAOYSA-N 275.290 -0.842 5 10 CBBE C[C@H](F)[C@@H](N)C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2223842181 IDQFBGRENOTGOU-YLWLKBPMSA-N 259.241 -0.370 5 10 CBBE CNC1CC(C(=O)NCc2nn(C)cc2[N+](=O)[O-])C1 2231925180 WDHLOYBCMXFELG-UHFFFAOYSA-N 267.289 -0.058 5 10 CBBE COC[C@@H]1[C@H](O)[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])o1 2233863820 VOAFKFBXVXICDW-FWWHASMVSA-N 286.240 -0.620 5 10 CBBE NC(=O)[C@H]1COCCN1Cc1cccc(N)c1[N+](=O)[O-] 2236875348 IJIBTVSPMRDVPS-SNVBAGLBSA-N 280.284 -0.137 5 10 CBBE COCCNC(=O)CN=c1[nH]c(C)ncc1[N+](=O)[O-] 2271075341 YPBJKLSMJFMZAH-UHFFFAOYSA-N 269.261 -0.710 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2C=CCNC2)[nH]1 2271094300 MUXQFHVWWSBXSO-MRVPVSSYSA-N 265.273 -0.107 5 10 CBBE C[C@@]1(O)[C@H]2C[C@@H]1CN(c1nc(NN)ncc1[N+](=O)[O-])C2 2286247247 PARRNNVBAUBBTO-IIDWOEFGSA-N 280.288 -0.123 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2C[C@H]3CNC[C@H]32)[nH]1 2286652455 PAFDQLJYFSXZGU-DJLDLDEBSA-N 279.300 -0.027 5 10 CBBE N=c1[nH]c(N2C[C@@H]3C[C@@H](O)[C@H]2C3)ncc1[N+](=O)[O-] 2309933230 DYAWVKFLTJFBAB-SHYZEUOFSA-N 251.246 -0.243 5 10 CBBE Cn1nc(N2CC[C@H](O)[C@@H](O)CC2)nc1[N+](=O)[O-] 2321705751 WIYOPTSXVLUFPH-BQBZGAKWSA-N 257.250 -0.955 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2C[C@@H](O)[C@@H]3COC[C@@H]32)[nH]1 2329204554 GYCFRAICSYQCBT-HRDYMLBCSA-N 266.257 -0.402 5 10 CBBE O=[N+]([O-])c1cnc(N2[C@H]3CC[C@@H]2[C@H](O)[C@H](O)C3)nc1 2331964194 FUYAXGUCFZVBGD-ZQNVIIHSSA-N 266.257 -0.152 5 10 CBBE Cn1[nH]c(=NC[C@@]2(O)C[C@H]2C(F)(F)F)nc1[N+](=O)[O-] 2344968161 MCGSEJCDTTZILA-FBCQKBJTSA-N 281.194 -0.130 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC[C@H]1NC[C@@H]2C[C@H]12 2357565126 NLKOSCAECKDGOI-LPEHRKFASA-N 279.300 -0.095 5 10 CBBE N[C@H]1C[C@H]1NS(=O)(=O)c1cccc([N+](=O)[O-])c1 36263976 QBADGVZENVZLBF-DTWKUNHWSA-N 257.271 -0.027 5 10 CBBE COC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 42265320 DQJGHDAVRATTMU-UHFFFAOYSA-N 283.240 -0.082 5 10 CBBE C[C@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@@H](O)[C@H](O)[C@H]1O 44170551 SWRPIVXPHLYETN-JJDXKYNWSA-N 285.252 -0.199 5 10 CBBE CCOC(=O)[C@@H](NC=O)[C@@H](O)c1ccc([N+](=O)[O-])o1 90301074 OVFJSFUGOPWNNC-IUCAKERBSA-N 272.213 -0.101 5 10 CBBE Nc1ncnc(N2CC[C@H](N3CCOCC3)C2)c1[N+](=O)[O-] 149971494 PHPGGAZTHRZNKL-VIFPVBQESA-N 294.315 -0.122 5 10 CBBE NNc1ncnc(N2CCN3CCC[C@@H]3C2)c1[N+](=O)[O-] 161330315 DFAHDTNJDBJILE-MRVPVSSYSA-N 279.304 -0.045 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N[C@@H]2CNC(=O)C2)n1 229396889 VPLPRBGGFIPKHF-YFKPBYRVSA-N 252.234 -0.424 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H](O)C2(CC2)C1 377188577 LLNGVQKZUYRQSQ-SECBINFHSA-N 266.257 -0.225 5 10 CBBE NC(=O)C[S@@](=O)CC(=O)Nc1cccc([N+](=O)[O-])c1 526837953 BOBLUMQRWCXSQH-LJQANCHMSA-N 285.281 -0.233 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CNC[C@@H]1O 592549297 XZVSQADSWGJVFL-XVKPBYJWSA-N 268.273 -0.757 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CCN(C3CC3)C(=O)C2)n1 611335229 HBSPDJINMCJHLT-UHFFFAOYSA-N 293.283 -0.225 5 10 CBBE NC(=O)C(Nc1nc2ccc([N+](=O)[O-])cc2o1)C(N)=O 695267890 JXCGFYMUQKAPMH-UHFFFAOYSA-N 279.212 -0.513 5 10 CBBE COC[C@H](ONc1ncc([N+](=O)[O-])cn1)C(=O)O 709690993 COPRMYPYOHPGNN-LURJTMIESA-N 258.190 -0.172 5 10 CBBE C[C@H](O)[C@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 717357512 WWOUIJGDROMZIB-GZMMTYOYSA-N 284.268 -0.169 5 10 CBBE N[C@@H]1CCOC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 722073628 IDDLUBPMNLPCOV-SVRRBLITSA-N 254.246 -0.231 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1O[C@H]1CCOC[C@H]1N 724849204 IAUSKQCGXDCVBH-BDAKNGLRSA-N 282.256 -0.416 5 10 CBBE C[C@@H](CN1CCOCC1)OC(=O)Cn1cnc([N+](=O)[O-])n1 784919694 TZFFXWQDZZSFPR-VIFPVBQESA-N 299.287 -0.550 5 10 CBBE CN1C(=O)CC[C@@H](NC(=O)c2nn(C)cc2[N+](=O)[O-])C1=O 1118154549 YSVPWYLTWCUEPR-ZCFIWIBFSA-N 295.255 -0.795 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CC3(C[C@H](O)CNC3=O)C2)n1 1187624884 LJSXWDUHSFNDPY-ZETCQYMHSA-N 281.272 -0.985 5 10 CBBE Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@]1(C(N)=O)CCOC1 1332923353 DHLBFQGQSHUFGL-GFCCVEGCSA-N 294.267 -0.328 5 10 CBBE CCN1CCN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1627184648 BSZFZFNYFCHRMH-GHMZBOCLSA-N 270.333 -0.595 5 10 CBBE CC(C)(CO)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1632232338 BBMBIZSZRVYFPV-UHFFFAOYSA-N 269.257 -0.356 5 10 CBBE COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1637437709 OJAODQZXMXBYEV-RITPCOANSA-N 284.228 -0.934 5 10 CBBE CC(=O)NCCOCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1679728079 NAFSITYLOSXZQG-NXEZZACHSA-N 273.289 -0.689 5 10 CBBE CNC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 1860754748 APKORRTWUOKRFL-UHFFFAOYSA-N 293.283 -0.616 5 10 CBBE O=C(O)[C@H](O)[C@@H](O)C(=O)Nc1ccc([N+](=O)[O-])c(F)c1 1865946077 OZUMSZGFBSHDQE-HTQZYQBOSA-N 288.187 -0.521 5 10 CBBE N=c1cc(C(=O)N2CCOCCO2)c([N+](=O)[O-])c[nH]1 1899027526 JORVCWLWOJESCR-UHFFFAOYSA-N 268.229 -0.194 5 10 CBBE O=C(O)c1cc(N2CC(CO)(CO)C2)ncc1[N+](=O)[O-] 1914993273 WWVHJANWQPIFFQ-UHFFFAOYSA-N 283.240 -0.521 5 10 CBBE NC(=O)C1(O)CN(c2ccnc(Cl)c2[N+](=O)[O-])C1 1915345290 FZYXASZKTOQEAS-UHFFFAOYSA-N 272.648 -0.320 5 10 CBBE CCN(CCO)c1ncc([N+](=O)[O-])cc1C(N)=O 1917261021 NVTVSUKUAASJNF-UHFFFAOYSA-N 254.246 -0.093 5 10 CBBE N[C@H](C(=O)O)c1csc(N2CC([N+](=O)[O-])C2)n1 2016887479 KKACWGWAZDRHKC-LURJTMIESA-N 258.259 -0.307 5 10 CBBE O=C(O)CCONC(=O)Cn1ccc([N+](=O)[O-])n1 2039447518 DVQPGERRQBHCDN-UHFFFAOYSA-N 258.190 -0.686 5 10 CBBE CC(CO)(CO)CNc1cc(N)c([N+](=O)[O-])cn1 2047196474 HFSCQHZUBVTUIW-UHFFFAOYSA-N 256.262 -0.025 5 10 CBBE CN(c1ncnc(N)c1[N+](=O)[O-])[C@@H]1[C@@H]2CNC[C@@H]21 2053643863 KEYXQGXRNFTMGD-KVSKUHBBSA-N 250.262 -0.379 5 10 CBBE O=[N+]([O-])c1ccc(N2C[C@H](O)CC23CNC3)nc1 2066535797 XFANNSLDVYQCFF-SECBINFHSA-N 250.258 -0.097 5 10 CBBE CN=c1[nH]c(N2C[C@@H]3C[C@H]2CN3)ncc1[N+](=O)[O-] 2067322229 UFFWLOUSBOUSLW-BQBZGAKWSA-N 250.262 -0.601 5 10 CBBE Cc1nn(C)c(N2CC[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 2068419808 HFZVEXIZSCAOKF-JGVFFNPUSA-N 256.262 -0.431 5 10 CBBE 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KBCGOMULGOOICC-UHFFFAOYSA-N 278.232 -0.677 5 10 CBBE Cc1cn([C@H]2CS(=O)(=O)C[C@H]2O)nc1[N+](=O)[O-] 70218684 QBUXZSJBGXMQQT-NKWVEPMBSA-N 261.259 -0.570 5 10 CBBE CCn1cc([N+](=O)[O-])c(=O)n(C[C@@H](C)CNC)c1=O 70527780 RMZRYGLXBAZLFJ-QMMMGPOBSA-N 270.289 -0.206 5 10 CBBE COc1ncnc(NCCCS(N)(=O)=O)c1[N+](=O)[O-] 94739392 ZYPOXTYLOOHXQS-UHFFFAOYSA-N 291.289 -0.516 5 10 CBBE Nc1nnc(Cn2cc([N+](=O)[O-])cnc2=O)s1 128707007 GVCFHKUCQZVZOY-UHFFFAOYSA-N 254.231 -0.367 5 10 CBBE CCNC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 233506374 FJYKAEUMBLCFGF-UHFFFAOYSA-N 281.272 -0.172 5 10 CBBE COc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](O)[C@@H](O)C1 234891954 KZSWDUFDAIZYPB-IUCAKERBSA-N 282.252 -0.219 5 10 CBBE O=C1N[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CS1 269125920 XFYMEPVQEMRLOC-SSDOTTSWSA-N 285.285 -0.268 5 10 CBBE Cc1ccnc(N2CC[C@](O)(C(N)=O)C2)c1[N+](=O)[O-] 276455580 MIBKECVSIIXVKF-LLVKDONJSA-N 266.257 -0.275 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@H]2CCN(S(C)(=O)=O)C2)[nH]1 400184117 BXQRILJCUJZEFQ-ZETCQYMHSA-N 289.317 -0.804 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCO[C@H]2C[C@H]21 590428047 CMYJZOIBCPAOSA-ZJUUUORDSA-N 279.252 -0.244 5 10 CBBE O=C(CNc1nc(F)ncc1[N+](=O)[O-])N1CCOCC1 689020136 VDMAFGJMGCJREL-UHFFFAOYSA-N 285.235 -0.205 5 10 CBBE Cc1nc(N)nc(N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 716724051 ZQCBHORTOPZKHA-ZETCQYMHSA-N 270.293 -0.390 5 10 CBBE C[C@@H](N)[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)CCO1 905628111 IBSCXHUVLONARO-APPZFPTMSA-N 255.278 -0.119 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@H](O)C(F)(F)C1 1118782836 WZOXVBJUIBHTSR-LURJTMIESA-N 291.214 -0.585 5 10 CBBE COC[C@@](C)(O)CNC(=O)Cn1c([N+](=O)[O-])cnc1C 1136987787 IGROJZKNIMUHSX-NSHDSACASA-N 286.288 -0.387 5 10 CBBE COC(=O)[C@H]1[C@H](O)CCCN1Cc1cn(C)nc1[N+](=O)[O-] 1169291704 BVWRDWLZZXCRAG-NXEZZACHSA-N 298.299 -0.173 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)C(N)=O 1251326158 NMGUMGMPAOLGIC-UHFFFAOYSA-N 269.261 -0.520 5 10 CBBE CN1CC[C@@H](N(C)C(=O)c2cnc(N)c([N+](=O)[O-])c2)C1=O 1297724374 MHDYJGMFXRKTBP-MRVPVSSYSA-N 293.283 -0.125 5 10 CBBE C[C@]1(CO)C[C@H](O)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 1301121995 MRADIFCEHVNFHJ-QPUJVOFHSA-N 297.267 -0.347 5 10 CBBE CCCn1ncnc1COC(=O)Cn1cnc([N+](=O)[O-])n1 1344649556 CGWBFMRBXOBVDK-UHFFFAOYSA-N 295.259 -0.069 5 10 CBBE C[C@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CN1CCN(C)CC1 1464883034 RYWSIZLAHHQMOX-IJLUTSLNSA-N 284.360 -0.349 5 10 CBBE O=C(NC/C=C/CNCc1nncs1)[C@@H]1C[C@H]1[N+](=O)[O-] 1568849401 YLSVCCLBQSFOIJ-NPIHWTNLSA-N 297.340 -0.035 5 10 CBBE COC[C@H](O)CNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl 1634026988 LADSNCOXYOLSQU-SCSAIBSYSA-N 278.652 -0.292 5 10 CBBE CCc1[nH]nc(C(=O)N[C@@H]2CCOC[C@H]2O)c1[N+](=O)[O-] 1637338416 BNGCTSNWDQHFGM-HTQZYQBOSA-N 284.272 -0.240 5 10 CBBE Nc1nc(N2CC(N[C@H]3CCOC3)C2)ncc1[N+](=O)[O-] 1643237511 MSSAQGWHUVQJKP-ZETCQYMHSA-N 280.288 -0.466 5 10 CBBE Cc1cc(=O)n(Cc2nc(=O)n(C)[nH]2)cc1[N+](=O)[O-] 1656374690 OHMFAILPBIBEIU-UHFFFAOYSA-N 265.229 -0.465 5 10 CBBE CN1CCN(C(=O)c2cnc([N+](=O)[O-])n2C)CC1=O 1848828421 QTXFXBKZACLQPF-UHFFFAOYSA-N 267.245 -0.758 5 10 CBBE CCN=c1ccc(S(=O)(=O)N2CC([N+](=O)[O-])C2)c[nH]1 1876137713 WBFCNHZHRNVLRD-UHFFFAOYSA-N 286.313 -0.415 5 10 CBBE O=C(NCC(O)(CO)CO)c1ccc([N+](=O)[O-])c(F)c1 1913587091 ABRIJDYRYTXTKJ-UHFFFAOYSA-N 288.231 -0.821 5 10 CBBE O=[N+]([O-])c1cccc(N2CCOC[C@@H]2[C@H](O)CO)n1 1925564396 RIZYFNZHRUAGIB-RKDXNWHRSA-N 269.257 -0.452 5 10 CBBE N[C@H](CO)C(=O)Nc1ccnc(Cl)c1[N+](=O)[O-] 1946585933 XZFKHHFRFYSKJA-SCSAIBSYSA-N 260.637 -0.099 5 10 CBBE Cc1nc([N+](=O)[O-])c(NCCn2cnnn2)n1C 1963089565 BKCMRZPYIQMRAH-UHFFFAOYSA-N 252.238 -0.265 5 10 CBBE C[C@@H]1CNC[C@](C(=O)O)(n2cnc([N+](=O)[O-])n2)C1 2028366579 QLIHUAKSZAIOJP-IMTBSYHQSA-N 255.234 -0.404 5 10 CBBE Cn1c(C(=O)N(CCN)CCN)ccc1[N+](=O)[O-] 2034693332 OBFPCVAUQNEQJN-UHFFFAOYSA-N 255.278 -0.707 5 10 CBBE COCCN1C[C@H](O)[C@H](n2ccnc2[N+](=O)[O-])C1 2039282042 ZLYXFPVVDJVAAF-BDAKNGLRSA-N 256.262 -0.345 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCC2(C)CNC2)[nH]1 2053461687 HRVTVWQXXDVQEZ-UHFFFAOYSA-N 252.278 -0.708 5 10 CBBE C[C@@H]1CNC[C@H]1CN=c1[nH]cnc(N)c1[N+](=O)[O-] 2053603188 ZBXBZUQMMXOUNP-RQJHMYQMSA-N 252.278 -0.344 5 10 CBBE Cc1cc(=N[C@@H](CO)C(=O)O)c([N+](=O)[O-])c(C)[nH]1 2054776807 IDGZBZLZXGRIEY-QMMMGPOBSA-N 255.230 -0.114 5 10 CBBE C[C@@H](N=c1ccc([N+](=O)[O-])c(N)[nH]1)[C@H](O)C(=O)O 2056749037 JYOHMDHXBYGMSO-FBCQKBJTSA-N 256.218 -0.760 5 10 CBBE Nc1ncnc(N2C[C@H]3C[C@H](O)[C@H]2C3)c1[N+](=O)[O-] 2057029275 OKZVMRUVSWIQQH-QYNIQEEDSA-N 251.246 -0.074 5 10 CBBE O=[N+]([O-])c1ccc(N2C[C@@H](O)CC23CNC3)nc1 2066535799 XFANNSLDVYQCFF-VIFPVBQESA-N 250.258 -0.097 5 10 CBBE C[C@@H]1CN(C(=O)N2CC([N+](=O)[O-])C2)C[C@H]1C(=O)O 2071558739 QOFTUHGSNJHQJB-HTRCEHHLSA-N 257.246 -0.280 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@]2(CO)CCNC2)[nH]n1C 2086322984 RKSNZQWLNHVLHO-JTQLQIEISA-N 255.278 -0.805 5 10 CBBE NCCN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 2100780881 MQEYKJYCAPKXHE-UHFFFAOYSA-N 267.289 -0.361 5 10 CBBE COc1nc(N2CCNC[C@@H](O)C2)ncc1[N+](=O)[O-] 2101466902 KHFXGTFSTBDNRI-SSDOTTSWSA-N 269.261 -0.836 5 10 CBBE CN=c1[nH]c(N(C)[C@@H]2COC[C@H]2O)ncc1[N+](=O)[O-] 2101471370 YLEPHENXRNGXBK-HTQZYQBOSA-N 269.261 -0.956 5 10 CBBE CN=c1[nH]c(N2CC(=O)N[C@@H](C)C2)ncc1[N+](=O)[O-] 2101474926 ZQQMWNMOAJVUMR-LURJTMIESA-N 266.261 -0.827 5 10 CBBE N[C@@H]1C[C@H]2C[C@H]1C[C@@]2(C(=O)O)n1cnc([N+](=O)[O-])n1 2108223516 DIRSPWXIMGXBLZ-MPXCPUAZSA-N 267.245 -0.277 5 10 CBBE NNc1ncnc(N2CC([C@@H](F)CO)C2)c1[N+](=O)[O-] 2110592987 YEJSWMCOHXDRNU-LURJTMIESA-N 272.240 -0.563 5 10 CBBE CO[C@@H]1C[C@H](CN)N(c2ncnc(N)c2[N+](=O)[O-])C1 2117168549 HUFCZCIYLXSVKO-RNFRBKRXSA-N 268.277 -0.481 5 10 CBBE Nc1cccc(N2CCS(=O)(=O)CCN2)c1[N+](=O)[O-] 2117169707 WUGYLGUDVNKHHI-UHFFFAOYSA-N 286.313 -0.084 5 10 CBBE N=c1[nH]c(=NC[C@H]2CNCCCO2)[nH]cc1[N+](=O)[O-] 2117198376 AMWNARRGQCHFOR-SSDOTTSWSA-N 268.277 -0.990 5 10 CBBE NC[C@@]12CN(c3ncc([N+](=O)[O-])cn3)C[C@H]1CCO2 2118554451 FFAGRNHVCPFWGV-LDYMZIIASA-N 265.273 -0.061 5 10 CBBE COC[C@H](N)COc1ncc([N+](=O)[O-])cc1C(N)=O 2119769616 ROKLBIUSBAZXJP-LURJTMIESA-N 270.245 -0.559 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2CC[C@H](CO)[C@H](N)C2)[nH]1 2122347656 LAHWGXHJWLNKAE-VXNVDRBHSA-N 267.289 -0.452 5 10 CBBE C[C@H]1CNC(=O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 2124756454 NHYHCXZNDXIREH-ZETCQYMHSA-N 267.245 -0.862 5 10 CBBE C[C@@H]1CNC[C@@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C 2129976011 RFLHIRUWLGVZIW-HTQZYQBOSA-N 267.289 -0.086 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3C[C@@H](O)[C@H]2C3)n1 2129999320 SQHHXDPTZGEGLO-ZXFLCMHBSA-N 266.257 -0.076 5 10 CBBE CNS(=O)(=O)C1CN(c2cc([N+](=O)[O-])cc(=N)[nH]2)C1 2130755569 KDSJMOFCCJHGJP-UHFFFAOYSA-N 287.301 -0.860 5 10 CBBE N[C@@H]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccn2)C1 2137720969 GWRSAETWTKBWFJ-MRVPVSSYSA-N 265.273 -0.039 5 10 CBBE CN=c1nc(N2C[C@H](CO)C[C@@H]2CO)c([N+](=O)[O-])c[nH]1 2146074414 XRZKAXKLJJQBBO-HTQZYQBOSA-N 283.288 -0.972 5 10 CBBE N=c1cc(C(=O)N2CC(N3CCC3)C2)c([N+](=O)[O-])c[nH]1 2152247972 HDOAADYIUSISFQ-UHFFFAOYSA-N 277.284 -0.068 5 10 CBBE CN(C)c1nc(NCc2nnn(C)n2)ncc1[N+](=O)[O-] 2157669851 MSLHGFZCSRXJLL-UHFFFAOYSA-N 279.264 -0.414 5 10 CBBE COc1nc(=NC[C@H](CC(=O)O)OC)[nH]cc1[N+](=O)[O-] 2157675783 KZZCURBPNZOFFH-LURJTMIESA-N 286.244 -0.283 5 10 CBBE Nc1nc(N2CC[C@@](O)(CC(=O)O)C2)ccc1[N+](=O)[O-] 2160853886 KAQXWPQYXIGGRZ-LLVKDONJSA-N 282.256 -0.012 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2CC(N3CCNCC3)C2)[nH]1 2173954573 JRKIUUYNIGKAHO-UHFFFAOYSA-N 278.316 -0.504 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@@H](O)[C@H](CC(=O)O)C2)n1 2174356263 TZBNCQHNGJKJEJ-GMSGAONNSA-N 284.272 -0.404 5 10 CBBE N[C@@H]1C[C@H](O)CN(C(=O)c2cccc([N+](=O)[O-])c2O)C1 2174776416 UTVRTETUQQHOPX-SFYZADRCSA-N 281.268 -0.166 5 10 CBBE CNc1ncnc(N2CCC[C@@H]2[C@@H](O)CO)c1[N+](=O)[O-] 2179799800 PLNUJOQDJKZDKB-SFYZADRCSA-N 283.288 -0.252 5 10 CBBE NC[C@H]1C[C@@H](O)CN1c1nccc(C(=O)O)c1[N+](=O)[O-] 2181127461 UTRQARLDDMTTOY-RNFRBKRXSA-N 282.256 -0.414 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)C[C@H]2CC[C@@H](N2)[C@@H]1F 2190657895 RTEKASFKTJWAQD-JQCUSGDOSA-N 285.235 -0.171 5 10 CBBE O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CNCCS1(=O)=O 2197789456 MVIUGGGQAPWFEB-JTQLQIEISA-N 299.308 -0.080 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N2CC[C@@H](O)[C@](C)(O)C2)[nH]1 2201487277 SIOLHYLCDVUZCC-BXKDBHETSA-N 282.300 -0.225 5 10 CBBE CC(=O)N[C@H](Cn1ccc(C)c([N+](=O)[O-])c1=O)C(=O)O 2203256205 TYBCDHSAFBZIDK-MRVPVSSYSA-N 283.240 -0.346 5 10 CBBE CN1CCN(c2cc(NN)ccc2[N+](=O)[O-])[C@H](CO)C1 2206797314 FOKNONPWUPSMFG-JTQLQIEISA-N 281.316 -0.007 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@@H]2COCC[C@H]2N)[nH]1 2222998558 PNWUONJJCVBJFS-HTQZYQBOSA-N 255.278 -0.239 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H](N)C2CC2)n1 2223844529 UVHPRXDFOFCZSF-VIFPVBQESA-N 253.262 -0.318 5 10 CBBE NNc1cc(N2C[C@H](O)C[C@@H](O)C2)ccc1[N+](=O)[O-] 2226056615 LHPNNIVLSPGWTH-RKDXNWHRSA-N 268.273 -0.188 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC2(c3nn[nH]n3)CC2)[nH]1 2230755885 XCLCFKYCHMQUDA-UHFFFAOYSA-N 264.249 -0.153 5 10 CBBE COC(=O)[C@@](C)(O)CNCc1nn(C)cc1[N+](=O)[O-] 2231915548 CLCZDSUOQIOQFL-JTQLQIEISA-N 272.261 -0.658 5 10 CBBE C[C@H](CN=c1ccc([N+](=O)[O-])c(N)[nH]1)[C@]1(O)CCNC1 2238411063 FNKGEBKUEIJZPT-PELKAZGASA-N 281.316 -0.234 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NCc2nnn(C)n2)[nH]1 2258616672 RSSLRWLNSMBXPC-UHFFFAOYSA-N 250.222 -0.749 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]3CO[C@H]2C3)[nH]1 2313113585 DULDKIZNYNVBEJ-BBVRLYRLSA-N 251.246 -0.191 5 10 CBBE Cn1[nH]c(=NC[C@@H]2C[C@@H](O)C2(C)C)nc1[N+](=O)[O-] 2321694938 WELMKDFEHXRDPD-NKWVEPMBSA-N 255.278 -0.036 5 10 CBBE Cn1nc(N2CC3(C[C@@H]3C(=O)O)C2)nc1[N+](=O)[O-] 2321761359 RCYKXJYKRNDRFM-RXMQYKEDSA-N 253.218 -0.366 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@@H](CN)C2(C)C)nc1[N+](=O)[O-] 2321761656 VFCXDJREGGTAPA-NKWVEPMBSA-N 254.294 -0.070 5 10 CBBE Cn1[nH]c(=N[C@@H]2C=C[C@H](C(=O)O)C2)nc1[N+](=O)[O-] 2321765032 NVJKXGGEIOVJKO-NTSWFWBYSA-N 253.218 -0.414 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@H]2C[C@@H]3CN[C@H]2C3)c1[N+](=O)[O-] 2330450079 DBIAQQSJVAYXNY-CSMHCCOUSA-N 264.289 -0.310 5 10 CBBE CO[C@@H]1C[C@@H](N)CN(Cc2nn(C)cc2[N+](=O)[O-])C1 2344691259 BBNRDYLHTODTPJ-RKDXNWHRSA-N 269.305 -0.124 5 10 CBBE Cn1ccnc1CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 45134261 SQWCUCZPLUPEIJ-LLVKDONJSA-N 294.315 -0.282 5 10 CBBE COC[C@H](O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 50469814 SWENSCIJEPFPAT-MRVPVSSYSA-N 272.261 -0.743 5 10 CBBE C[C@H](CNC1CC1)Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O 70527749 SCANOPFHRGADTM-SSDOTTSWSA-N 268.273 -0.167 5 10 CBBE COC[C@H](O)CNc1ncnc(OC)c1[N+](=O)[O-] 94739627 PXOPEEFPAGODSE-ZCFIWIBFSA-N 258.234 -0.187 5 10 CBBE CCNCCCn1c(=O)c([N+](=O)[O-])cn(C)c1=O 111545325 AGUOJVPZJCMPEH-UHFFFAOYSA-N 256.262 -0.545 5 10 CBBE COC[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 159050024 APEVGWUNMJDIDS-ZETCQYMHSA-N 257.202 -0.248 5 10 CBBE CN1CCN(c2ncc([N+](=O)[O-])cn2)[C@@H](CN)C1 226623043 PKMKHJCWBVHBAB-QMMMGPOBSA-N 252.278 -0.536 5 10 CBBE NC(=O)[C@H](O)CNc1cc(C(=O)O)ccc1[N+](=O)[O-] 228772245 LANHYZOKLSYKSD-MRVPVSSYSA-N 269.213 -0.449 5 10 CBBE CN1CCCN(c2nc(NN)ccc2[N+](=O)[O-])CC1=O 228889539 PCLYNDWTBJGUML-UHFFFAOYSA-N 280.288 -0.056 5 10 CBBE O=C(O)c1nn([C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-] 229737251 RHAIRSZPNIZLFY-RXMQYKEDSA-N 275.242 -0.151 5 10 CBBE Cc1nc(N)nc(NN2CCN(C)CC2)c1[N+](=O)[O-] 234334401 ZJJZRLHVKIQLEE-UHFFFAOYSA-N 267.293 -0.150 5 10 CBBE C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC(=O)N1C 285896220 JKKMGNCVYLIYSZ-LURJTMIESA-N 267.245 -0.379 5 10 CBBE CC(=O)NCCN(C)c1nc(N)nc(C)c1[N+](=O)[O-] 308315202 UXTFQZMRMGJWQZ-UHFFFAOYSA-N 268.277 -0.152 5 10 CBBE CN1CCN(NC(=O)c2cc([N+](=O)[O-])ncc2N)CC1 312284152 IOBLVDQBCIEVON-UHFFFAOYSA-N 280.288 -0.536 5 10 CBBE Nc1[nH]c(=NCC[C@@]2(O)CCOC2)ccc1[N+](=O)[O-] 404171927 OZRTVXKGXNCCJA-LLVKDONJSA-N 268.273 -0.053 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1NCC1CS(=O)(=O)C1 701878761 XFMLVLQGRSSHJU-UHFFFAOYSA-N 276.249 -0.020 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2C[C@@H](CO)[C@@H](CO)C2)n1 704817281 XBRFTYACSPYUDP-OCAPTIKFSA-N 283.288 -0.688 5 10 CBBE CNC[C@@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])c[nH]1 708836185 GXGDFNXXTRYPNB-MRVPVSSYSA-N 256.262 -0.425 5 10 CBBE CN(C)C[C@H](CO)Nc1ccc(N)c([N+](=O)[O-])n1 716687821 RZNGEVUQPVDWPQ-SSDOTTSWSA-N 255.278 -0.094 5 10 CBBE O=c1nc(O)c([N+](=O)[O-])cn1C[C@@H]1C[C@@H]2COC[C@@H]2O1 724646271 ITRRDRAPYFHGPS-FJXKBIBVSA-N 283.240 -0.339 5 10 CBBE C[C@H](COC(=O)Cn1cc([N+](=O)[O-])cn1)[N+](=O)[O-] 813108676 JPNGGVHSMJWDNH-ZCFIWIBFSA-N 258.190 0.000 5 10 CBBE NNc1cccc(C(=O)N[C@@H]2CCNC2=O)c1[N+](=O)[O-] 822132602 FRELHTCBWZGXIL-MRVPVSSYSA-N 279.256 -0.501 5 10 CBBE CCS(=O)(=O)C[C@H](C)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126129533 QMAUVOUUFCJUDN-XLPZGREQSA-N 264.303 -0.409 5 10 CBBE NC(=O)c1ccnc(N2CCn3cnnc3C2)c1[N+](=O)[O-] 1143702124 IGRLWZIIMGXWLC-UHFFFAOYSA-N 289.255 -0.300 5 10 CBBE NC(=O)[C@H]1CN(c2cc(F)c([N+](=O)[O-])cc2CO)CCO1 1185089345 VDDZRGZUZRVMBK-LLVKDONJSA-N 299.258 -0.083 5 10 CBBE CN1C[C@@H](CCNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 1288924101 PPUMUPMWASMKSD-VIFPVBQESA-N 295.299 -0.224 5 10 CBBE Cn1cc(CN2CCn3c(O)nnc3C2)c([N+](=O)[O-])n1 1307654379 PWFQNUUMLNGVBH-UHFFFAOYSA-N 279.260 -0.359 5 10 CBBE O=C1NCCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 1445715308 LQPWULGOADZHHU-VIFPVBQESA-N 281.272 -0.566 5 10 CBBE CCN(CCNCc1nnc(C)o1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1482925019 PUDYRFZAQSRPQZ-NXEZZACHSA-N 297.315 -0.019 5 10 CBBE Cn1cc(CN2CC[C@H](c3nn[nH]n3)C2)c([N+](=O)[O-])n1 1560101094 BQESFVHQWGRPIR-ZETCQYMHSA-N 278.276 -0.169 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC=C(N)N1 1610973971 GODWJLHTIKXZKK-UHFFFAOYSA-N 266.261 -0.363 5 10 CBBE CNC(=O)[C@H]1CNCCN1c1cnc(C)cc1[N+](=O)[O-] 1918350748 XAFDGIHNFFQBIR-LLVKDONJSA-N 279.300 -0.178 5 10 CBBE CCn1cc([N+](=O)[O-])cc1C(=O)NC1(CO)CNC1 1918430622 YMOYITAHLFESTR-UHFFFAOYSA-N 268.273 -0.520 5 10 CBBE NC(=O)[C@H]1C[C@@H](N)CN(c2cccc([N+](=O)[O-])n2)C1 1925595233 QTQJTFIOSISCEW-JGVFFNPUSA-N 265.273 -0.371 5 10 CBBE Cc1[nH]c(=NC[C@H](O)C(N)=O)c(Cl)cc1[N+](=O)[O-] 1965600227 AMKZHSDCOBMAGR-ZETCQYMHSA-N 274.664 -0.368 5 10 CBBE NS(=O)(=O)c1cn(C[C@H]2C[C@@H]2F)nc1[N+](=O)[O-] 2014752393 IWBAOEQACWDWQG-UHNVWZDZSA-N 264.238 -0.203 5 10 CBBE O=[N+]([O-])c1c(F)nc[nH]c1=NC[C@H]1CNCCO1 2044044760 QLHUKJFKVXRGSZ-ZCFIWIBFSA-N 257.225 -0.654 5 10 CBBE NCCO[C@@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 2049889031 UKVMEIXBGZYOQC-SECBINFHSA-N 253.262 -0.061 5 10 CBBE COc1ccc([N+](=O)[O-])c(N[C@@H](CO)C(=O)O)n1 2054772023 GDBVCXYTGOKBIR-YFKPBYRVSA-N 257.202 -0.144 5 10 CBBE CO[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H]1N 2058639725 QBCJYRMQQZMMAZ-SVRRBLITSA-N 254.246 -0.279 5 10 CBBE CN1C[C@H]2C[C@H]1CN2c1ncc([N+](=O)[O-])c(=N)[nH]1 2067394830 OJQDXOYWQDXUNA-NKWVEPMBSA-N 250.262 -0.310 5 10 CBBE Nc1ccnc(N2CC[C@@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 2068371108 UHSJYOZWUALVKT-SFYZADRCSA-N 254.246 -0.496 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)COCC1(F)F 2076468941 VFQRAHDWHZMRGN-ZCFIWIBFSA-N 264.144 -0.368 5 10 CBBE CN(CCN)CC(=O)Nc1ccc([N+](=O)[O-])cn1 2082426908 CHTYBIPIKCUDGP-UHFFFAOYSA-N 253.262 -0.181 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCc2cn(C)cn2)c1[N+](=O)[O-] 2088025114 MIIGXFPRGUSNHE-UHFFFAOYSA-N 263.261 -0.127 5 10 CBBE Cc1nc([N+](=O)[O-])cn1[C@]1(C(=O)O)CCS(=O)(=O)C1 2088925803 NMISKZWXBISINS-SECBINFHSA-N 289.269 -0.302 5 10 CBBE CN=c1nc(N2C[C@@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])c[nH]1 2090124762 PALIPEAUZULAMV-CPCISQLKSA-N 265.273 -0.333 5 10 CBBE CO[C@H]1CNCC[C@@H]1N=c1ccc([N+](=O)[O-])c(N)[nH]1 2090584142 QFAMKMRQINWVQM-CBAPKCEASA-N 267.289 -0.217 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NC[C@@H]2COC[C@H]2O)[nH]1 2097831200 MJTADWSNFJVVFV-VXNVDRBHSA-N 268.273 -0.127 5 10 CBBE Nc1[nH]c(=NC[C@@H]2C[C@@H](O)CCO2)ccc1[N+](=O)[O-] 2097941847 MBKVLXXPVJHWPA-YUMQZZPRSA-N 268.273 -0.054 5 10 CBBE COc1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@@H](O)C2)n1 2105109124 WNAOEJYCYSWSNP-OCAPTIKFSA-N 269.257 -0.070 5 10 CBBE COC(=O)[C@H]1C[C@@H]1Cn1cc([N+](=O)[O-])c(O)nc1=O 2115384993 IJJLVYWPNDZSNM-RITPCOANSA-N 269.213 -0.334 5 10 CBBE N=c1[nH]c(N2CC[C@H](OCCN)C2)ncc1[N+](=O)[O-] 2117204025 WMELCOMJDKUVQF-ZETCQYMHSA-N 268.277 -0.649 5 10 CBBE N=c1nc(N2CC[C@H]3CNC[C@H]3C2)c([N+](=O)[O-])c[nH]1 2117229997 QXXDITQDAIXMPD-YUMQZZPRSA-N 264.289 -0.157 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@H]2COCC[C@@H]2N)[nH]1 2117248483 LYSJKHRGLUJKMZ-IUCAKERBSA-N 267.289 -0.019 5 10 CBBE CN(C)C[C@@H]1C[C@H](Oc2c([N+](=O)[O-])ncn2C)CN1 2119764804 CHHOHSDUWVWVES-IUCAKERBSA-N 269.305 -0.001 5 10 CBBE Cc1nn(C)c(O[C@H]2CS(=O)(=O)C[C@H]2N)c1[N+](=O)[O-] 2121464250 KAXCQADAMTXFOH-RQJHMYQMSA-N 290.301 -0.860 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H]2[C@@H](O)C[C@@H]21 2121669495 VPMVDABFLNTDQA-GUBZILKMSA-N 266.257 -0.227 5 10 CBBE CC1(C)[C@H](O)[C@H](O)CN1c1[nH]c(=N)ccc1[N+](=O)[O-] 2124794536 BVAVVEYJVIIVBG-VXNVDRBHSA-N 268.273 -0.277 5 10 CBBE CN=c1cc(C(=O)N2C[C@@H](O)[C@@H]2C)c([N+](=O)[O-])c[nH]1 2126122525 KOECUBWLPGYHAI-IMTBSYHQSA-N 266.257 -0.341 5 10 CBBE Cc1nccc(O[C@H]2CS(=O)(=O)C[C@@H]2N)c1[N+](=O)[O-] 2126954234 ATAUYQAWLATDDK-CBAPKCEASA-N 287.297 -0.199 5 10 CBBE CNC1(C(N)=O)CN(c2ccnc(C)c2[N+](=O)[O-])C1 2126955718 GOTGUAWCWKRDNP-UHFFFAOYSA-N 265.273 -0.438 5 10 CBBE Nc1ccc(O[C@H]2CN[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 2128114718 GFLOLAANVICXEH-IYSWYEEDSA-N 268.229 -0.234 5 10 CBBE Nc1cc(N2C[C@H](O)[C@@H](O)[C@H]2CO)cc([N+](=O)[O-])c1 2136343735 YCZZWMQWMKCHTP-VWYCJHECSA-N 269.257 -0.920 5 10 CBBE Nc1ncnc(N2CC[C@@H]3CC(=O)N[C@H]3C2)c1[N+](=O)[O-] 2145073978 QIVCXYHYYOAXPB-RQJHMYQMSA-N 278.272 -0.318 5 10 CBBE CO[C@H](CN=c1[nH]cnc(N)c1[N+](=O)[O-])[C@H]1CCOC1 2150214278 DHPCWZKIAKZCGR-JGVFFNPUSA-N 283.288 -0.148 5 10 CBBE N=c1[nH]c(N2CCCCC2(CO)CO)ncc1[N+](=O)[O-] 2157638892 IIORHRUDBHZINF-UHFFFAOYSA-N 283.288 -0.489 5 10 CBBE COc1nc(N2CC[C@@](N)(C(=O)O)C2)ncc1[N+](=O)[O-] 2157678748 PTFPJCGJZXBEIJ-JTQLQIEISA-N 283.244 -0.614 5 10 CBBE O=C(O)[C@@]12COC[C@H]1CN(c1ncc([N+](=O)[O-])cn1)C2 2160989229 IQMCZFIFYDNZFK-HQJQHLMTSA-N 280.240 -0.078 5 10 CBBE CCOC1(CO)CN(c2ncnc(OC)c2[N+](=O)[O-])C1 2172997073 IBCJKDPVZQJAML-UHFFFAOYSA-N 284.272 -0.019 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@H](F)C2CNC2)[nH]1 2173750443 VGVSNYPAJGPMEP-QMMMGPOBSA-N 284.295 -0.452 5 10 CBBE NNc1cc(N[C@H]2CCO[C@H]2C(N)=O)cc([N+](=O)[O-])c1 2174107728 QXNVFHUZGACHPB-VHSXEESVSA-N 281.272 -0.065 5 10 CBBE CN1C[C@@H](N)[C@H](Oc2ncc([N+](=O)[O-])cc2C(N)=O)C1 2176303619 DCSXSOWYNVGNCW-RKDXNWHRSA-N 281.272 -0.891 5 10 CBBE NC(=O)C1(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CNC1 2176413567 KJZJPEGWJJBKPK-UHFFFAOYSA-N 282.212 -0.291 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2[C@@H]3CCCO[C@H]32)c1 2176417883 DMGCYWHMRPBCJP-WRWGMCAJSA-N 282.300 -0.081 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H]1CNC(=O)C(C)(C)C1 2182230018 DGIZKJFPTGEIFY-ZETCQYMHSA-N 282.304 -0.281 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[C@H](C2)[C@@H](O)[C@H]3O)[nH]1 2182537651 KGIQFAORWHWGEP-BJPCUFFRSA-N 280.284 -0.420 5 10 CBBE Cn1[nH]c(CCN)nc1=NC(=O)c1ccc([N+](=O)[O-])o1 2183125359 JALXPBCJDHREHC-UHFFFAOYSA-N 280.244 -0.508 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1O[C@H]1C[C@@H]2CNCCN2C1 2184655338 BKEDLODCEUZNNH-SFYZADRCSA-N 283.263 -0.051 5 10 CBBE NC1CN(S(=O)(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 2191527793 AUIFUHHENZKMKQ-UHFFFAOYSA-N 298.324 -0.202 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@](C)(O)[C@H](O)C1 2197968940 VYAXRSABPGFXCR-LDYMZIIASA-N 284.272 -0.714 5 10 CBBE C[C@]1(O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1O 2197968965 XBMXIXJNSTTZNY-KWQFWETISA-N 284.272 -0.865 5 10 CBBE Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1NC[C@@H](O)[C@@H]1O 2201150723 VMQXEPHNRMEVPD-MXWKQRLJSA-N 281.268 -0.465 5 10 CBBE O=c1ccn([C@H]2CC(CO)(CO)C[C@@H]2O)cc1[N+](=O)[O-] 2206358058 CUYQQTIKHPEZKL-KWQFWETISA-N 284.268 -0.577 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)c2cc(=N)[nH][nH]2)n1 2231917158 BQRCEGLZYSTIEO-UHFFFAOYSA-N 265.233 -0.606 5 10 CBBE CC(C)n1ncc([N+](=O)[O-])c1NCC(CO)(CO)CO 2240588604 DLOLVSSUXGSXBK-UHFFFAOYSA-N 288.304 -0.253 5 10 CBBE CN(CCC(=O)O)C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2240624032 QPWZHXQRSAWLIV-UHFFFAOYSA-N 285.260 -0.056 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2[C@H]3CCCN[C@H]32)n1 2240634282 OGHKCJZBHATLIV-AVPPRXQKSA-N 279.300 -0.058 5 10 CBBE 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N[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])C(=O)O 323567482 JRMTUCUVIFJGAH-QMMMGPOBSA-N 267.241 -0.335 5 10 CBBE CC1(C)[C@@H](O)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 361420757 PIZKTBPPTNTXPI-MNOVXSKESA-N 284.316 -0.003 5 10 CBBE CC1(C)[C@@H](O)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 361420759 PIZKTBPPTNTXPI-QWRGUYRKSA-N 284.316 -0.003 5 10 CBBE CCNC(=O)C1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 362876885 RKNNXNNUHJZPLW-UHFFFAOYSA-N 266.261 -0.461 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CO)C1CCC1 597921199 KYRWVJOKJAMIEN-QMMMGPOBSA-N 269.261 -0.537 5 10 CBBE COC(=O)CCNC(=O)CCNc1ncc([N+](=O)[O-])cn1 599170495 RRUTVPOQIOZTHM-UHFFFAOYSA-N 297.271 -0.134 5 10 CBBE CC[C@H](CCO)NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599245121 QGGUJBZNDBHURO-SSDOTTSWSA-N 292.317 -0.232 5 10 CBBE Cc1nn(CC(=O)N(C)C[C@@H](O)CN)c(C)c1[N+](=O)[O-] 700750778 XEQLVSQOTNBSAC-VIFPVBQESA-N 285.304 -0.814 5 10 CBBE NCC1(Nc2ccc(C(N)=O)c([N+](=O)[O-])c2)COC1 705684656 MNWGLAUZASHGCJ-UHFFFAOYSA-N 266.257 -0.167 5 10 CBBE Nc1nc(N[C@H]2CCNC[C@H]2O)ccc1[N+](=O)[O-] 710416686 GTHLIQDZRUIEHH-POYBYMJQSA-N 253.262 -0.293 5 10 CBBE NC(=O)NCCNC(=O)Cc1ccccc1[N+](=O)[O-] 735810108 JLTNRIZIMGTLKR-UHFFFAOYSA-N 266.257 -0.078 5 10 CBBE COC(=O)C1=NO[C@]2(CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 1471260364 KSNCJUPYXFJPBY-JWKOBGCHSA-N 297.267 -0.428 5 10 CBBE Nc1nc(N2C[C@@H](CO)[C@H](CCO)C2)ncc1[N+](=O)[O-] 1472902299 KMVQXFTVFIQJQY-SFYZADRCSA-N 283.288 -0.606 5 10 CBBE CN1C[C@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@@H]2C1 1614894725 VNJXPGNVFSXYOU-IUCAKERBSA-N 280.288 -0.794 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CCS(=O)(=O)CC1 1626767840 CJYKSHMCMGMFCV-UHFFFAOYSA-N 288.285 -0.801 5 10 CBBE CN(CCS(N)(=O)=O)c1cccnc1[N+](=O)[O-] 1652188333 BRTKVOHOXQYRRO-UHFFFAOYSA-N 260.275 -0.286 5 10 CBBE CC(C)(O)CC(=O)N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1688020038 SCVGKQHQKIBQQE-ZYUZMQFOSA-N 299.327 -0.424 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[C@@H]2[C@H]1CO 1905847149 LDPMJURHRHFOHJ-ACLDMZEESA-N 266.257 -0.219 5 10 CBBE COc1ncnc(N[C@@H](C)C2(O)CNC2)c1[N+](=O)[O-] 1918665866 HTDPWWSJUVYIGD-LURJTMIESA-N 269.261 -0.472 5 10 CBBE Cc1cc([N+](=O)[O-])nn1C[C@H]1CCS(=O)(=O)N1 1942338889 YKNGBTCOEWEGER-SSDOTTSWSA-N 260.275 -0.209 5 10 CBBE C[C@@]1(O)CON(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 1962998721 PYLBOECQCPGAEG-JTQLQIEISA-N 268.229 -0.290 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CNCCOC1 1971146965 NRHUKCMBLUJFML-VIFPVBQESA-N 282.300 -0.101 5 10 CBBE O=c1nc(O)c([N+](=O)[O-])cn1C[C@@H](O)C(F)F 2008306944 ANYLJSPTOLJOFK-SCSAIBSYSA-N 251.145 -0.517 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N2CC[C@H]2C(N)=O)[nH]1 2028915920 UPKORXKZAQMSGS-ZETCQYMHSA-N 251.246 -0.483 5 10 CBBE Nc1nc(OC[C@H]2COC[C@H]2N)ccc1[N+](=O)[O-] 2029852672 YIKVJJOMTATNGW-RNFRBKRXSA-N 254.246 -0.076 5 10 CBBE Nc1ccc(=N[C@H](CO)CCCO)[nH]c1[N+](=O)[O-] 2029919845 PGFNOULKBAKTOP-ZETCQYMHSA-N 256.262 -0.461 5 10 CBBE O=[N+]([O-])c1ncn(C[C@H]2C[C@@]3(CCNC3)CO2)n1 2034592789 PPEXEQGKYBJNIM-PSASIEDQSA-N 253.262 -0.045 5 10 CBBE NC[C@H]1COC[C@@H]1Nc1nccc(N)c1[N+](=O)[O-] 2053554690 VRDXTFQNCQNQJI-XPUUQOCRSA-N 253.262 -0.042 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCCCCCN)[nH]1 2053595532 NDOYNZFHCVGCOA-UHFFFAOYSA-N 254.294 -0.189 5 10 CBBE N=c1nc(N2C[C@@H]3C[C@@H]3[C@@H]2CN)c([N+](=O)[O-])c[nH]1 2078275252 UTQAJZPQYDRHJJ-ACZMJKKPSA-N 250.262 -0.419 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC[C@@H](O)C[C@@H]1CO 2080495571 JDPGHZRRNZZYIF-RNFRBKRXSA-N 257.250 -0.955 5 10 CBBE CN(C)C[C@H](N)C(=O)Nc1cc([N+](=O)[O-])ccn1 2082433453 VIOCSAQMMCEZEF-QMMMGPOBSA-N 253.262 -0.183 5 10 CBBE Nc1nc(OC2CC(N)(C(=O)O)C2)ccc1[N+](=O)[O-] 2087694913 IBYIMEGEAWLJAO-UHFFFAOYSA-N 268.229 -0.105 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@H]3C[C@@]3(CO)C2)c1[N+](=O)[O-] 2090124652 NYLKWWIBHKJRLC-HQJQHLMTSA-N 265.273 -0.076 5 10 CBBE CNc1ncnc(N[C@H]2CN(C)C[C@H]2O)c1[N+](=O)[O-] 2090357407 YLUXFILXZHRPGN-NKWVEPMBSA-N 268.277 -0.487 5 10 CBBE O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@H]2C[C@@]1(CO)CO2 2094651110 KKGQIZXIMDAFLA-LDYMZIIASA-N 267.241 -0.101 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@@H](O)C[C@]2(C)CO)n1 2102864261 DWDFWNBORFGJSQ-GZMMTYOYSA-N 270.289 -0.354 5 10 CBBE CC(C)[C@@H](N=c1nc([N+](=O)[O-])[nH]n1C)C(=O)N(C)C 2102931162 BQDADSJKCMJQRT-SSDOTTSWSA-N 270.293 -0.330 5 10 CBBE CO[C@H]1C[C@H](C(=O)O)N(c2nc([N+](=O)[O-])nn2C)C1 2102936813 JGGOOJPQHLZBMF-NTSWFWBYSA-N 271.233 -0.598 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1C=CC[C@H](C(=O)O)C1 2102942458 XFHKQLJTBVDJCO-NKWVEPMBSA-N 267.245 -0.024 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCC12CC(CO)(CO1)C2 2103257765 CUWZRYVUMBAMGD-UHFFFAOYSA-N 269.261 -0.901 5 10 CBBE N[C@H]1COC[C@@H]1Nc1cnc([N+](=O)[O-])cc1C(=O)O 2105930668 DDWNLXZVZZLHFG-XPUUQOCRSA-N 268.229 -0.174 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1CCO[C@H]2CNC[C@@H]21 2106537071 BJBKXQBIZHYZOW-BQBZGAKWSA-N 269.236 -0.299 5 10 CBBE CO[C@H]1C[C@@H](O)CN(c2ncnc(N)c2[N+](=O)[O-])C1 2109022573 XIVNUBNZCRJHSO-RQJHMYQMSA-N 269.261 -0.447 5 10 CBBE Nc1cc(=NCCCCS(N)(=O)=O)[nH]cc1[N+](=O)[O-] 2109585849 PFZNQPOTQQDOKD-UHFFFAOYSA-N 289.317 -0.526 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N2CCC[C@@](N)(CO)C2)[nH]1 2117214937 DBVYDSHYZBHQAI-NSHDSACASA-N 267.289 -0.308 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CC23CCNCC3)[nH]1 2117266927 KHSLCUKKNJWWFL-MRVPVSSYSA-N 264.289 -0.227 5 10 CBBE Nc1cnc([N+](=O)[O-])cc1C(=O)N[C@H]1[C@H]2COC[C@H]21 2118048892 RPKZFISKBAESJS-LYIWLLOFSA-N 264.241 -0.053 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1[C@H]2CCN[C@@H]2C1(C)C 2119350915 NMNFPWRAYNYAJM-BIIVOSGPSA-N 266.305 -0.056 5 10 CBBE COc1nc(N2C[C@@H](N)[C@H](OC)C2)ncc1[N+](=O)[O-] 2122653171 NMXGWBNDYPJGBX-HTRCEHHLSA-N 269.261 -0.444 5 10 CBBE CN=c1[nH]c(OC[C@]2(F)CCNC2)ncc1[N+](=O)[O-] 2128116167 XCEAALXOFUGKBU-JTQLQIEISA-N 271.252 -0.071 5 10 CBBE N[C@H]1COC[C@H]1Oc1nc(C(=O)O)ccc1[N+](=O)[O-] 2128123353 YICWMABSJAHCPD-YLWLKBPMSA-N 269.213 -0.207 5 10 CBBE NNc1cnc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCO1 2133032908 CHCCNTCJFGJJEP-ZCFIWIBFSA-N 267.245 -0.206 5 10 CBBE C[C@]1(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])COCCN1 2137704881 RLJTYYXVZCXXCB-LLVKDONJSA-N 266.257 -0.271 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=N[C@@H]2CC[C@@H](C(N)=O)C2)[nH]1 2146202964 ITSDEYGWAIEQDE-PHDIDXHHSA-N 281.276 -0.842 5 10 CBBE CCN=c1cc([N+](=O)[O-])cc(N[C@@H]2CN(C)C[C@@H]2O)[nH]1 2146540649 NECWZZGXCDUWJT-ZJUUUORDSA-N 281.316 -0.070 5 10 CBBE CN=c1[nH]c(-n2nnc(C(F)(F)F)n2)ncc1[N+](=O)[O-] 2157676277 YKUPJPMREZPIAI-UHFFFAOYSA-N 290.165 -0.157 5 10 CBBE COc1nc(=NCCO[C@@H]2CCNC2)[nH]cc1[N+](=O)[O-] 2165426445 DSFGOYICFTVKMA-MRVPVSSYSA-N 283.288 -0.394 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCc2ccc(O)nn2)[nH]1 2173729066 LEGOTMUVTIDZTI-UHFFFAOYSA-N 277.244 -0.622 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCC2(OC)OC)[nH]1 2173739083 RDHYYFIFSICMNK-QMMMGPOBSA-N 283.288 -0.166 5 10 CBBE CN=c1nc(N2CC[C@H](OCCN)C2)c([N+](=O)[O-])c[nH]1 2173742603 PWQHOGCSVNRKKO-QMMMGPOBSA-N 282.304 -0.598 5 10 CBBE COc1nc(=NC[C@@H]2CCN(C)C2=O)[nH]cc1[N+](=O)[O-] 2194628337 YUXAEXXQKVMVEC-ZETCQYMHSA-N 281.272 -0.295 5 10 CBBE Cc1nc(CN2CC(OCC(N)=O)C2)ccc1[N+](=O)[O-] 2195967449 JYBBIGMAHJHLCN-UHFFFAOYSA-N 280.284 -0.016 5 10 CBBE NNc1cc([N+](=O)[O-])cc(N2C[C@H](O)[C@H](O)[C@@H]2CF)n1 2205621128 ZRTKTFXEMPHECQ-MHYGZLNHSA-N 287.251 -0.845 5 10 CBBE CC(C)n1ncc([N+](=O)[O-])c1NC[C@H](O)C(N)=O 2223815684 VQCYNHOWVHVGBP-ZETCQYMHSA-N 257.250 -0.370 5 10 CBBE COC(=O)[C@H](CC(=O)O)Nc1ncncc1[N+](=O)[O-] 2226987647 UMIMPRCCQWAJPR-YFKPBYRVSA-N 270.201 -0.187 5 10 CBBE O=[N+]([O-])c1cncnc1N1C[C@@H]2C[C@H](C1)[C@@H](O)[C@H]2O 2226991605 TZTVGAWJTOJXOI-OXMRFTEPSA-N 266.257 -0.437 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@@H]1C[C@H]2OCC[C@H]2N1 2227002117 MGKGGTBDZKNBPD-QXFUBDJGSA-N 265.273 -0.262 5 10 CBBE COC[C@@H]1[C@@H](O)[C@@H](O)CN1c1cnc(C)cc1[N+](=O)[O-] 2233867682 AOHRDDRHVDAFGN-GRYCIOLGSA-N 283.284 -0.145 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N(CCN)C[C@H](C)O)[nH]1 2269808586 RJBWTYMJNUAUAK-QMMMGPOBSA-N 269.305 -0.401 5 10 CBBE Cc1ncc([N+](=O)[O-])c(OC2(CN)CS(=O)(=O)C2)n1 2271069045 RCCJNJBSVHROKJ-UHFFFAOYSA-N 288.285 -0.802 5 10 CBBE CCn1nnnc1CN=c1[nH]c(C)ncc1[N+](=O)[O-] 2271076404 MVCCMQRNQVFWOL-UHFFFAOYSA-N 264.249 -0.266 5 10 CBBE CN=c1[nH]c(N[C@@]23CO[C@@H](C2)[C@@H](N)C3)ncc1[N+](=O)[O-] 2281272112 HCVLOPCVKITWOA-GEOGLEFRSA-N 280.288 -0.481 5 10 CBBE Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]1[C@@H](O)CO 2286212224 PGQKKHRPVOIFOS-MNOVXSKESA-N 281.268 -0.255 5 10 CBBE NNc1cc(CN2CC[C@H]2[C@H](O)CO)ccc1[N+](=O)[O-] 2286227373 OAWSLXZUAAXEFV-NWDGAFQWSA-N 282.300 -0.192 5 10 CBBE COCc1ncc([N+](=O)[O-])c(NC2(C(=O)O)COC2)n1 2286636365 MTWGRPWFZSEAAD-UHFFFAOYSA-N 284.228 -0.203 5 10 CBBE Cc1cc([N+](=O)[O-])cnc1N1C[C@H](O)[C@@H](O)[C@H](CO)C1 2289495232 RLEUHFXAVVOCTF-LSJOCFKGSA-N 283.284 -0.551 5 10 CBBE C[N+](C)(C)C[C@@H](CC(=O)O)OC(=O)C=CC(=O)O 2295007694 QMRSJQVUNCCUCI-MRVPVSSYSA-O 260.266 -0.280 5 10 CBBE N[C@@H]1C[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C[C@H]1O 2295651044 CKHRDTMXOFGEKM-JVUFJMBOSA-N 280.284 -0.182 5 10 CBBE O=C(O)[C@@]1(n2cc([N+](=O)[O-])cn2)CCN[C@@H]2C[C@@H]21 2309975285 GZNXZKVTMSJSJG-QXFUBDJGSA-N 252.230 -0.047 5 10 CBBE COC[C@H](CC(=O)O)N=c1nc([N+](=O)[O-])n(C)[nH]1 2321742170 WQGLMEWFTWCDDW-YFKPBYRVSA-N 259.222 -0.953 5 10 CBBE Cn1nc(N2C[C@H]3C(C(=O)O)[C@@H]3C2)nc1[N+](=O)[O-] 2321763052 HIHKRFMVNZXWIU-RFZPGFLSSA-N 253.218 -0.510 5 10 CBBE Cn1[nH]c(=NCCO[C@@H]2CCCNC2)nc1[N+](=O)[O-] 2345019932 XVWSKFYOZFYXOL-MRVPVSSYSA-N 270.293 -0.674 5 10 CBBE Nc1ccnc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)c1[N+](=O)[O-] 2357585449 MIRDJCIGPNBOGG-JGWOGQQGSA-N 280.284 -0.108 5 10 CBBE O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H](O)CN1 40676265 SEJDAUWGLFXQHQ-RYUDHWBXSA-N 279.296 -0.024 5 10 CBBE O=[N+]([O-])c1ccc(O[C@H]2OC[C@@H](O)[C@H](O)[C@@H]2O)cc1 44963994 MLJYKRYCCUGBBV-VPOLOUISSA-N 271.225 -0.587 5 10 CBBE CCOC(=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 45701632 KUGGALFJFGZVFH-SNVBAGLBSA-N 286.288 -0.305 5 10 CBBE CNC(=O)[C@@H](C)NC(=O)c1cc(NN)c(F)cc1[N+](=O)[O-] 51119916 DVYFJBWXYZYDMK-RXMQYKEDSA-N 299.262 -0.116 5 10 CBBE CN(C)C(=O)[C@@H]1CNCCN1c1ncccc1[N+](=O)[O-] 89088113 IBDJBNHLVMIEME-JTQLQIEISA-N 279.300 -0.144 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1CCNC[C@H]1C(N)=O 91554663 FPQYKQALRPSHOT-QMMMGPOBSA-N 282.304 -0.617 5 10 CBBE CNC(=O)[C@@H]1CNCCN1c1cc(C)c([N+](=O)[O-])cn1 92027809 WICIKWSEGKCCSZ-JTQLQIEISA-N 279.300 -0.178 5 10 CBBE CNC(=O)[C@@H](C)Nc1ncnc(OC)c1[N+](=O)[O-] 94739206 MAIKHZXAHZMYAL-RXMQYKEDSA-N 255.234 -0.060 5 10 CBBE O=c1c2cc([N+](=O)[O-])ccc2ncn1C[C@H](O)CO 105992628 NSNYBLZCCSAHNU-QMMMGPOBSA-N 265.225 -0.342 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CCCOC2)c1 109546710 LQGWBGJYDBSGSU-GXSJLCMTSA-N 270.289 -0.079 5 10 CBBE NNc1c(C(=O)N[C@@H]2CCC(=O)NC2)cccc1[N+](=O)[O-] 161564848 KASDDIOTSVGAAF-SSDOTTSWSA-N 293.283 -0.111 5 10 CBBE C[C@H]1CO[C@@H](CO)CN1c1nn(C)cc1[N+](=O)[O-] 231672948 GNYVKFKEXMPJTG-JGVFFNPUSA-N 256.262 -0.086 5 10 CBBE COC[C@H](O)CN(C)c1nc(NN)ncc1[N+](=O)[O-] 234710554 HMIKHEMVLMKXEE-ZCFIWIBFSA-N 272.265 -0.886 5 10 CBBE O=C(CN1C[C@H](O)[C@@H](O)C1)c1cc([N+](=O)[O-])c[nH]1 236582081 YNEAKZIOTYTABL-UWVGGRQHSA-N 255.230 -0.857 5 10 CBBE 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CCN=c1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@H](O)C2)[nH]1 2161357204 NRVULKOTAYUAEZ-IUCAKERBSA-N 282.300 -0.225 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NC2CC(N)(C(=O)O)C2)[nH]1 2174035158 LVGWUTZRQWBUQL-UHFFFAOYSA-N 281.272 -0.190 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2cncnc2)c1 2178834115 GSNAQCQRVUKLQV-NSHDSACASA-N 278.272 -0.268 5 10 CBBE O=C(O)c1cc(N2CCC2(CO)CO)ncc1[N+](=O)[O-] 2194395584 JFMDMLSKGBXWCA-UHFFFAOYSA-N 283.240 -0.379 5 10 CBBE CN(C)C[C@H]1COC[C@H]1Nc1ncnc(N)c1[N+](=O)[O-] 2206373889 GJTRRUNTKVELKL-JGVFFNPUSA-N 282.304 -0.045 5 10 CBBE CN(c1ncncc1[N+](=O)[O-])[C@@H]1COC[C@@H]1C(=O)O 2226982701 GWHBCOPGFNHPBP-POYBYMJQSA-N 268.229 -0.079 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1C[C@H]2CCO[C@@]2(CO)C1 2231364313 VJXIRLHNFZXKAV-LDYMZIIASA-N 268.273 -0.084 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1CCN[C@H](CCO)C1 2231870668 FFIFDPBYKJCYOK-SECBINFHSA-N 269.305 -0.028 5 10 CBBE C[C@H](CN=c1ccc(N)c([N+](=O)[O-])[nH]1)[C@@]1(O)CCNC1 2238420872 NVBLCFNEXMGUJP-PRHODGIISA-N 281.316 -0.234 5 10 CBBE CCc1nn(C)c(N2CC[C@@H]2[C@@H](O)CO)c1[N+](=O)[O-] 2270706562 UAMGTMIYRPEGRM-BDAKNGLRSA-N 270.289 -0.177 5 10 CBBE CCCc1ncc([N+](=O)[O-])c(=N[C@@H]2CNC[C@@H]2O)[nH]1 2271105995 UTNIZTCBPHCCTE-APPZFPTMSA-N 267.289 -0.496 5 10 CBBE CN=c1nc(N2CC(O)(CCO)C2)c([N+](=O)[O-])c(C)[nH]1 2286193751 UEVJNTLZPGUEPM-UHFFFAOYSA-N 283.288 -0.910 5 10 CBBE O=C(O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H]1[C@H](O)CO 2286207925 CNOPVPQKXBOSMS-RKDXNWHRSA-N 283.240 -0.380 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=NC[C@]2(O)CCCNC2)[nH]1 2286665288 BKSBJKFALFARQB-LBPRGKRZSA-N 281.316 -0.105 5 10 CBBE O=C(O)CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])cn1 2295650830 ANPGTRNQJTVGEU-UHFFFAOYSA-N 283.196 -0.399 5 10 CBBE CCNC(=O)[C@@H](C)N=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2295896778 WVYIYVVOUNUHNC-SSDOTTSWSA-N 278.272 -0.004 5 10 CBBE CN(C)C[C@H](CO)N=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2295918925 PZQPIUNCYLXDGB-MRVPVSSYSA-N 280.288 -0.606 5 10 CBBE Cn1nc(OCC2(N)CCOCC2)nc1[N+](=O)[O-] 2321740525 AYGHFQTUKAYPHB-UHFFFAOYSA-N 257.250 -0.390 5 10 CBBE Cn1nc(N=[S@@]2(=O)CC[C@@H](CN)C2)nc1[N+](=O)[O-] 2321756492 GEOUPUVYXRQXLA-AHGSNSTDSA-N 274.306 -0.199 5 10 CBBE O=[N+]([O-])c1cnc(N2CC[C@@H]3C[C@H]2[C@@H](O)[C@H]3O)nc1 2332592361 JNIFMSSXMOVJFQ-DOWZNPNQSA-N 266.257 -0.295 5 10 CBBE NCCNS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 20012522 DQVQLYCGILMLII-UHFFFAOYSA-N 263.250 -0.029 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnn[nH]1 51116273 FZVDHCDGYXMHFV-UHFFFAOYSA-N 278.232 -0.677 5 10 CBBE CC[C@H]1C(=O)NC(=O)CN1C(=O)c1ccc([N+](=O)[O-])n1C 97319619 YJVRMUHOFKWPBH-ZETCQYMHSA-N 294.267 -0.190 5 10 CBBE Cc1nn(C)c(N2CCN(C)C[C@@H]2CN)c1[N+](=O)[O-] 122824800 PIWGPEQLRGOTPJ-VIFPVBQESA-N 268.321 -0.284 5 10 CBBE CNc1ncnc(N2CCC[C@H]2C(N)=O)c1[N+](=O)[O-] 122894569 DOHZTQABFBMJBM-LURJTMIESA-N 266.261 -0.119 5 10 CBBE NCc1cn(CC(=O)Nc2ccc(O)cc2[N+](=O)[O-])nn1 167380526 JQWMETVQNPYQOD-UHFFFAOYSA-N 292.255 -0.011 5 10 CBBE NCCNS(=O)(=O)Nc1cccc([N+](=O)[O-])c1 213434098 ZAXLUSUIOWZOAG-UHFFFAOYSA-N 260.275 -0.200 5 10 CBBE O=C(O)c1cn(CCn2cc([N+](=O)[O-])cnc2=O)nn1 228594965 IFBSHPCANRFDTA-UHFFFAOYSA-N 280.200 -0.859 5 10 CBBE NNc1c(CN2CC(=O)NC(=O)C2)cccc1[N+](=O)[O-] 229834129 LYUALLNWCHAIOI-UHFFFAOYSA-N 279.256 -0.661 5 10 CBBE CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ncc1N 311417103 BKJYJPGEAQPRHD-RXMQYKEDSA-N 267.245 -0.564 5 10 CBBE NC(=O)c1ccc(Cn2nncc2CO)c([N+](=O)[O-])c1 313497378 KBYVHYIHRZAFQH-UHFFFAOYSA-N 277.240 -0.174 5 10 CBBE CCNc1ncnc(N[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 323396089 JPKOVDIUOVWJBZ-RQJHMYQMSA-N 269.261 -0.012 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]2OCCN[C@H]2C1 404069284 HFXMJNRFXQTZNK-IUCAKERBSA-N 267.289 -0.105 5 10 CBBE C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)N 568867245 PEFVXVZPBSYTPX-SFYZADRCSA-N 268.273 -0.392 5 10 CBBE Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])n2C)nn1 611946422 YARIBEQRRURMDE-UHFFFAOYSA-N 264.245 -0.008 5 10 CBBE CO[C@]1(C)C[C@@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 694354864 SUVFAKUGIKXMCD-GARJFASQSA-N 270.289 -0.081 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCC(CO)(CO)C2)n1 694698894 RJPSSLJQLFENQV-UHFFFAOYSA-N 256.262 -0.491 5 10 CBBE CCO[C@@H]1C[C@@H](N)[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 702057331 MXABMPILQFQGQB-FXPVBKGRSA-N 283.288 -0.588 5 10 CBBE O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCNC[C@H]1O 710439567 ANJHJEBSEKGTFD-NWDGAFQWSA-N 279.296 -0.024 5 10 CBBE CCn1ncc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 862386669 YKWYMMCZHPSDEP-UHFFFAOYSA-N 279.260 -0.281 5 10 CBBE O=C(NCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cccnc1 1292447331 QMMRERAKSGXLKC-NXEZZACHSA-N 278.268 -0.407 5 10 CBBE CN1CCOC[C@]1(CO)CNc1nn(C)cc1[N+](=O)[O-] 1458615783 OEXJQWZTALZXMZ-LLVKDONJSA-N 285.304 -0.567 5 10 CBBE O=C(NC/C=C/CNCc1cnsn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1497585139 SZFTXZIJACIIHY-UFLMBTITSA-N 297.340 -0.035 5 10 CBBE CNC(=O)Cn1cnc(NC(=O)CCC(C)(C)[N+](=O)[O-])n1 1531223025 VOVOTIWSWZHYCT-UHFFFAOYSA-N 298.303 -0.202 5 10 CBBE Cc1nn(C)c(N2CC3(CNC(=O)O3)C2)c1[N+](=O)[O-] 1612512815 BBUYRPPJZCPAQF-UHFFFAOYSA-N 267.245 -0.065 5 10 CBBE O=C(NCc1nnc2n1CCOC2)c1cc([N+](=O)[O-])c[nH]1 1626651022 KHDHMSJDHDWSSX-UHFFFAOYSA-N 292.255 -0.025 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](O)[C@@H](CO)C2)n1 1626670343 JHVJDSBGJASIDP-PSASIEDQSA-N 298.299 -0.374 5 10 CBBE CO[C@@H]1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1O 1641563562 HJIGQVUAVMVOOX-HTQZYQBOSA-N 284.272 -0.532 5 10 CBBE Cc1cc(N2CC3(C[C@@H](O)CNC3=O)C2)ncc1[N+](=O)[O-] 1652231151 FQRLNVVWOYSLIW-SECBINFHSA-N 292.295 -0.015 5 10 CBBE Cc1ncc(CNCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1731908655 OOOUHAVRPZLXKB-VXGBXAGGSA-N 293.327 -0.002 5 10 CBBE CN(C)C1(C(=O)NCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1742404264 QUTOMFNJSVTEHD-NXEZZACHSA-N 298.343 -0.632 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCOC[C@@H]2CO)[nH]1 1878770322 SLQFRPHYMKXLEW-NKWVEPMBSA-N 269.261 -0.971 5 10 CBBE CNC(=O)[C@@H](C)N(C)c1ncnc(NC)c1[N+](=O)[O-] 1916793231 SMKGXKDYRNGVBQ-ZCFIWIBFSA-N 268.277 -0.003 5 10 CBBE C[C@@H](N=c1ccc([N+](=O)[O-])c(N)[nH]1)C1(O)CCNCC1 1918787042 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Cn1ncnc1C1(O)CN(C(=O)CCC(C)(C)[N+](=O)[O-])C1 1153624854 CIZLIVYWDAPKLU-UHFFFAOYSA-N 297.315 -0.320 5 10 CBBE Cc1nnc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])o1 1291703211 KBRMDDJUSIMVJV-UHFFFAOYSA-N 252.190 -0.061 5 10 CBBE CNC(=O)[C@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1298839995 ZENLZBFCPPFJDU-ZETCQYMHSA-N 282.256 -0.993 5 10 CBBE Cc1nn(C)c(N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c1[N+](=O)[O-] 1307188833 QTVITIFRVLBABN-OCAPTIKFSA-N 293.283 -0.312 5 10 CBBE O=C1N[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CO1 1516729751 QZDGHZIMWZARRF-SSDOTTSWSA-N 269.217 -0.984 5 10 CBBE C[C@H](CS(C)(=O)=O)NC(=O)c1c([N+](=O)[O-])cnn1C 1629022468 NTJVOQNVJUZMQW-ZCFIWIBFSA-N 290.301 -0.509 5 10 CBBE Nc1ccn(C[C@H]2CNC(=O)O2)c(=O)c1[N+](=O)[O-] 1652952926 SSQJDPQDYCOAQL-RXMQYKEDSA-N 254.202 -0.553 5 10 CBBE O=C(NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1)c1cc[nH]n1 1747782875 GLORMUNNQPHJRI-VXNVDRBHSA-N 293.283 -0.547 5 10 CBBE Cn1cc(C(=O)N[C@H]2COC[C@H]2F)cc([N+](=O)[O-])c1=O 1889522301 RXLOSWJFJRRESM-SFYZADRCSA-N 285.231 -0.240 5 10 CBBE Cc1ccc(N2CC(O)(C(N)=O)C2)cc1[N+](=O)[O-] 1915216392 RFFLIKSUBIJXTE-UHFFFAOYSA-N 251.242 -0.060 5 10 CBBE C[C@H]1CO[C@@H](CO)CN1c1c([N+](=O)[O-])cnn1C 1916433166 ZCYTWTAUCUSIOU-JGVFFNPUSA-N 256.262 -0.086 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)NCC2OCCO2)c1 1990924304 CGZQMIFISLPDHY-UHFFFAOYSA-N 289.269 -0.359 5 10 CBBE CNCC[S@](C)(=O)=Nc1nc([N+](=O)[O-])nn1C 1998204832 ZMGLQODJANZIRZ-KRWDZBQOSA-N 262.295 -0.328 5 10 CBBE NC[C@@H](Oc1nc(Cl)ncc1[N+](=O)[O-])C(N)=O 2012642754 DJLCZFIAPMLAGV-SCSAIBSYSA-N 261.625 -0.770 5 10 CBBE O=C(O)[C@H](C1CC1)S(=O)(=O)N1CC([N+](=O)[O-])C1 2016896727 QNXNKJVZUQJOOK-ZETCQYMHSA-N 264.259 -0.860 5 10 CBBE Cc1nc([N+](=O)[O-])c(NCCC2(O)CNC2)n1C 2027288649 HOHDWCQMRFMEAD-UHFFFAOYSA-N 255.278 -0.227 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NCCO[C@H]1CC1(F)F 2041249415 QDFPUWZSULWGGT-YFKPBYRVSA-N 263.204 -0.019 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC[C@@H]1CO[C@@H](CN)C1 2041252002 BTVULBQSZCNNJX-NKWVEPMBSA-N 257.250 -0.534 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@]1(F)C[C@@H](CO)C1 2049505786 FRPKHZCXMUSJOZ-KZCWHLCOSA-N 259.241 -0.332 5 10 CBBE N=c1[nH]c(N2CC[C@@H]3C[C@]3(O)C2)ncc1[N+](=O)[O-] 2051360719 BIQLOKDNCLILTI-LDWIPMOCSA-N 251.246 -0.242 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NCC2=CCCOC2)[nH]1 2053455510 MNOUGXAVSHCSGI-UHFFFAOYSA-N 251.246 -0.022 5 10 CBBE CN=c1[nH]c(N2C[C@H]3C[C@H]2CN3)ncc1[N+](=O)[O-] 2053523883 UFFWLOUSBOUSLW-RQJHMYQMSA-N 250.262 -0.601 5 10 CBBE Nc1ccc(=N[C@H]2COCC[C@@H]2N)[nH]c1[N+](=O)[O-] 2053547063 ROXINXNCWAGMCC-XPUUQOCRSA-N 253.262 -0.478 5 10 CBBE CN=c1[nH]c(=NC[C@H]2C[C@H](N)C2)[nH]cc1[N+](=O)[O-] 2053555525 PAVAEHDQVDYBJM-LJGSYFOKSA-N 252.278 -0.581 5 10 CBBE C[C@H]1C[C@@H](N=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])CCN1 2053690170 SMMXDUNASQLVNL-BQBZGAKWSA-N 252.278 -0.228 5 10 CBBE COC[C@@H](N)COc1ncc([N+](=O)[O-])c(OC)n1 2056216266 LXSPVOMXTFHUSS-ZCFIWIBFSA-N 258.234 -0.254 5 10 CBBE Cn1nc([N+](=O)[O-])nc1NC(C)(C)[C@@H](O)C(=O)O 2056743326 QHNPOFRDSMIFLT-BYPYZUCNSA-N 259.222 -0.641 5 10 CBBE O=C(NOC1CNC1)c1ccc([N+](=O)[O-])c(O)c1 2058952005 CWUUNAGWJXOZTC-UHFFFAOYSA-N 253.214 -0.066 5 10 CBBE NC(=O)C1(Oc2ncnc(Cl)c2[N+](=O)[O-])CNC1 2064973801 NOAVRPGRAHWQQW-UHFFFAOYSA-N 273.636 -0.756 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](CN)C2)n1 2066471329 FIBZAWHGQJYFTN-KNVOCYPGSA-N 253.262 -0.205 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1COC(C)(C)[C@H]1O 2078719360 BOHCMIAWHDFRNS-WDSKDSINSA-N 257.250 -0.905 5 10 CBBE O=[N+]([O-])c1ccccc1[S@](=O)C[C@]1(O)CNC[C@@H]1O 2100932468 SERQEFFNWGHAPT-ZDCWMAILSA-N 286.309 -0.602 5 10 CBBE O=Cc1cc(N[C@@H]2C[C@H](O)[C@H](O)[C@@H]2O)c([N+](=O)[O-])s1 2108828255 ALCSAUPZAHXVPH-JYFAAPFMSA-N 288.281 -0.264 5 10 CBBE NC(=O)C[C@@H](N)C(=O)Nc1cc(Cl)ncc1[N+](=O)[O-] 2109588174 AHEHMZQXDROWSH-SCSAIBSYSA-N 287.663 -0.216 5 10 CBBE C[C@@H]1C[S@](=O)CCN1c1ncnc(NN)c1[N+](=O)[O-] 2115333394 HCBGGWPUZOBMNM-ZLWQNGGKSA-N 286.317 -0.372 5 10 CBBE CNc1ncnc(N2C[C@@H](O)C[C@@H](N)C2)c1[N+](=O)[O-] 2117106762 NQQMPZLZAOLAKC-RQJHMYQMSA-N 268.277 -0.675 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2[C@@H]3C[C@@H]2CN3)[nH]1 2117250935 RLJFUECCGYMKEI-GJMOJQLCSA-N 264.289 -0.649 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@H]2CCO[C@@]2(CN)C1 2118556464 OOYMTARECGFIOU-KCJUWKMLSA-N 267.289 -0.118 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2[C@H]3CCO[C@@H]23)[nH]1 2119901864 HQVUFPGUKJTJKE-ZXFLCMHBSA-N 265.273 -0.283 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@@]2(C)CCNC2=O)[nH]n1C 2142496695 LWYKYUNBHARJDP-LLVKDONJSA-N 267.289 -0.003 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N2C[C@@H](O)[C@@H](C3CC3)C2)n1 2146890448 JAPQCOVAIQTHKW-VXNVDRBHSA-N 280.288 -0.123 5 10 CBBE COc1c(C(=O)N(CCN)CCN)cccc1[N+](=O)[O-] 2152184997 RIQSRNZFLLTKJD-UHFFFAOYSA-N 282.300 -0.037 5 10 CBBE NC(=O)C1(N)CN(C(=O)c2c(F)cccc2[N+](=O)[O-])C1 2165756191 LWWIKJCALXPQLG-UHFFFAOYSA-N 282.231 -0.628 5 10 CBBE N=c1[nH]c(N2CCC[C@@H](NCCO)C2)ncc1[N+](=O)[O-] 2173816908 SCHFAYNCHSLVOW-MRVPVSSYSA-N 282.304 -0.652 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NCCNC[C@@H](C)O)[nH]1 2174025710 HUYLNOLXGPYNNM-MRVPVSSYSA-N 284.320 -0.957 5 10 CBBE O=C(O)c1cc([N+](=O)[O-])cnc1OC1(C(=O)O)CNC1 2184559691 RAQQNDOOPRRHBX-UHFFFAOYSA-N 283.196 -0.507 5 10 CBBE CN1CC[C@H](N(C)c2nc(=N)[nH]cc2[N+](=O)[O-])CC1=O 2188466062 HNUPCWULMIBUOC-ZETCQYMHSA-N 280.288 -0.146 5 10 CBBE O=C(O)c1cc([N+](=O)[O-])cnc1N[C@]1(CO)CCNC1 2190122884 YRLYYBZTVNDGSE-LLVKDONJSA-N 282.256 -0.176 5 10 CBBE CN=c1nc(N2CC[C@@](C)(O)[C@@H](O)C2)c([N+](=O)[O-])c[nH]1 2197954891 GWLDULTZNUPOSP-GZMMTYOYSA-N 283.288 -0.830 5 10 CBBE COC[C@H](NCc1nn(C)cc1[N+](=O)[O-])C(=O)O 2223842259 XQKIAXNIDQZOPC-ZETCQYMHSA-N 258.234 -0.483 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@H]2COC[C@]2(CO)C1 2226174729 KURXSFICICVNTH-GZMMTYOYSA-N 268.273 -0.227 5 10 CBBE C[C@H](O)CN1CCN(c2ncncc2[N+](=O)[O-])CC1 2226983247 NNXZJGHGSHVXCX-VIFPVBQESA-N 267.289 -0.112 5 10 CBBE CNS(=O)(=O)CCN=c1[nH]n(C(C)C)cc1[N+](=O)[O-] 2230777448 AMFDMWRULHELHF-UHFFFAOYSA-N 291.333 -0.245 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@H](C(=O)O)C(C)(C)O)[nH]1 2230796549 JUBRCQBEQZHRHP-SSDOTTSWSA-N 272.261 -0.131 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1C[C@@H](O)C[C@@H]1C(=O)O 2231841188 GXSNFXGPBSICBU-NKWVEPMBSA-N 270.245 -0.165 5 10 CBBE CN=c1cc(C(=O)N=c2nc[nH]s2)c([N+](=O)[O-])c[nH]1 2232168227 UMZIWADETXRIDA-UHFFFAOYSA-N 280.269 -0.021 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1ON1C[C@@H](N)CC1=O 2232247569 CYNNATQUXTULBN-ZETCQYMHSA-N 269.261 -0.027 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C[C@H]3CCO[C@@]3(CO)C2)n1 2239794971 GXGWFLDPQQOWPU-BXKDBHETSA-N 282.300 -0.089 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN[C@H]2C[C@@H]3OCCN[C@@H]3C2)n1 2240634980 YMOUBRUCAOJJGC-LNLATYFQSA-N 281.316 -0.063 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N[C@]2(CO)C[C@H](O)C2)n1 2286724948 UXHRQQJPWKZOLM-DGFRNANFSA-N 284.272 -0.171 5 10 CBBE O=[N+]([O-])c1ccnc(N[C@H]2C[C@@H](O)[C@H](O)[C@@H]2O)c1 2309041075 BOVBVHCZEROABY-WDQPUEAGSA-N 255.230 -0.743 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2[C@H]3CN[C@@H]2C3)c1[N+](=O)[O-] 2311872434 ZYYXRYBQKSZRGJ-FSDSQADBSA-N 250.262 -0.591 5 10 CBBE Cn1cc([N+](=O)[O-])c(CS(=O)(=O)[C@H]2CC[C@@H]2N)n1 2315646385 ZOEZUJHKDVHBJT-RCOVLWMOSA-N 274.302 -0.267 5 10 CBBE C[C@]12CCO[C@H]1[C@@](C(=O)O)(N1CC([N+](=O)[O-])C1)C2 2326356058 XQEMPVRVISDKSG-IEBDPFPHSA-N 256.258 -0.030 5 10 CBBE O=C(NCC[C@@H](O)CCO)c1ccc([N+](=O)[O-])[nH]1 2326772822 NDELRPCHRWSTCE-SSDOTTSWSA-N 257.246 -0.214 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC[C@H]1CO[C@@H]2CNC[C@@H]21 2330881676 DVCZDHXQGRICDH-BWZBUEFSSA-N 269.261 -0.664 5 10 CBBE CN=c1cc(C(=O)N[C@H]2[C@@H]3CCO[C@@H]32)c([N+](=O)[O-])c[nH]1 2355547627 QMRSRFLDLDWOAV-CYUDJLOBSA-N 278.268 -0.030 5 10 CBBE COc1ccc(S(=O)(=O)N[C@H]2C[C@H]2N)cc1[N+](=O)[O-] 36263915 JCXCYLRMYJSOPW-SFYZADRCSA-N 287.297 -0.019 5 10 CBBE Cc1nn(C[C@@H](O)CN[C@@H](C)C(N)=O)c(C)c1[N+](=O)[O-] 69369530 NXHXLZRYFFFSFD-CBAPKCEASA-N 285.304 -0.768 5 10 CBBE NNc1ncnc(NC[C@H](O)C2CC2)c1[N+](=O)[O-] 87876709 SNQMQDDMWGTUKM-LURJTMIESA-N 254.250 -0.147 5 10 CBBE CN(C)C(=O)[C@H]1CNCCN1c1ccncc1[N+](=O)[O-] 89088388 LNRCHKXAISMMFJ-LLVKDONJSA-N 279.300 -0.144 5 10 CBBE C/C(=C\C(=O)O)Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O 111543928 DBCSXZGCTBVMHT-GORDUTHDSA-N 255.186 -0.524 5 10 CBBE NNc1ccc(CN2CCOC[C@H]2C(N)=O)cc1[N+](=O)[O-] 159123146 QFNYCXAFDHHSBV-NSHDSACASA-N 295.299 -0.434 5 10 CBBE COC(=O)c1ncn(-c2ncnc(N)c2[N+](=O)[O-])n1 167677964 VAOLHDJBWOYAJB-UHFFFAOYSA-N 265.189 -0.666 5 10 CBBE Nc1c([N+](=O)[O-])ccc(F)c1C(=O)N1C[C@@H](O)[C@H](O)C1 222970565 OKUNWPPQAFULIR-HTQZYQBOSA-N 285.231 -0.506 5 10 CBBE Cc1nn(C(C)C)c(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 228597019 BNKYWBSIGDLXQJ-SSDOTTSWSA-N 271.277 -0.061 5 10 CBBE CC(C)N(CC(N)=O)c1nc(N)ncc1[N+](=O)[O-] 232650029 DHRTUHSNUVOKHR-UHFFFAOYSA-N 254.250 -0.333 5 10 CBBE CN(C[C@@H](O)CN)S(=O)(=O)c1cccc([N+](=O)[O-])c1 311716251 OQWZTMQGWSRMIC-VIFPVBQESA-N 289.313 -0.465 5 10 CBBE Nc1cccc(C(=O)N2C[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 316536241 GZCRJJNUHWFQBN-XVKPBYJWSA-N 281.268 -0.398 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccnc2ccnn12 342680472 JYVRBVOTEJQJNQ-UHFFFAOYSA-N 288.227 -0.132 5 10 CBBE COc1cc(C(=O)N2CC(O)(CO)C2)ccc1[N+](=O)[O-] 597704857 GYAHKBIRRWAUDT-UHFFFAOYSA-N 282.252 -0.217 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@]23COC[C@H]2C3)c1 689213765 MVMBBSRNVAXKJS-YUSALJHKSA-N 282.300 -0.222 5 10 CBBE CNC[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 702056485 DTUOBFNPIBWKFL-SNVBAGLBSA-N 283.288 -0.762 5 10 CBBE CN(c1cc(C(N)=O)ccc1[N+](=O)[O-])[C@H]1COC[C@H]1O 709643409 OECGMGPAPWOMMP-WDEREUQCSA-N 281.268 -0.110 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)N[C@@H]1COCC[C@H]1O 710864017 BBKVGGZRIKRWOW-RKDXNWHRSA-N 284.272 -0.553 5 10 CBBE NNc1ncc([N+](=O)[O-])c(N[C@]23COC[C@@H]2C3)n1 718041279 QVUYAUCOTIBWKH-SSDLBLMSSA-N 252.234 -0.129 5 10 CBBE CN1CCN(c2c([N+](=O)[O-])cnn2C)C[C@H]1CO 894880493 CQNCOLMIDFVGFG-QMMMGPOBSA-N 255.278 -0.559 5 10 CBBE C=CC(=O)NCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1136636871 QKAWTLKOCWJQMS-UHFFFAOYSA-N 253.218 -0.650 5 10 CBBE CONC(=O)CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N 1179623805 UKHIOHXNVCZBGW-UHFFFAOYSA-N 286.219 -0.277 5 10 CBBE Cc1ccnc(N2CCN(CC(N)=O)C(=O)C2)c1[N+](=O)[O-] 1307140468 SFARXHOIEVIVRK-UHFFFAOYSA-N 293.283 -0.568 5 10 CBBE CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1nccn1C 1317448412 SXNAUERCNFVVAY-NXEZZACHSA-N 281.316 -0.367 5 10 CBBE CN1C[C@@H](COC(=O)Cn2cnc([N+](=O)[O-])n2)CC1=O 1342575919 RPVJMSCERXHDFQ-ZETCQYMHSA-N 283.244 -0.792 5 10 CBBE Cc1nn(C)c(C(=O)N2C[C@@H](CO)[C@@H](CO)C2)c1[N+](=O)[O-] 1457976897 ALCZPHDYXYIJJW-DTORHVGOSA-N 298.299 -0.690 5 10 CBBE O=C1NC(=O)C2(CN(c3ncccc3[N+](=O)[O-])C2)N1 1458716767 RDQKHNIXXBVJGI-UHFFFAOYSA-N 263.213 -0.612 5 10 CBBE Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)[C@@H](CO)C1 1468867247 KIXODSLSMCWACS-KSBSHMNSSA-N 299.258 -0.259 5 10 CBBE COCCC(=O)N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1578433870 VMZKUXQRJAVCRA-ZYUZMQFOSA-N 285.300 -0.549 5 10 CBBE Cn1cnc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c1 1586276944 YBKVZUZPMQCJAM-UHFFFAOYSA-N 264.245 -0.159 5 10 CBBE Cc1[nH]nc(C(=O)N2CC(=O)N[C@H](C)C2)c1[N+](=O)[O-] 1641000170 KSUCELVMOZTCGO-RXMQYKEDSA-N 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MHRGJFPCEGEPRU-YUMQZZPRSA-N 283.288 -0.492 5 10 CBBE O=C(O)c1cnc(NC2([C@@H](O)CO)CC2)c([N+](=O)[O-])c1 2190119424 LZAWJHHLTOBRDO-QMMMGPOBSA-N 283.240 -0.014 5 10 CBBE COc1nc(NC2(CO)CCNCC2)ncc1[N+](=O)[O-] 2190269117 MDQUWLKOTNHEDW-UHFFFAOYSA-N 283.288 -0.080 5 10 CBBE Cc1ccc(N2C[C@H](O)[C@@H](O)[C@@H]2C(=O)O)c([N+](=O)[O-])c1 2200869204 ZHWWURGQLUSWDZ-HBNTYKKESA-N 282.252 -0.102 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(NC[C@@]2(O)CCCNC2)[nH]1 2201299243 PHFWTLYHAQUTIA-GFCCVEGCSA-N 281.316 -0.020 5 10 CBBE O=C(O)[C@@H]1CNCCN1c1ccc([N+](=O)[O-])cc1CO 2205282135 CILDIUNYCDUWGF-NSHDSACASA-N 281.268 -0.050 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1C[C@H]2NCC[C@@H]12 2205643438 FLKVZABKQIIKQI-INTQDDNPSA-N 279.300 -0.095 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@]2(CO)C[C@H](O)C2(C)C)[nH]n1C 2207476384 PGVSBRPPTPDCEY-UFBFGSQYSA-N 284.316 -0.008 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC[C@@]2(O)CCOC2)[nH]1 2223033446 UCJJGYDUBNISLS-JTQLQIEISA-N 256.262 -0.204 5 10 CBBE Cc1nc(=NCc2nn(C)cc2[N+](=O)[O-])n(C)[nH]1 2223854969 VRWYCIJRQBZRBH-UHFFFAOYSA-N 251.250 -0.201 5 10 CBBE O=[N+]([O-])c1ncccc1N1CC[C@](O)(CO)[C@H](O)C1 2225728691 UAEVUECYHNUFEI-KOLCDFICSA-N 269.257 -0.716 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CC(CO)(C(=O)O)C2)n1 2230797282 OHRUHDNUJOAVER-UHFFFAOYSA-N 270.245 -0.306 5 10 CBBE C[C@H]1CNC[C@H]1C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2231917995 NTYNJNFIHDTFKR-JGVFFNPUSA-N 267.289 -0.200 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2CCCNC2)n1 2231918600 SXYUDJTWPLIKFX-MRVPVSSYSA-N 267.289 -0.056 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@H]1CN2CCCN1CC2 2235295141 WSXIUDPCLSLHFD-JTQLQIEISA-N 278.316 -0.392 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](O)[C@H](O)CC1 2284579035 RZBWHQSJRTYSON-GHMZBOCLSA-N 283.284 -0.109 5 10 CBBE CN[C@@H]1CCN(C(=O)NCc2nn(C)cc2[N+](=O)[O-])C1 2285529216 KXGRQQMKZOXNGD-MRVPVSSYSA-N 282.304 -0.168 5 10 CBBE Cn1[nH]c(=N[C@H](CCO)C(F)F)nc1[N+](=O)[O-] 2304476248 SUIKTPBBNZZHSS-SCSAIBSYSA-N 251.193 -0.427 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@H](CN)C2(C)C)nc1[N+](=O)[O-] 2321761657 VFCXDJREGGTAPA-RNFRBKRXSA-N 254.294 -0.070 5 10 CBBE COC[C@](CCCN)(C(=O)O)N1CC([N+](=O)[O-])C1 2326352070 GJPDMITXJMKIIE-SNVBAGLBSA-N 261.278 -0.844 5 10 CBBE Cc1cc(=NCCS(=O)(=O)CCO)[nH]cc1[N+](=O)[O-] 2335855070 RSESUMPJRINLGU-UHFFFAOYSA-N 289.313 -0.461 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCO[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 2345025098 SHQLKGYCJKKZBB-PHDIDXHHSA-N 271.233 -0.811 5 10 CBBE O=C1NC2(CO1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2 2351874003 FLMQXNDCXIBHNK-UHFFFAOYSA-N 266.213 -0.143 5 10 CBBE COc1ncnc(N[C@@H]2COC[C@@H]2C(=O)O)c1[N+](=O)[O-] 94738502 JLYQQAPVLZVUCD-NTSWFWBYSA-N 284.228 -0.095 5 10 CBBE CNc1cc(Cn2c(=O)c([N+](=O)[O-])cn(C)c2=O)ccn1 111545464 ADQHZVRMQSHWSX-UHFFFAOYSA-N 291.267 -0.060 5 10 CBBE COCCCNCCn1cc([N+](=O)[O-])cnc1=O 128715514 MMGJHFWORGMLGL-UHFFFAOYSA-N 256.262 -0.222 5 10 CBBE N[C@]1(C(=O)O)CCN(c2ccc([N+](=O)[O-])nc2)C1 229303370 SBDMPFRKIVEKAY-SNVBAGLBSA-N 252.230 -0.018 5 10 CBBE CCn1cnnc1CNc1ncnc(NN)c1[N+](=O)[O-] 230762480 IDHULGBMISJDBH-UHFFFAOYSA-N 279.264 -0.106 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1NCC1(O)CNC1 311492925 NYQDNAXKGQWVJV-UHFFFAOYSA-N 266.257 -0.560 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@](O)(CO)C2)c1 313665683 HRJCSDLKLHGCPE-GFCCVEGCSA-N 281.268 -0.373 5 10 CBBE Nc1cc([N+](=O)[O-])ccc1N1C[C@@H](O)[C@@H](CO)C1 316322103 CBIOYLFIQBMHOZ-RDDDGLTNSA-N 253.258 -0.034 5 10 CBBE Nc1ccc(CN2C[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] 316406089 MLINFYXHBIYZIS-BXKDBHETSA-N 267.285 -0.038 5 10 CBBE NNc1cccc(N2C[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 316759270 NSRMBXSTLQXWTB-XCBNKYQSSA-N 268.273 -0.330 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)N[C@@H]2COC[C@H]2O)c1 323069578 OZUIPOPQMBXBRK-RKDXNWHRSA-N 289.269 -0.972 5 10 CBBE N[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)C(=O)O 323554153 HBJHLDGCYIQLRC-SECBINFHSA-N 267.241 -0.335 5 10 CBBE COCC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCC1 347599373 KWUNRYBZLGKFKK-UHFFFAOYSA-N 269.261 -0.128 5 10 CBBE C[C@@](O)(CO)CNC(=O)CNc1ccccc1[N+](=O)[O-] 348351779 QULWDIRROQPJTI-LBPRGKRZSA-N 283.284 -0.134 5 10 CBBE C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCS1(=O)=O 353256597 GMMXLDWREZPRTO-LURJTMIESA-N 288.285 -0.423 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN2CCCC[C@@H]2C1 408024335 ZNJUEUZCCFNAQT-SNVBAGLBSA-N 294.315 -0.117 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)NC2CN(C(=O)OC)C2)n1 496344161 PMNJZIDATUIUAT-UHFFFAOYSA-N 297.271 -0.008 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N2CC(=O)N(C)C(=O)C2)n1 565315282 SXGPOJUJPFZYLH-UHFFFAOYSA-N 295.255 -0.748 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1O[C@H](CN)C(=O)OC 715386572 PWEOJIJJBZNVQX-SSDOTTSWSA-N 272.261 -0.001 5 10 CBBE CS(=O)(=O)C1CC(Nc2nc(N)ncc2[N+](=O)[O-])C1 716149577 WKVCZKSUTBIUCO-UHFFFAOYSA-N 287.301 -0.046 5 10 CBBE O=C(CC1OCCCO1)OCCn1cnc([N+](=O)[O-])n1 793157386 FLVLANBBVXYDDT-UHFFFAOYSA-N 286.244 -0.117 5 10 CBBE CO[C@H](C)CS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842350755 XBXNSIRKCDRJSH-FSDSQADBSA-N 266.275 -0.868 5 10 CBBE Cn1cc(CCCNC(=O)Cn2cnc([N+](=O)[O-])n2)cn1 1115959288 PMEUYWXQHIKJNN-UHFFFAOYSA-N 293.287 -0.331 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](O)[C@@H]2CCCO2)n1 1118946774 KHOSPKDKURHFHX-BDAKNGLRSA-N 284.272 -0.402 5 10 CBBE O=C(NCCNc1ccccc1[N+](=O)[O-])C1(O)COC1 1135673069 VEBJZHDJMZCJTI-UHFFFAOYSA-N 281.268 -0.116 5 10 CBBE O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC(CO)C1 1255125324 XIHJUCQXMCGVAM-UHFFFAOYSA-N 273.270 -0.397 5 10 CBBE O=[N+]([O-])CCN1CCO[C@]2(CCS(=O)(=O)C2)C1 1341577782 GSGGKXLAGLMEAN-SECBINFHSA-N 264.303 -0.847 5 10 CBBE O=C(NC[C@H]1CCCCS1(=O)=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1536637976 UQLSHOBDTYWDNH-IWSPIJDZSA-N 276.314 -0.265 5 10 CBBE C[C@@H](O)[C@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1566796380 PEVBDSSQCBJSCH-ZJUUUORDSA-N 295.295 -0.014 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CCO[C@@H](CC(N)=O)C1 1620471753 YMAZQQRQAFPGGZ-JTQLQIEISA-N 297.315 -0.324 5 10 CBBE O=[N+]([O-])c1ccn(CCN2CC[C@H](O)[C@@H](CO)C2)n1 1659030070 RGQWZFZBYXPRHU-ZJUUUORDSA-N 270.289 -0.534 5 10 CBBE O=C(O)[C@@H]1COCC[C@@H]1NC(=O)N1CC([N+](=O)[O-])C1 1876148702 HZWJLXZWJVXYRS-SFYZADRCSA-N 273.245 -0.853 5 10 CBBE CC1(C)OC[C@@H](N=c2ccc([N+](=O)[O-])c(N)[nH]2)[C@@H]1O 1910905461 LMRRGYZKHSRKLB-MUWHJKNJSA-N 268.273 -0.056 5 10 CBBE O=[N+]([O-])c1nn(C[C@]2(O)CNC[C@H]2O)cc1Cl 1950983156 KTUZLPWTDJSEEK-HTRCEHHLSA-N 262.653 -0.860 5 10 CBBE O=[N+]([O-])c1c(N2C[C@]3(CO)C[C@]3(CO)C2)ccnc1O 1965655407 GVVJEJYJGMJDQT-TXEJJXNPSA-N 281.268 -0.124 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCOC[C@]2(C)CO)n1 1970188138 DHGQSMGGGSSKQI-NSHDSACASA-N 270.289 -0.089 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CNCC2COC2)c1 2036599981 RICDJSUXIDMVQX-JTQLQIEISA-N 256.262 -0.612 5 10 CBBE Nc1cc(N[C@H]2COC[C@H]2CO)ncc1[N+](=O)[O-] 2047196127 BEXUBFBFIUXNSR-SVRRBLITSA-N 254.246 -0.009 5 10 CBBE CNc1ncnc(N[C@H](CO)[C@@H](C)O)c1[N+](=O)[O-] 2053796455 WUZNCFATEAMVDK-PHDIDXHHSA-N 257.250 -0.420 5 10 CBBE Cc1cc(=N[C@@H](C(=O)O)[C@@H](C)O)c([N+](=O)[O-])c[nH]1 2054835818 SFTAOOGQWUWDJX-HZGVNTEJSA-N 255.230 -0.034 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCN[C@H]3C[C@H]32)[nH]1 2057536990 NPOZNKXNJPMSEA-XVMARJQXSA-N 250.262 -0.618 5 10 CBBE N[C@@H]1COC[C@H]1COc1ncnc(F)c1[N+](=O)[O-] 2064911183 TZWIDHPIEXTLHJ-NTSWFWBYSA-N 258.209 -0.124 5 10 CBBE Nc1ncnc(N2CC[C@H]3CNC[C@@H]32)c1[N+](=O)[O-] 2068561879 JWMZKJGJNAYDNE-BQBZGAKWSA-N 250.262 -0.235 5 10 CBBE COCC1(Nc2ccc([N+](=O)[O-])c(N)n2)CNC1 2070554359 KAPBDXPZHFQRLR-UHFFFAOYSA-N 253.262 -0.028 5 10 CBBE O=[N+]([O-])c1c[nH]ccc1=NS(=O)(=O)CCCCO 2082420694 RIGIFSUDQPPEOF-UHFFFAOYSA-N 275.286 -0.074 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@H]2CCC(=O)NC2)[nH]n1C 2086308045 PZSUFISNFSGAGF-ZETCQYMHSA-N 253.262 -0.251 5 10 CBBE Cc1c([N+](=O)[O-])c(N2C[C@@H](O)C[C@H](O)C2)nn1C 2086314936 NANAOSIFWFSXDQ-YUMQZZPRSA-N 256.262 -0.431 5 10 CBBE C[C@@H]1CCN(c2ncnc(N)c2[N+](=O)[O-])[C@H]1C(N)=O 2090258168 GFBRZPGYCLSXAR-PHDIDXHHSA-N 266.261 -0.333 5 10 CBBE N[C@]1(C(=O)O)C[C@@H](Nc2ncnc(F)c2[N+](=O)[O-])C1 2106072759 HIGLHYIJCDSAKE-CFRJAMMZSA-N 271.208 -0.120 5 10 CBBE Nc1nc[nH]c(=NCc2nccc(O)n2)c1[N+](=O)[O-] 2107039451 INMHQNSRXBZRRL-UHFFFAOYSA-N 263.217 -0.503 5 10 CBBE CON(c1ncnc(NN)c1[N+](=O)[O-])[C@@H]1CCOC1 2108482690 KFBZMVZCDCXKMF-ZCFIWIBFSA-N 270.249 -0.173 5 10 CBBE Nc1cnc([N+](=O)[O-])cc1C(=O)N1CC=C[C@@H](O)C1 2108852133 WWJLORMLIMVMFR-SSDOTTSWSA-N 264.241 -0.055 5 10 CBBE COCC1(C(=O)O)CN(c2ncc([N+](=O)[O-])cn2)C1 2112829895 FJLJBIJPXFPWFV-UHFFFAOYSA-N 268.229 -0.078 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCc2cc(C)[nH]n2)[nH]1 2117105041 LEFHQTAGSIFTSM-UHFFFAOYSA-N 263.261 -0.086 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2C[C@@H]2CO)[nH]1 2117659346 ZMAWUDWCOWVRJN-JGVFFNPUSA-N 267.289 -0.299 5 10 CBBE O=C(NCC(CO)CO)c1cc([N+](=O)[O-])cnc1Cl 2123160414 KFCMVFITIZRUQT-UHFFFAOYSA-N 289.675 -0.026 5 10 CBBE N=c1[nH]c(=NCC[C@@H]2CNCCO2)[nH]cc1[N+](=O)[O-] 2124746808 FOVNOKNKIKBKRU-SSDOTTSWSA-N 268.277 -0.990 5 10 CBBE Cc1c([N+](=O)[O-])c(N2CCN(C)[C@@H](CO)C2)nn1C 2142480777 BQWCXALWEFRQAU-SECBINFHSA-N 269.305 -0.251 5 10 CBBE CN(C)[C@H]1CN(c2cc([N+](=O)[O-])cc(NN)n2)C[C@H]1O 2146152005 JCUYAXNKZSSSMG-DTWKUNHWSA-N 282.304 -0.614 5 10 CBBE CCN=c1ccc([N+](=O)[O-])c(N[C@@H](COC)C(N)=O)[nH]1 2152366106 MZDQCERDQFVTBN-ZETCQYMHSA-N 283.288 -0.244 5 10 CBBE Nc1cnc([N+](=O)[O-])cc1C(=O)N=c1ccnc(O)[nH]1 2153815050 DSNLVRCMQAPCKB-UHFFFAOYSA-N 276.212 -0.258 5 10 CBBE CCn1ncnc1CNc1ncnc(NN)c1[N+](=O)[O-] 2168067186 IXCLBFPIFLKYJL-UHFFFAOYSA-N 279.264 -0.106 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@]1(O)CCCOC1 2168090772 YROOHVQIEMSSEY-NSHDSACASA-N 284.272 -0.551 5 10 CBBE COCCNC(=O)CCn1cc([N+](=O)[O-])c(C(=O)O)n1 2173499355 FZWMYUSKGNWSGZ-UHFFFAOYSA-N 286.244 -0.358 5 10 CBBE Cc1[nH]c(=N)nc(N(C)C[C@@H]2CNCCO2)c1[N+](=O)[O-] 2173857717 QJQQGWFPCAGDBA-QMMMGPOBSA-N 282.304 -0.470 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(NCC2(CCO)CNC2)[nH]1 2175827592 AXPHNUWJNUMGIQ-UHFFFAOYSA-N 281.316 -0.163 5 10 CBBE CNC[C@@H](CN(C)C)Oc1ncnc(OC)c1[N+](=O)[O-] 2176303732 FIICUIHPSIAQDB-QMMMGPOBSA-N 285.304 -0.078 5 10 CBBE 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CBBE O=C(COc1ccccc1[N+](=O)[O-])N1CC(CO)(CO)C1 1558288151 JJKWIOGKSOJUMC-UHFFFAOYSA-N 296.279 -0.213 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)[C@H]1CCOC1 1567035641 KEFUQDQHXAVSCC-UWVGGRQHSA-N 298.299 -0.387 5 10 CBBE COC(=O)[C@H](C)NC(=O)[C@H](C)N=c1cc[nH]cc1[N+](=O)[O-] 1612700701 OWFPKKYADHKGRH-YUMQZZPRSA-N 296.283 -0.110 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)Cc1nncn1C 1625627722 LPRGCADUQZBDDT-UHFFFAOYSA-N 293.287 -0.113 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)NCCC1(CO)CC1 1627654620 NHKCPXBPNGFBKQ-UHFFFAOYSA-N 269.261 -0.535 5 10 CBBE C[C@@]1(C2CCN(CC[N+](=O)[O-])CC2)NC(=O)NC1=O 1641967114 UCYOTKWZHGEEEE-NSHDSACASA-N 270.289 -0.427 5 10 CBBE O=[N+]([O-])c1ccccc1S(=O)(=O)[N@]1[C@H]2CNC[C@H]21 1887574033 HNDDWYBRVPDZMZ-GDGBQDQQSA-N 269.282 -0.061 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@@H]1COC[C@H]1C(=O)O 1916388891 KTGPMEDQYRTUGP-PHDIDXHHSA-N 256.218 -0.160 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NCC(=O)N1CCNCC1 1916431575 UHYSRUZHGYXKRY-UHFFFAOYSA-N 268.277 -0.828 5 10 CBBE Nc1ncnc(N2CC[C@@](F)(CO)C2)c1[N+](=O)[O-] 1917109409 MRGFARCASFATKZ-VIFPVBQESA-N 257.225 -0.122 5 10 CBBE NCCN1CCC(C(=O)O)(n2ccc([N+](=O)[O-])n2)CC1 1918391386 WZQDVNCQMHHKJA-UHFFFAOYSA-N 283.288 -0.374 5 10 CBBE C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C1(O)CNC1 1918702723 NWKBTLKBPFXBNG-ZCFIWIBFSA-N 254.246 -0.625 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCNC[C@H](O)C2)n1 1964534802 WLENBAGGXGZZRX-QMMMGPOBSA-N 255.278 -0.906 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)N2C[C@H]3[C@H](O)C[C@H]3C2)c1 1965792286 PVOVVRIIJVUFJZ-WHGOUJPWSA-N 299.308 -0.009 5 10 CBBE Nc1ccnc(N[C@H]2COC[C@@H]2CO)c1[N+](=O)[O-] 2029840425 HUCOBJQQLJFEFG-XPUUQOCRSA-N 254.246 -0.009 5 10 CBBE NC[C@H]1CCN1C(=O)c1cc([N+](=O)[O-])cnc1O 2030016991 YRUQIQJGVMILDM-ZCFIWIBFSA-N 252.230 -0.131 5 10 CBBE CN1CC(CCN=c2[nH]cc([N+](=O)[O-])c(=N)[nH]2)C1 2039900414 UAGUQCZDMQKGSQ-UHFFFAOYSA-N 252.278 -0.417 5 10 CBBE C[C@@H]1[C@H](N=c2nc([N+](=O)[O-])[nH]n2C)CCS1(=O)=O 2041242630 GLMBDURZIODQMU-PHDIDXHHSA-N 275.290 -0.867 5 10 CBBE C[C@@H]1CNC[C@@H](COc2nc([N+](=O)[O-])nn2C)O1 2041247462 MRSGUZADVZCBAO-RQJHMYQMSA-N 257.250 -0.521 5 10 CBBE CN(c1nc(=N)[nH]cc1[N+](=O)[O-])[C@H]1[C@@H]2CNC[C@@H]21 2053500580 ZEHAZIPAFGOUEM-BDINMYNLSA-N 250.262 -0.549 5 10 CBBE CN=c1nc(N(C)CC2CNC2)c([N+](=O)[O-])c[nH]1 2053623710 DDNNNZUXNLBOJB-UHFFFAOYSA-N 252.278 -0.496 5 10 CBBE C[C@H]1NCCC[C@@H]1N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2053686690 FWVXYQRHHAXPAT-RQJHMYQMSA-N 252.278 -0.228 5 10 CBBE Cc1cc(=NC[C@H](O)C(=O)O)c([N+](=O)[O-])c(C)[nH]1 2056769625 XGWYRCSIVMQOJG-QMMMGPOBSA-N 255.230 -0.114 5 10 CBBE O=C(O)[C@]1(n2ccnc2[N+](=O)[O-])CCN[C@H]2C[C@H]21 2057526636 AQTPXQHVFBPIED-FWWHASMVSA-N 252.230 -0.047 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@@H]1CO[C@H]2CNC[C@H]12 2057950615 SRGYTFIPILZAJZ-BHNWBGBOSA-N 253.262 -0.273 5 10 CBBE N=c1[nH]c(O[C@@H]2C[C@H]3NCC[C@H]32)ncc1[N+](=O)[O-] 2064786243 ZWVNTJFFIGMUMS-ATRFCDNQSA-N 251.246 -0.073 5 10 CBBE CN1C[C@H](N)[C@@H](Oc2ccc(N)c([N+](=O)[O-])n2)C1 2065005087 VZJONZVEHZHBEZ-YUMQZZPRSA-N 253.262 -0.408 5 10 CBBE O=C(O)[C@@]1(n2cnc([N+](=O)[O-])n2)COCC1(F)F 2076468940 VFQRAHDWHZMRGN-LURJTMIESA-N 264.144 -0.368 5 10 CBBE O=C(NCC1(CO)CNC1)c1ccc([N+](=O)[O-])[nH]1 2081959780 NWKYYERPOQCFLL-UHFFFAOYSA-N 254.246 -0.765 5 10 CBBE O=C(N=c1cc[nH]cc1[N+](=O)[O-])[C@@H]1CNCCO1 2082420977 WKPGYOQNKNMUHS-VIFPVBQESA-N 252.230 -0.661 5 10 CBBE C[C@](C(=O)O)(C1CS(=O)(=O)C1)n1ccc([N+](=O)[O-])n1 2090653270 LZZQYUKQRKMNCS-SECBINFHSA-N 289.269 -0.364 5 10 CBBE C[C@@H]1CCO[C@H]1CN=c1[nH]c(NN)ncc1[N+](=O)[O-] 2096108537 UIRMHHZRBUURRP-SVRRBLITSA-N 268.277 -0.071 5 10 CBBE COC(=O)[C@H](CO)Nc1ncc([N+](=O)[O-])c(OC)n1 2101474449 RMXVQULSTWCCII-YFKPBYRVSA-N 272.217 -0.661 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CC(C)(C)[C@@H]2O)[nH]1 2105095020 HEOUKOFZRFYQIN-HTRCEHHLSA-N 267.289 -0.158 5 10 CBBE O=C1CNCCN1CCOc1cccc([N+](=O)[O-])n1 2114629402 CYUAACLYNDOSLB-UHFFFAOYSA-N 266.257 -0.200 5 10 CBBE C[C@@H](O)[C@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1 2117478872 SCLKQWYTWBNPSK-KCJUWKMLSA-N 268.269 -0.005 5 10 CBBE CN=c1[nH]c(N2C[C@H]3C[C@@H](O)[C@H]2C3)ncc1[N+](=O)[O-] 2120641925 VVWZWEWOLSGOTG-ZXFLCMHBSA-N 265.273 -0.192 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2C[C@H]2CN)[nH]1 2122782977 LIHDLWBDJCJVDQ-YUMQZZPRSA-N 266.305 -0.272 5 10 CBBE O=[N+]([O-])c1c(F)nc[nH]c1=NCC[C@@H]1CNCCO1 2124798468 DGPIHQZINDXDIZ-SSDOTTSWSA-N 271.252 -0.264 5 10 CBBE NC(=O)COC1CN(c2cc([N+](=O)[O-])cc(F)n2)C1 2126839482 FJZAVVINLAQQAI-UHFFFAOYSA-N 270.220 -0.181 5 10 CBBE CNC[C@@]1(Oc2ncc([N+](=O)[O-])c(=N)[nH]2)CCOC1 2129437598 RYVBWTGQKAJAHY-JTQLQIEISA-N 269.261 -0.445 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCCc2ccno2)[nH]1 2129881062 AJKXMHVJMYZARF-UHFFFAOYSA-N 264.245 -0.087 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1C[C@@H](O)CC12CNC2 2130063844 UZANCQWTDCLFGQ-LURJTMIESA-N 269.236 -0.563 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N2CC[C@@H](O)[C@H](O)C2)[nH]1 2132137982 QIJGIGCMWMQMDW-RKDXNWHRSA-N 268.273 -0.615 5 10 CBBE CN(C)C(=O)OCCCN=c1[nH]cc([N+](=O)[O-])c(=N)[nH]1 2161177739 QPIVBBMSYIIIOB-UHFFFAOYSA-N 284.276 -0.281 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN1CC(CO)(C(=O)O)C1 2170801086 QFRJUOYGXXGDTF-UHFFFAOYSA-N 284.272 -0.521 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(NC[C@H]2CNCCN2C)[nH]1 2173894121 JGFXYKKNALKZAU-SECBINFHSA-N 280.332 -0.231 5 10 CBBE Cc1cc(N2CCNC[C@H]2C(N)=O)nc(C)c1[N+](=O)[O-] 2174257091 LGNYBIWOHMDGDA-VIFPVBQESA-N 279.300 -0.130 5 10 CBBE Nc1ccc(=NCC2[C@H]3CS(=O)(=O)C[C@H]23)[nH]c1[N+](=O)[O-] 2174614182 GLEHXPPHLRZSBH-HTQZYQBOSA-N 298.324 -0.304 5 10 CBBE O=C(NC1(CCO)CNC1)c1cccc([N+](=O)[O-])c1O 2174795258 VUJGYQQBGXBRKL-UHFFFAOYSA-N 281.268 -0.245 5 10 CBBE CNc1ncnc(N[C@@H]2CO[C@@H]3CNC[C@@H]23)c1[N+](=O)[O-] 2178142864 KTBBTSBLSFJFKM-XLPZGREQSA-N 280.288 -0.175 5 10 CBBE CN=c1[nH]c(OC[C@](C)(COC)NC)ncc1[N+](=O)[O-] 2184670315 BRUJSJUMLWNNPB-NSHDSACASA-N 285.304 -0.148 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](CO)[C@H](N)C2)n1 2186529988 YKHJSLFZXJJMBX-JGVFFNPUSA-N 283.288 -0.890 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2CC[C@H]3C[C@H]2[C@H](O)[C@H]3O)[nH]1 2199533284 VCDQUUOYAIBTIS-APYZPAHBSA-N 280.284 -0.277 5 10 CBBE Nc1ccc([N+](=O)[O-])c(CN2C[C@H](O)[C@H](O)[C@@H]2CO)c1 2201033162 KZKVCBPJAUGLIT-SDDRHHMPSA-N 283.284 -0.925 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@@H]2CN[C@]3(CCOC3)C2)[nH]n1C 2207489526 QLIVZSNLDWLZOY-JOYOIKCWSA-N 281.316 -0.008 5 10 CBBE C[C@]1(CO)COCCN1c1ncncc1[N+](=O)[O-] 2219808905 MDCVSEUNNDAUOM-JTQLQIEISA-N 254.246 -0.028 5 10 CBBE O=C1CNCC(=O)N1Cc1ccc([N+](=O)[O-])cn1 2221139471 ZACBHPBXIMYGAN-UHFFFAOYSA-N 250.214 -0.552 5 10 CBBE CC(C)n1cc([N+](=O)[O-])c(=N[C@H]2CCNC[C@H]2O)[nH]1 2230757787 OGMHSYNGGPFPKH-WCBMZHEXSA-N 269.305 -0.071 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCC[C@@H](O)[C@@H]1O 2232549519 VCVHVMDUGIRIKB-SOCHQFKDSA-N 284.272 -0.818 5 10 CBBE O=[N+]([O-])c1cccc(CN2CC[C@@](O)(CO)[C@@H](O)C2)c1 2234102794 AOEVKTRVGQHFRN-QWHCGFSZSA-N 282.296 -0.115 5 10 CBBE CO[C@H]1[C@H](CO)N(c2ncncc2[N+](=O)[O-])C[C@H]1OC 2235279778 XVFPXKIOJALDRP-AEJSXWLSSA-N 284.272 -0.404 5 10 CBBE Nc1nc(N2CC[C@H](O)[C@H](O)CC2)ccc1[N+](=O)[O-] 2269138289 OBEZOXJLCVYCOG-DTORHVGOSA-N 268.273 -0.106 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=NCC(=O)NCC(F)F)[nH]1 2271062586 CSZNYLHOYAXALM-UHFFFAOYSA-N 275.215 -0.092 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@@H]2COC[C@H]2CO)[nH]1 2271109153 IUYRVFDQTFMQFK-HTQZYQBOSA-N 268.273 -0.212 5 10 CBBE COc1nccc(N2C[C@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 2273003049 KHDPNHHMHSJZMM-HTQZYQBOSA-N 269.257 -0.070 5 10 CBBE NC(CO)(CO)CNc1cc([N+](=O)[O-])ccc1C(=O)O 2286193414 ODNKIULNQMIFBK-UHFFFAOYSA-N 285.256 -0.613 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@@H]2C[C@@H]3NCC[C@@H]32)n1 2286379456 ZCWFYQWJHIXCEE-HLTSFMKQSA-N 279.300 -0.058 5 10 CBBE Cc1nccc(N2C[C@H](O)[C@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 2289404124 WGAHZOFCPWCGKO-PTOFAABTSA-N 283.284 -0.551 5 10 CBBE COC[C@H]1C[C@@H](CN)N(c2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2289503386 PSBKGZXPWJVMEZ-YUMQZZPRSA-N 282.304 -0.403 5 10 CBBE O=[N+]([O-])c1cncnc1N1C[C@@H]2C[C@@H](O)[C@@H](O)[C@H]1C2 2333697896 DSOWKWCMGPWNOY-WDQPUEAGSA-N 266.257 -0.295 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1CC([C@H](O)CO)C1 2336768960 KJMNOYHXAFTMTM-SNVBAGLBSA-N 267.241 -0.585 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1C[C@@H]2C[C@H]1CN2 2341067682 RNTBPKJDEMGXJL-XHNCKOQMSA-N 265.273 -0.342 5 10 CBBE Cn1nc(N2CCO[C@@H]3CCNC[C@@H]32)nc1[N+](=O)[O-] 2345009611 FPQUODPQQJSGKT-JGVFFNPUSA-N 268.277 -0.710 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N[C@H]2CO[C@@H]3CNC[C@@H]32)[nH]1 2355694373 XWDLAMUEMKLSFW-KHQFGBGNSA-N 279.300 -0.148 5 10 CBBE NC[C@H]1[C@@H]2C[C@@H]2CN1C(=O)CCn1cnc([N+](=O)[O-])c1 2357565224 SHRGFRHFIVXPQL-BBBLOLIVSA-N 279.300 -0.013 5 10 CBBE COc1ccc([N+](=O)[O-])cc1OC[C@H](N)C(N)=O 45463567 NQIOQAWJXSKWDN-ZETCQYMHSA-N 255.230 -0.205 5 10 CBBE CCN(CC)C(=O)CN(C)c1ncnc(NN)c1[N+](=O)[O-] 159394120 YRKFKAWBAXLACE-UHFFFAOYSA-N 297.319 -0.025 5 10 CBBE O=C(NC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1)C1CC1 189376027 RYHLYWXBEZAQOW-UHFFFAOYSA-N 293.283 -0.472 5 10 CBBE CC(=O)NC(CO)(CO)C(=O)c1ccc([N+](=O)[O-])cc1 205143888 RJWPKQQDNYEAEA-UHFFFAOYSA-N 282.252 -0.363 5 10 CBBE CN1CCN(Nc2nc(NN)ncc2[N+](=O)[O-])CC1 234334496 MCFUNLXCBWNJAP-UHFFFAOYSA-N 268.281 -0.755 5 10 CBBE NNc1ccc([N+](=O)[O-])cc1CN1C[C@@H](CO)[C@@H](O)C1 317138383 AZFQWCKTJSHAJU-CABZTGNLSA-N 282.300 -0.335 5 10 CBBE CO[C@H]1C[C@@H](CO)N(c2ncc([N+](=O)[O-])c(N)n2)C1 343355191 RCAOKVHPBUJBMK-BQBZGAKWSA-N 269.261 -0.447 5 10 CBBE CO[C@H](CCNC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 401345109 MHFNYGTYPKUKEO-MRVPVSSYSA-N 286.244 -0.603 5 10 CBBE C[C@@H]1C(=O)N(C)CN1CCn1cc([N+](=O)[O-])cn1 592189133 FULSXGGTJANDLZ-MRVPVSSYSA-N 253.262 -0.089 5 10 CBBE CO[C@](C)(CO)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 594395769 HQPKNLPPWXLELL-VIFPVBQESA-N 258.234 -0.555 5 10 CBBE Nc1c(C(=O)N[C@@H]2CCNC2=O)cccc1[N+](=O)[O-] 597857520 UYVWFUFXGHAYLN-SSDOTTSWSA-N 264.241 -0.205 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](O)[C@@H]1CCCO1 600238822 RDXQUUAAGFBEOD-UWVGGRQHSA-N 298.299 -0.244 5 10 CBBE N[C@]1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOC1 688488305 PZKXYAFKUSXUKY-JTQLQIEISA-N 254.246 -0.230 5 10 CBBE Nc1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@@H]2CO)n1 698154114 VZODTRDNOJZHPS-RQJHMYQMSA-N 254.246 -0.496 5 10 CBBE O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCNC[C@H]1O 710439569 ANJHJEBSEKGTFD-VXGBXAGGSA-N 279.296 -0.024 5 10 CBBE COc1ccc([N+](=O)[O-])c(N2CC(CO)(CO)C2)n1 721391003 RXHMXCVLICYXMG-UHFFFAOYSA-N 269.257 -0.211 5 10 CBBE O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CC(O)(CO)C1 854675179 YUDKJYPDGASUTL-JTQLQIEISA-N 282.252 -0.806 5 10 CBBE CC(=O)N1CC[C@@H](CN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1127158980 CCTYDNRSNPZXFU-HBNTYKKESA-N 269.301 -0.022 5 10 CBBE CS(=O)(=O)c1cccnc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1128556400 FLCQADPPDMVGQU-VXNVDRBHSA-N 299.308 -0.234 5 10 CBBE COC(=O)C1(O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1 1175340675 CETLYIZPIQFKDY-UHFFFAOYSA-N 296.235 -0.340 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)c1cnc[nH]1 1177836039 BBLRFYOHBZECKP-SECBINFHSA-N 280.244 -0.636 5 10 CBBE C[C@H]1CC(=O)NN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 1290609926 NYOQFBNJBVSQKR-YFKPBYRVSA-N 266.213 -0.039 5 10 CBBE COC(=O)CN(C)CCNC(=O)c1ccc([N+](=O)[O-])cn1 1319626858 ZZGVGVDIVCNWEZ-UHFFFAOYSA-N 296.283 -0.176 5 10 CBBE C[C@@H](CC(N)=O)NC(=O)c1c([N+](=O)[O-])cnn1C 1556637516 ZYHJDUAYRIVXIU-YFKPBYRVSA-N 255.234 -0.678 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](O)[C@@H](CO)C1 1637678679 QBLDMNVUVCLXAT-NXEZZACHSA-N 298.299 -0.699 5 10 CBBE NC(=O)C1(O)CN(c2ccc([N+](=O)[O-])cc2F)C1 1640274714 LECVXYPDPPLMRH-UHFFFAOYSA-N 255.205 -0.230 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](O)C[C@@]1(C)CO 1641839139 AAGJZSLZEDGRIY-SKDRFNHKSA-N 298.299 -0.556 5 10 CBBE CN1CCC(N(CCO)C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1643943130 NNHPHOUHNFYNAZ-UHFFFAOYSA-N 297.315 -0.153 5 10 CBBE NC(=O)C(=O)NC/C=C\CNCc1csc([N+](=O)[O-])c1 1732895492 RNNKOARWWDHRSL-UPHRSURJSA-N 298.324 -0.096 5 10 CBBE C[C@@H]1O[C@H](Oc2cccc([N+](=O)[O-])c2)[C@H](O)[C@H](O)[C@@H]1O 1772502552 YRJBDGWTIOMJOP-FBRIDRNKSA-N 285.252 -0.199 5 10 CBBE O=C(O)CN(CC(=O)O)C(=O)c1ccc(O)c([N+](=O)[O-])c1 1866357546 YROXCIZIAMMSHI-UHFFFAOYSA-N 298.207 -0.088 5 10 CBBE O=C(O)[C@@H]1C[C@H]2CN(C(=O)N3CC([N+](=O)[O-])C3)C[C@H]21 1876136712 HKJLPRGWXCUKMJ-NBEYISGCSA-N 269.257 -0.280 5 10 CBBE CN(C(=O)c1cc([N+](=O)[O-])ncc1NN)C1CC(O)C1 1914601822 XNRWSVDNYJYLHW-UHFFFAOYSA-N 281.272 -0.129 5 10 CBBE O=C(NC1(CO)CNC1)c1cc(Cl)ncc1[N+](=O)[O-] 1918428018 GTPAKGPNLCNUTD-UHFFFAOYSA-N 286.675 -0.293 5 10 CBBE Cc1cc(=NCCS(N)(=O)=O)c([N+](=O)[O-])c(C)[nH]1 1921387256 CFZYCCPGERZOPC-UHFFFAOYSA-N 274.302 -0.271 5 10 CBBE C[C@@H]1CN(c2nc(NN)ccc2[N+](=O)[O-])CC(=O)N1C 1925956040 HNTXHMQDHUUOMP-SSDOTTSWSA-N 280.288 -0.058 5 10 CBBE O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@H](CO)C[C@@H](CO)C1 1963558780 TXCLODLVFBCQSG-RKDXNWHRSA-N 283.284 -0.014 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN[C@H]2C[C@@H]21 1964395892 GYFIEPRFMDUTBS-YUMQZZPRSA-N 251.246 -0.636 5 10 CBBE CN=c1[nH]c(=NCCCCCO)[nH]cc1[N+](=O)[O-] 2039924758 OZKBUEKWALQFFD-UHFFFAOYSA-N 255.278 -0.155 5 10 CBBE CN=c1[nH]c(N[C@@H]2CCNC2=O)ncc1[N+](=O)[O-] 2039931950 SAUWDXLOYMWFMX-RXMQYKEDSA-N 252.234 -0.851 5 10 CBBE Cn1cc([N+](=O)[O-])c(Cn2ccc(O)nc2=O)n1 2041192358 XJVUNGWILDLUTA-UHFFFAOYSA-N 251.202 -0.361 5 10 CBBE C[C@@H](N)c1cnnn1Cc1nn(C)cc1[N+](=O)[O-] 2041197532 DEUAIOYOZVRZRB-ZCFIWIBFSA-N 251.250 -0.012 5 10 CBBE CN1CCC(CN=c2nc([N+](=O)[O-])[nH]n2C)CC1 2041251006 NZDMKLCIYCIRHK-UHFFFAOYSA-N 254.294 -0.101 5 10 CBBE N=c1[nH]c(N2C[C@@H](F)C[C@@H]2CN)ncc1[N+](=O)[O-] 2053531737 IFLRPEOMAYWEAE-NTSWFWBYSA-N 256.241 -0.327 5 10 CBBE Nc1cc(NC2(CCO)CNC2)ncc1[N+](=O)[O-] 2053545602 YVVKUYRQOBJMSI-UHFFFAOYSA-N 253.262 -0.292 5 10 CBBE NC[C@@H]1C[C@H](F)CN1c1ncnc(N)c1[N+](=O)[O-] 2053633223 ILXAOVMDBFJZPG-WDSKDSINSA-N 256.241 -0.158 5 10 CBBE O=[N+]([O-])c1c[nH]ccc1=N[C@@H]1[C@H]2CS(=O)(=O)C[C@H]21 2054276310 UFZKJEWGLQUEPK-MTBHXBHISA-N 269.282 -0.133 5 10 CBBE CN(C)[C@@H]1CNC[C@@H]1Oc1nn(C)cc1[N+](=O)[O-] 2056220836 WXBDAPZUZOKIOX-APPZFPTMSA-N 255.278 -0.391 5 10 CBBE N=c1[nH]c(N2CCC=C[C@@H]2CO)ncc1[N+](=O)[O-] 2061974085 DDRUPHQENXSEKH-SSDOTTSWSA-N 251.246 -0.075 5 10 CBBE CCOC[C@H](CN)Oc1ncc([N+](=O)[O-])c(=N)[nH]1 2064997588 JHPQKMHUSQNUBP-LURJTMIESA-N 257.250 -0.460 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@@H](C(=O)O)C(C)(C)O 2067772870 SWAXYJXCZWYLBM-LURJTMIESA-N 258.234 -0.036 5 10 CBBE O=C(O)[C@@H]1CN(C(=O)N2CC([N+](=O)[O-])C2)C[C@@H]1F 2071563688 MLWNKFGVPMDDDO-RQJHMYQMSA-N 261.209 -0.578 5 10 CBBE COC(=O)[C@@H](O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 2085315025 QXPUGWLAJGQZNQ-ZETCQYMHSA-N 276.632 -0.056 5 10 CBBE Nc1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](CO)C2)c1 2085726717 WRIWABDYRVXECM-HQJQHLMTSA-N 253.258 -0.034 5 10 CBBE C[C@H](CN=c1[nH]c(=N)[nH]cc1[N+](=O)[O-])c1ncon1 2087632786 WMBGZBGDCXLXPH-RXMQYKEDSA-N 265.233 -0.182 5 10 CBBE O=c1ncc([N+](=O)[O-])cn1C[C@@H](O)[C@H]1CCCNC1 2096027604 WWUKGNBLURUDHR-WCBMZHEXSA-N 268.273 -0.488 5 10 CBBE COC1(CCN=c2[nH]c(F)ncc2[N+](=O)[O-])CNC1 2110713843 XOHHSUUVDHFSQL-UHFFFAOYSA-N 271.252 -0.264 5 10 CBBE N=c1ccc([N+](=O)[O-])c(NC2CN(C3COC3)C2)[nH]1 2114711261 BLCCSZHNPNJOKA-UHFFFAOYSA-N 265.273 -0.103 5 10 CBBE CN(c1nc(F)ncc1[N+](=O)[O-])[C@@H]1CC(=O)NC1=O 2114737251 JGTMJLLOFAUWGJ-SCSAIBSYSA-N 269.192 -0.625 5 10 CBBE CCN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@H](C)CN)[nH]1 2117126372 YYAVIHGKSISMIZ-SSDOTTSWSA-N 268.321 -0.024 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCCC23CNC3)[nH]1 2117390587 FUVCYDULXPOYPU-QMMMGPOBSA-N 264.289 -0.227 5 10 CBBE C[C@@H](O)[C@@H]1CN(c2nc(=N)[nH]cc2[N+](=O)[O-])CCO1 2117544039 FFGUXBVBHJPCET-SVRRBLITSA-N 269.261 -0.617 5 10 CBBE NC[C@H]1C[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])nc1 2117643617 IHMGBJGFFGHVBL-HTQZYQBOSA-N 286.313 -0.137 5 10 CBBE CO[C@@H]1CN[C@H](COc2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2128117365 LBEYTIANCNJSOU-BQBZGAKWSA-N 269.261 -0.447 5 10 CBBE Cc1ccc(S(=O)(=O)N2CC([N+](=O)[O-])C2)c(NN)n1 2137704793 WVWUZYWQNVTYHT-UHFFFAOYSA-N 287.301 -0.675 5 10 CBBE N[C@@H]1COC[C@H]1CC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2137715080 UOCTYXOHJBXGGX-HTQZYQBOSA-N 266.257 -0.286 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3C[C@H]2[C@@H]3CO)n1 2138230747 PGLKKGIODMYKRZ-PRJMDXOYSA-N 266.257 -0.219 5 10 CBBE CS(=O)(=O)NCCNc1cc(NN)ccc1[N+](=O)[O-] 2141816137 TVFWQTOZHTYNRE-UHFFFAOYSA-N 289.317 -0.159 5 10 CBBE N=c1[nH]c(OCCCOC2CNC2)ncc1[N+](=O)[O-] 2141975721 HZPMIRKUZQHMMU-UHFFFAOYSA-N 269.261 -0.445 5 10 CBBE CN(C)c1nc(N2C[C@H](O)C[C@H]2CO)ncc1[N+](=O)[O-] 2157682685 VNEWDMLZAZULBX-JGVFFNPUSA-N 283.288 -0.617 5 10 CBBE N=c1[nH]c(N2CC3(C2)OCCC[C@@H]3O)ncc1[N+](=O)[O-] 2159649855 GWSQAHJNTJQJSC-QMMMGPOBSA-N 281.272 -0.473 5 10 CBBE Cc1[nH]c(=N)nc(N(C[C@H](C)O)C[C@@H](C)O)c1[N+](=O)[O-] 2159727675 XUXGLIAAQSABPW-KNVOCYPGSA-N 285.304 -0.326 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@H]1Cc2nncn2C1 2167658783 SPWIHOFTVPRFRG-ZCFIWIBFSA-N 279.235 -0.178 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NC[C@@H]2C[C@H](N)[C@@H](O)C2)c1[N+](=O)[O-] 2173762002 PLBZQIHKMKUOJJ-CSMHCCOUSA-N 282.304 -0.962 5 10 CBBE CCN=c1[nH]cc([N+](=O)[O-])c(=NCC2[C@@H]3CNC[C@@H]23)[nH]1 2173891382 CVXZPCCYWMXBPO-HTQZYQBOSA-N 278.316 -0.462 5 10 CBBE CN=c1ccc([N+](=O)[O-])c(N[C@@H]2CCO[C@@H]2C(N)=O)[nH]1 2174116549 OJAUIGCDUQTXLB-MUWHJKNJSA-N 281.272 -0.492 5 10 CBBE NCC1(CNC(=O)CCn2cnc([N+](=O)[O-])c2)COC1 2176836126 RYIGYGYXZJQGCR-UHFFFAOYSA-N 283.288 -0.727 5 10 CBBE O=[N+]([O-])c1cccc(N2CCN(C[C@H](O)CO)CC2)n1 2178040841 SHERGNSTVUAYSW-JTQLQIEISA-N 282.300 -0.535 5 10 CBBE CO[C@@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C[C@@H]1N 2179061243 VTTQWULGLQNZNM-IONNQARKSA-N 282.256 -0.150 5 10 CBBE C[C@](N)(CO)CNC(=O)COc1cccc([N+](=O)[O-])c1 2181127544 WBECXKNSTILRLD-GFCCVEGCSA-N 283.284 -0.201 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](N)[C@H](CO)C2)n1 2186535907 UFVVCQIAZCDNGC-JGVFFNPUSA-N 283.288 -0.890 5 10 CBBE CN=c1[nH]c(N[C@H]2CCN(C)C(=O)C2)ncc1[N+](=O)[O-] 2188496495 BAFKOZPYKWVEBS-ZETCQYMHSA-N 280.288 -0.119 5 10 CBBE O=C(O)[C@@]1(O)CCN(c2cccc([N+](=O)[O-])c2)C[C@@H]1O 2197465704 DWTVXINZFKXINV-CMPLNLGQSA-N 282.252 -0.019 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2C[C@@]23CCOC3)c1 2198313084 UJKOQAWWEOKUKZ-GRYCIOLGSA-N 282.300 -0.079 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1CC[C@H]2C[C@H]1[C@H](O)[C@@H]2O 2199527790 UOTFPXCSEZSDFP-ITFKJWCVSA-N 284.247 -0.156 5 10 CBBE Cc1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)[C@H]2C(=O)O)n1 2200864184 PRIWCFHYVZCQOX-CIUDSAMLSA-N 283.240 -0.707 5 10 CBBE O=[N+]([O-])c1cnc(N2CC[C@@](O)(CO)[C@@H](O)C2)s1 2218683472 FDUYZRINUYWNNI-IMTBSYHQSA-N 275.286 -0.654 5 10 CBBE Cn1cc([N+](=O)[O-])c(C[C@@]2(C(=O)O)C=CCN2)n1 2221441204 OATDHBXYTMVESH-SNVBAGLBSA-N 252.230 -0.146 5 10 CBBE CCN1C[C@H](O)[C@@H](NCc2nn(C)cc2[N+](=O)[O-])C1 2231934254 FTSRCQYQGPBLLN-ONGXEEELSA-N 269.305 -0.517 5 10 CBBE COC[C@@H]1[C@H](O)[C@H](O)CN1Cc1ccc([N+](=O)[O-])cn1 2233862692 LUAPRVHYQWHNLL-UTUOFQBUSA-N 283.284 -0.458 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1C[C@@H](CO)C[C@@H](CO)C1 2236639196 BCMRBGWSNHWJHJ-OCAPTIKFSA-N 286.263 -0.049 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1C[C@H](N)C[C@@H](C(N)=O)C1 2240562739 CDLLARTZNXCVDH-HTQZYQBOSA-N 282.304 -0.550 5 10 CBBE NCC1(Oc2ncnc(F)c2[N+](=O)[O-])CS(=O)(=O)C1 2267889252 HDCCNZQKPVDDQB-UHFFFAOYSA-N 292.248 -0.971 5 10 CBBE Cc1ncc([N+](=O)[O-])c(=N[C@@H](C)c2nc(=O)o[nH]2)[nH]1 2271064919 HYFYCXJLGAKBCL-BYPYZUCNSA-N 266.217 -0.035 5 10 CBBE CCc1ncc([N+](=O)[O-])c(N2CC[C@H]2[C@@H](O)CO)n1 2271103291 LGQJTOFVZRIZBL-CBAPKCEASA-N 268.273 -0.121 5 10 CBBE C[C@@H](CC(N)=O)N=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2278416461 VVLHOCBBJHQGKK-LURJTMIESA-N 264.245 -0.265 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H](O)[C@H](O)CC1 2284581705 AEMLMSDWZFCZRX-NXEZZACHSA-N 284.272 -0.865 5 10 CBBE O=C(O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H]1O 2295615192 UPUDICXNGYFALX-HTRCEHHLSA-N 283.240 -0.170 5 10 CBBE CS[C@@H]1CNC[C@H]1N=c1nc([N+](=O)[O-])n(C)[nH]1 2304514846 OMAFJYQDVJGIGM-PHDIDXHHSA-N 258.307 -0.740 5 10 CBBE Cn1[nH]c(=NCC(=O)NCC2CC2)nc1[N+](=O)[O-] 2321695462 ARSKLMFBZVTLIZ-UHFFFAOYSA-N 254.250 -0.917 5 10 CBBE Cn1[nH]c(=N[C@@H]2CCNC23CCC3)nc1[N+](=O)[O-] 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ARNVYUBKHMHZKF-JTQLQIEISA-N 268.277 -0.943 5 10 CBBE C[C@@H](O)[C@H](CO)NC(=O)Cc1ccccc1[N+](=O)[O-] 2117477076 AWDXLMFQOLPADU-SCZZXKLOSA-N 268.269 -0.005 5 10 CBBE C[C@@H](O)[C@@H](CO)Nc1ncc(C(=O)O)cc1[N+](=O)[O-] 2117480861 OUQQWHUASNYIJL-IYSWYEEDSA-N 271.229 -0.158 5 10 CBBE COc1ncnc(O[C@@H]2COCC[C@H]2N)c1[N+](=O)[O-] 2119771092 AYHCVKZUEYKQMV-RNFRBKRXSA-N 270.245 -0.112 5 10 CBBE COC(=O)[C@H](NC=O)[C@@H](O)c1ccccc1[N+](=O)[O-] 2121844587 JROVXWBTSKWLGG-ZJUUUORDSA-N 268.225 -0.084 5 10 CBBE CO[C@H]1CN[C@H](COc2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2128108632 LBEYTIANCNJSOU-NKWVEPMBSA-N 269.261 -0.447 5 10 CBBE NC(=O)[C@@]1(Oc2ncnc(F)c2[N+](=O)[O-])CCNC1 2128240286 BLVMYIJOWIBEJH-SECBINFHSA-N 271.208 -0.880 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=Nc2cccnc2N)[nH]1 2134942460 XAWPMLULTXLWNO-UHFFFAOYSA-N 261.245 -0.009 5 10 CBBE O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1NC[C@H](O)[C@H]1O 2136442611 GAWKEDZJYYQYHK-IVZWLZJFSA-N 267.241 -0.773 5 10 CBBE Cc1c([N+](=O)[O-])c(O[C@H]2CS(=O)(=O)C[C@H]2N)nn1C 2142485656 HZUYXXHIUBQUMB-RQJHMYQMSA-N 290.301 -0.860 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(NCCC2(O)CNC2)c1 2143826533 VCGHRZBBEDCYJR-UHFFFAOYSA-N 280.284 -0.170 5 10 CBBE Cn1cc(CN)c(=NC(=O)c2ccc([N+](=O)[O-])n2C)[nH]1 2150652186 OVUJXPRXZGFNDN-UHFFFAOYSA-N 278.272 -0.200 5 10 CBBE CN=c1nc(N2CC[C@@](O)(COC)C2)c([N+](=O)[O-])c[nH]1 2151895969 YIVNWEJOQBESCI-NSHDSACASA-N 283.288 -0.564 5 10 CBBE CNC(=O)c1ccc([N+](=O)[O-])c(N(CCN)CCN)c1 2152185703 AGTVHOMYQIPIHQ-UHFFFAOYSA-N 281.316 -0.322 5 10 CBBE COc1nc(N2C[C@H](CO)C[C@H]2CO)ncc1[N+](=O)[O-] 2157682768 WROBBQVRBFHTQE-SFYZADRCSA-N 284.272 -0.427 5 10 CBBE COC1(C(N)=O)CN(Cc2ccc(N)c([N+](=O)[O-])c2)C1 2161267658 UPSYNOUUSKRTFK-UHFFFAOYSA-N 280.284 -0.137 5 10 CBBE CO[C@@H]1C[C@@H](O)CN(c2cc([N+](=O)[O-])cc(NN)n2)C1 2165325401 FDUXQSOHQJWJCX-RKDXNWHRSA-N 283.288 -0.139 5 10 CBBE NC(=O)c1ccc(N2C[C@@H](N)C[C@@H](O)C2)c([N+](=O)[O-])c1 2168104074 XVMNSYXWYGJEBX-DTWKUNHWSA-N 280.284 -0.408 5 10 CBBE Nc1ncnc(N2C[C@H]3C[C@@H](O)[C@@H](O)[C@H]2C3)c1[N+](=O)[O-] 2173319495 GMLKWKCRKDNYMK-PULFBKJNSA-N 281.272 -0.713 5 10 CBBE CN=c1nc(N2C[C@@H]3[C@H](CO)C[C@H]3C2)c([N+](=O)[O-])c[nH]1 2174298238 SDGLXNLIAFUGEX-CIUDSAMLSA-N 279.300 -0.087 5 10 CBBE CON(C(=O)CCn1cnc([N+](=O)[O-])c1)[C@@H]1CCNC1 2176055777 UOVZOAOWHUVNPR-SECBINFHSA-N 283.288 -0.067 5 10 CBBE COC(=O)[C@H]1C[C@@H](Oc2nc(F)ncc2[N+](=O)[O-])CN1 2184613600 ZNSWSGZJEKDLRG-PHDIDXHHSA-N 286.219 -0.194 5 10 CBBE O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@H](O)[C@@H](O)C2)n1 2188626404 DDZNUAJPOSCIIP-IUCAKERBSA-N 283.240 -0.380 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CCNCCC2=O)n1 2221143678 URFNINGCWIEJKD-UHFFFAOYSA-N 253.262 -0.350 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NCCCS(N)(=O)=O)[nH]1 2222995161 MTBKRWDSOSPWGA-UHFFFAOYSA-N 277.306 -0.676 5 10 CBBE CCn1ncc([N+](=O)[O-])c1N1C[C@H](N)[C@@H](OC)C1 2223803751 YEELMBJVAGACAU-CBAPKCEASA-N 255.278 -0.027 5 10 CBBE CC(C)n1cc([N+](=O)[O-])c(=NC[C@@]2(O)CCNC2)[nH]1 2230757609 MYFTXEXXODHJMW-LLVKDONJSA-N 269.305 -0.070 5 10 CBBE CC(C)n1cc([N+](=O)[O-])c(=NC[C@H]2CNC[C@H]2O)[nH]1 2230798808 PIHONFXYTWMVTL-PSASIEDQSA-N 269.305 -0.214 5 10 CBBE N[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)C(=O)O 2237439632 MTMQOGTWAZTPDU-SECBINFHSA-N 285.231 -0.196 5 10 CBBE Nc1nc[nH]c(=NC[C@]23CNC[C@@H]2CCO3)c1[N+](=O)[O-] 2237800608 KKLUROGFLZTRGC-WRWORJQWSA-N 280.288 -0.821 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CCOC[C@@]2(CN)CO)n1 2239259394 QERVZPPVBOIBFI-LLVKDONJSA-N 285.304 -0.662 5 10 CBBE Nc1ccc(N2CC(O)(CCO)C2)nc1[N+](=O)[O-] 2258286178 GEDVNFWGNSVGJL-UHFFFAOYSA-N 254.246 -0.495 5 10 CBBE O=[N+]([O-])c1cnn2ccc(N3C[C@@H](O)CO3)nc12 2263865459 NFZMCGVGCZVQBF-ZCFIWIBFSA-N 251.202 -0.250 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=NC[C@@H](OC)C(=O)O)[nH]1 2271096220 HLXHSOPWXDFFNU-SSDOTTSWSA-N 270.245 -0.119 5 10 CBBE CO[C@@H]1[C@@H](O)C[C@H]1N=c1cc([N+](=O)[O-])cc(NN)[nH]1 2271174259 CWIZWEMRXQDBHE-FWWHASMVSA-N 269.261 -0.743 5 10 CBBE O=[N+]([O-])c1cccc(N2C[C@H](O)[C@H](O)[C@@H](CO)C2)n1 2273692419 GESSWCIYFHVBCQ-VHSKPIJISA-N 269.257 -0.860 5 10 CBBE CCN=c1cc([N+](=O)[O-])cc(N2CC[C@H]2[C@H](O)CO)[nH]1 2286207988 KESIWGXLWUTWGG-VHSXEESVSA-N 282.300 -0.225 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NC[C@H]1C[C@@H](N)[C@H](O)C1 2309547410 DBNPGFGURBKUPH-LKEWCRSYSA-N 255.278 -0.162 5 10 CBBE C[C@@H]1C[C@](C(=O)O)(c2nc([N+](=O)[O-])n(C)n2)CO1 2321697167 RLBYEMQUXKGYNK-MLUIRONXSA-N 256.218 -0.146 5 10 CBBE CO[C@H]1CCOC[C@@H]1N=c1nc([N+](=O)[O-])n(C)[nH]1 2321704731 LKUGXBVKXBHJBP-BQBZGAKWSA-N 257.250 -0.639 5 10 CBBE CN(c1nc([N+](=O)[O-])n(C)n1)[C@@H]1CNCC12CC2 2321755612 VKPRQVZOPZNCGX-SSDOTTSWSA-N 252.278 -0.089 5 10 CBBE Cn1[nH]c(=NC[C@@H](N)CC(F)(F)F)nc1[N+](=O)[O-] 2321765329 UUQBQMUTOPGZTM-BYPYZUCNSA-N 268.199 -0.163 5 10 CBBE CC[C@H]1CC[C@@](C(=O)O)(N2CC([N+](=O)[O-])C2)CN1 2323717316 MDCOGTAFARIHMY-GZMMTYOYSA-N 257.290 -0.067 5 10 CBBE O=C1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 50445820 CMQAVDCOPHMPAO-UHFFFAOYSA-N 279.252 -0.052 5 10 CBBE O=C(NC[C@@H](O)C(=O)O)c1csc([N+](=O)[O-])c1 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SPAWLYOPVPONEW-WCTZXXKLSA-N 252.278 -0.317 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@@]23C[C@@H]3C(=O)O)nc1[N+](=O)[O-] 2321763098 ACMGZFHQIGECJC-UDJQAZALSA-N 253.218 -0.580 5 10 CBBE CN=c1nc(N2C[C@@H]3CC[C@H]2[C@H]3N)c([N+](=O)[O-])c[nH]1 2331528532 PIEGEXSNNVJDHN-ZKWXMUAHSA-N 264.289 -0.226 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)N[C@@H]2[C@H]3CN[C@@H]2C3)c1 2333050756 IEOQSCRLCCQMRA-BDODKLCJSA-N 284.297 -0.372 5 10 CBBE O=C(O)C(CO)(CO)N=c1c(Cl)c[nH]cc1[N+](=O)[O-] 2344221913 POPQYVOKUKXLIG-UHFFFAOYSA-N 291.647 -0.715 5 10 CBBE Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@@H](O)C1 61713785 HQPFVJNUVUQAOR-MRVPVSSYSA-N 287.297 -0.068 5 10 CBBE COc1ncnc(NCCN2CCNCC2)c1[N+](=O)[O-] 94739812 DHNXEVATWWAORK-UHFFFAOYSA-N 282.304 -0.290 5 10 CBBE O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CCCOC2)c1 109546708 LQGWBGJYDBSGSU-KOLCDFICSA-N 270.289 -0.079 5 10 CBBE CCCn1cc([N+](=O)[O-])c(=O)n(CC(=O)OCC)c1=O 111544060 WKTJFSAKKCNFFW-UHFFFAOYSA-N 285.256 -0.109 5 10 CBBE O=C(NCCO)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1 159499360 YACYNNMSXMZRMH-MRVPVSSYSA-N 297.267 -0.099 5 10 CBBE C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCN1CCO 188785486 SQJXXIHOJLTDMY-JTQLQIEISA-N 297.315 -0.684 5 10 CBBE Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CN(C)CCO1 194599561 HMXHFKVPBBELAA-JTQLQIEISA-N 297.315 -0.453 5 10 CBBE CCNC(=O)[C@H]1CNCCN1c1ncc([N+](=O)[O-])s1 226781280 CSCWEEFSPILGNL-SSDOTTSWSA-N 285.329 -0.034 5 10 CBBE NNc1ncnc(NCCc2ncno2)c1[N+](=O)[O-] 231870472 RHTILCNHGRNZLQ-UHFFFAOYSA-N 266.221 -0.292 5 10 CBBE CCNC(=O)CNc1nc(NN)nc(C)c1[N+](=O)[O-] 233489558 JBFLTHSKVUSTNS-UHFFFAOYSA-N 269.265 -0.473 5 10 CBBE COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CNC[C@H]2O)c1 262300332 PNPHMRPPRIKDQZ-PRHODGIISA-N 295.295 -0.087 5 10 CBBE C[C@H]1CN(c2ncnc(NN)c2[N+](=O)[O-])C[C@H](CO)O1 299956520 DODZSLQJIVNDLG-NKWVEPMBSA-N 284.276 -0.744 5 10 CBBE CN1CC[C@@H](Oc2ncnc(NN)c2[N+](=O)[O-])C1 304627437 YUCWFOQQWWZSIF-ZCFIWIBFSA-N 254.250 -0.247 5 10 CBBE O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@](O)(CO)C1 313686931 USJCDGCWNWDFNJ-GFCCVEGCSA-N 282.252 -0.130 5 10 CBBE C[C@@]1(F)CNCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 566250245 CBXJQPRSIPAONK-LLVKDONJSA-N 285.279 -0.049 5 10 CBBE NC(=O)c1ccc(N2C[C@@H](O)C[C@@H](O)C2)c([N+](=O)[O-])c1 610588170 IZHCJWHPJGDKMX-DTORHVGOSA-N 281.268 -0.374 5 10 CBBE C[C@H](Nc1cc(C(=O)O)c([N+](=O)[O-])cn1)[C@H](O)CO 698952686 DLDGEEHESZMIMZ-YLWLKBPMSA-N 271.229 -0.158 5 10 CBBE O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CNC[C@@H]1O 700640408 GJELBKGJIYSVIC-QWRGUYRKSA-N 281.268 -0.578 5 10 CBBE O=C1CC[C@H](Nc2ncnc(F)c2[N+](=O)[O-])C(=O)N1 701577426 HZPPZBPPVNKCEH-BYPYZUCNSA-N 269.192 -0.259 5 10 CBBE COc1ncnc(NC2(CN)COC2)c1[N+](=O)[O-] 705652270 BPKIPIHNWUCIRI-UHFFFAOYSA-N 255.234 -0.467 5 10 CBBE Nc1cc(C(=O)N[C@@H]2CCOC[C@@H]2O)c([N+](=O)[O-])cn1 707049321 QOSRVGGFRLEKEJ-APPZFPTMSA-N 282.256 -0.548 5 10 CBBE CNC[C@H](O)CN(C)C(=O)CCn1cnc([N+](=O)[O-])c1 708876843 KHPGHULJTPJCLD-VIFPVBQESA-N 285.304 -0.780 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCNC[C@H]2O)c1 710349633 SLJPITIPKIPANG-GZMMTYOYSA-N 280.284 -0.172 5 10 CBBE CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1N 720820682 KDSSPSAASOAEKX-VIFPVBQESA-N 267.289 -0.013 5 10 CBBE CCc1[nH]nc(C(=O)O[C@H]2CCNC2=O)c1[N+](=O)[O-] 795612218 OLXJWVKWYUGKQI-LURJTMIESA-N 268.229 -0.074 5 10 CBBE Cn1nnc(COC(=O)c2ccc([N+](=O)[O-])cn2)n1 799498368 JBWUQMDGJWCWOT-UHFFFAOYSA-N 264.201 -0.130 5 10 CBBE C/C(=C/C(=O)N[C@@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1 804354831 KQTCVZOZFDWZIP-JYKYSHPRSA-N 293.279 -0.040 5 10 CBBE C[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H]1CN(C)CCO1 1116467700 NYURAGCIUSCEDK-SCZZXKLOSA-N 297.315 -0.223 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@@H](O)C1CC1 1149642853 UYALTYGVJDWMJC-LLVKDONJSA-N 281.268 -0.356 5 10 CBBE CCn1cc([N+](=O)[O-])c(C(=O)N2CC(NC3COC3)C2)n1 1179458426 QXCGVNWXPHCOPZ-UHFFFAOYSA-N 295.299 -0.376 5 10 CBBE NC(=O)[C@@H]1CN(c2cc(F)c([N+](=O)[O-])cc2CO)CCO1 1185089347 VDDZRGZUZRVMBK-NSHDSACASA-N 299.258 -0.083 5 10 CBBE NC(=O)[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 1325916043 QARMIXTTYYIZHL-LLVKDONJSA-N 280.240 -0.948 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)NCc2nnnn2C)n1 1467317396 CCZANIQXYNSTTB-UHFFFAOYSA-N 277.244 -0.248 5 10 CBBE COCCC(=O)NCCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 1497356237 UTZMNWUAMUFQEV-GHMZBOCLSA-N 299.327 -0.205 5 10 CBBE CC(=O)NCCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl 1624148311 BNVLYTBGJIOGSB-UHFFFAOYSA-N 275.652 -0.163 5 10 CBBE C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1cnccn1 1627710735 FUTCQLWAUPJCPM-ZETCQYMHSA-N 277.244 -0.146 5 10 CBBE NC(=O)N1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1629117131 FOPPEHVBXBIQIO-DJLDLDEBSA-N 270.289 -0.442 5 10 CBBE CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](CO)C1 1630706958 FPWINZZAOXEQBA-ZETCQYMHSA-N 269.261 -0.934 5 10 CBBE Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H](O)[C@@H](CO)C2)n1 1642400913 HBOKNSTYONXDGT-LDYMZIIASA-N 281.268 -0.277 5 10 CBBE COCCC(=O)N(C)CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1689051134 RLODBYKSXIRPRJ-NXEZZACHSA-N 287.316 -0.395 5 10 CBBE C[C@@H]1C[C@@H](C(=O)O)N1C(=O)Cn1cc([N+](=O)[O-])cn1 1913192215 NTEWSXSIUNSXGY-SVRRBLITSA-N 268.229 -0.135 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@H](O)[C@@H](O)C1 1917246579 BEBJPUCUNIZDOE-UWVGGRQHSA-N 267.241 -0.765 5 10 CBBE C[C@](C(=O)O)([C@@H]1CNCCO1)n1ccc([N+](=O)[O-])n1 1919708899 ICMUHJSLRCXENT-OIBJUYFYSA-N 270.245 -0.421 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CCN(C)[C@@H](C)C(N)=O 1963090961 PPKRVUUFOFKAPQ-ZETCQYMHSA-N 255.278 -0.095 5 10 CBBE CNC(=O)[C@H]1CCN(Cc2nn(C)cc2[N+](=O)[O-])C1 1970927487 IYXRXFVLXIGDRD-QMMMGPOBSA-N 267.289 -0.104 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@@H](OC)C2)[nH]1 2029086559 OQJWSFBOQQXWBT-KNVOCYPGSA-N 253.262 -0.140 5 10 CBBE CNCc1cn(Cc2nn(C)cc2[N+](=O)[O-])nn1 2041193144 GJURPFZMVOQDKN-UHFFFAOYSA-N 251.250 -0.313 5 10 CBBE NC(=O)C1(CNc2ncccc2[N+](=O)[O-])CNC1 2041268364 GYZRBRLMFLTFSD-UHFFFAOYSA-N 251.246 -0.523 5 10 CBBE C[C@H](CN=c1nc([N+](=O)[O-])[nH]n1C)[C@H](F)C(=O)O 2043580398 ZDCLZHMLXVVYBZ-UHNVWZDZSA-N 261.213 -0.384 5 10 CBBE N[C@H](CO)CNc1nc(C(=O)O)ccc1[N+](=O)[O-] 2043928116 ATFIYFAJWIFUOD-YFKPBYRVSA-N 256.218 -0.581 5 10 CBBE CN(c1cc(N)c([N+](=O)[O-])cn1)C1CS(=O)(=O)C1 2047195976 YRKCGMYPDCJFOC-UHFFFAOYSA-N 272.286 -0.195 5 10 CBBE N=c1[nH]c(O[C@@H]2CNCC2(F)F)ncc1[N+](=O)[O-] 2064780044 AMDMLZIBJFHTBZ-RXMQYKEDSA-N 261.188 -0.217 5 10 CBBE N=c1[nH]c(N[C@H]2CCNC(=O)C2)ncc1[N+](=O)[O-] 2066265192 IJSZGOJZDSWZMQ-YFKPBYRVSA-N 252.234 -0.512 5 10 CBBE NNc1ncc(C(=O)N2CC([N+](=O)[O-])C2)cc1F 2071564620 AUYKFAVMOAPDII-UHFFFAOYSA-N 255.209 -0.393 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2C=CCN2)n1 2078291772 NTWRTIQYJMWWCR-SSDOTTSWSA-N 251.246 -0.414 5 10 CBBE N[C@H]1COC[C@@H]1C(=O)Nc1ncccc1[N+](=O)[O-] 2082425074 PJCWXOOLJIGWDO-BQBZGAKWSA-N 252.230 -0.098 5 10 CBBE O=C(Cn1cc(Cl)cc([N+](=O)[O-])c1=O)NCCO 2085310575 LDESRWYHBMKNSN-UHFFFAOYSA-N 275.648 -0.482 5 10 CBBE COC[C@@H](N=c1[nH]n(C)c(C)c1[N+](=O)[O-])C(=O)O 2086321911 YTKXOLBHDPNODV-ZCFIWIBFSA-N 258.234 -0.430 5 10 CBBE CN=c1nc(N2CC(N(C)OC)C2)c([N+](=O)[O-])c[nH]1 2088383530 QXGCBRNFDPFXMP-UHFFFAOYSA-N 268.277 -0.470 5 10 CBBE NNc1ccc([N+](=O)[O-])c(CN2C[C@@H](O)[C@H](O)C2)c1 2093985654 VMCQZUIFMXNCKI-GHMZBOCLSA-N 268.273 -0.582 5 10 CBBE Cc1[nH]c(=N)nc(N2C[C@@H]3C[C@H](O)[C@H]3C2)c1[N+](=O)[O-] 2095044116 XLHOMVLUKVFYIY-FXQIFTODSA-N 265.273 -0.077 5 10 CBBE Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H](N)C1 2095858825 BPPDJRZSJBWREX-QMMMGPOBSA-N 268.273 -0.267 5 10 CBBE CC(C)C[C@H](O)Cn1c(=O)c([N+](=O)[O-])cn(C)c1=O 2098243629 UJWOJMWQLSHTDG-QMMMGPOBSA-N 271.273 -0.138 5 10 CBBE COc1nc(N[C@@H]2CN(C)C[C@@H]2O)ncc1[N+](=O)[O-] 2101474885 ZCORUAHMANLLAJ-SVRRBLITSA-N 269.261 -0.520 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@H]3CNC[C@@H]32)[nH]1 2117395940 UHLRLYNWAZKWPB-BIIVOSGPSA-N 264.289 -0.710 5 10 CBBE Nc1ccnc(N2CC[C@H](CO)[C@@H](N)C2)c1[N+](=O)[O-] 2122329797 COZKSCGYMAOVAG-APPZFPTMSA-N 267.289 -0.282 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@H]1CO[C@@]2(CCOC2)C1 2122443292 KHDIZLHOAGLIOO-XCBNKYQSSA-N 269.261 -0.495 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)NCC[C@@H](O)CO)cn1 2125813158 SYLQDAKHZWBLGG-SSDOTTSWSA-N 291.285 -0.989 5 10 CBBE CN1CCNC[C@H]1COc1ncc([N+](=O)[O-])c(=N)[nH]1 2128252827 LJKCKALZLWCGMF-ZETCQYMHSA-N 268.277 -0.920 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC1(CO)COC1 2132741673 SIRYTWYRVVPNOV-UHFFFAOYSA-N 270.245 -0.941 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCO[C@]23CCOC3)[nH]1 2144689711 MJAFFGLGNCDCNX-KCJUWKMLSA-N 281.272 -0.421 5 10 CBBE NC[C@]1(O)CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 2157526352 VVRWGCKVXRVHSC-LLVKDONJSA-N 283.288 -0.897 5 10 CBBE CNC(=O)C1(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 2159817470 ZBPICMVUXVIXOC-SECBINFHSA-N 283.288 -0.980 5 10 CBBE CNc1ncnc(N2C[C@H]3C[C@H]2[C@@H](O)[C@@H]3O)c1[N+](=O)[O-] 2160689190 IDGKFLGJFSLKCX-HSLWUYEYSA-N 281.272 -0.643 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@@H]1C[C@@H]2OCC[C@@H]2N1 2162368933 GMUPBOAREFONMR-ZKWXMUAHSA-N 283.263 -0.123 5 10 CBBE COC(=O)[C@H]1C[C@H](OCc2nn(C)cc2[N+](=O)[O-])CN1 2167172368 FPZRNIQKUANHEM-JGVFFNPUSA-N 284.272 -0.252 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@H](CCO)OC)[nH]1 2168517245 DLLVYJHRMBRXPM-QMMMGPOBSA-N 285.304 -0.612 5 10 CBBE CN=c1[nH]c(N2CCC[C@](O)(CN)C2)ncc1[N+](=O)[O-] 2173822971 WMVAHHRKQGIDEP-NSHDSACASA-N 282.304 -0.862 5 10 CBBE COCC1(Oc2ncc([N+](=O)[O-])c(N(C)C)n2)CNC1 2176311191 NARCRZXJYXLLJV-UHFFFAOYSA-N 283.288 -0.182 5 10 CBBE COC(=O)[C@@H]1C[C@H](Oc2nc(F)ncc2[N+](=O)[O-])CN1 2184613602 ZNSWSGZJEKDLRG-WDSKDSINSA-N 286.219 -0.194 5 10 CBBE C[C@H](C[C@@H]1COCCN1)Oc1ncc([N+](=O)[O-])c(=N)[nH]1 2185358971 VNZMPJQETGPPDM-HTQZYQBOSA-N 283.288 -0.057 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H](O)[C@@H](O)C1 2188680491 MDXHIYUQEMYJOZ-BDAKNGLRSA-N 282.256 -0.979 5 10 CBBE C[C@@H](C[C@H](C)C(=O)NC(=O)N1CC([N+](=O)[O-])C1)C(=O)O 2191503849 ZGUDHMXTCIGKNX-BQBZGAKWSA-N 287.272 -0.070 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC[C@@H](O)C[C@H]2CO)n1 2200829225 USKRMNXRLBKEMJ-JGVFFNPUSA-N 283.288 -0.403 5 10 CBBE Cc1cc(N2C[C@H](O)[C@@H](O)[C@@H]2C(=O)O)c([N+](=O)[O-])cn1 2200843985 PZBDOXGQOLUNCZ-IVZWLZJFSA-N 283.240 -0.707 5 10 CBBE CO[C@@H]1CNCC[C@@H]1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2202429300 HSNWASMEBYSSDX-GZMMTYOYSA-N 280.284 -0.025 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)[C@@H]2CF)c1 2206788373 VKWUQFCASZPTDY-GARJFASQSA-N 286.263 -0.240 5 10 CBBE Cc1c([N+](=O)[O-])c(N2CCOC[C@@H]2[C@@H](O)CO)nn1C 2207476416 PMEUOCUWOLLMDZ-BDAKNGLRSA-N 286.288 -0.805 5 10 CBBE N[C@H]1C[C@@H](CN=c2[nH]cncc2[N+](=O)[O-])[C@H](O)C1 2219824408 OLSPJRHESLCKAK-ACLDMZEESA-N 253.262 -0.683 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC2([C@@H](O)CO)CC2)[nH]1 2223032363 DIVRMPATFOUCFL-QMMMGPOBSA-N 256.262 -0.469 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)CCCON)n1 2223853797 OZFQYUYGZIYTKG-UHFFFAOYSA-N 257.250 -0.385 5 10 CBBE O=[N+]([O-])c1cc(F)cc(NC[C@@H]2NC[C@@H](O)[C@H]2O)c1 2225624467 VHINIHMCABEBTH-AXFHLTTASA-N 271.248 -0.161 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@@H]1C[C@H]2OCC[C@@H]2N1 2227002116 MGKGGTBDZKNBPD-OYNCUSHFSA-N 265.273 -0.262 5 10 CBBE CC(C)n1ncc([N+](=O)[O-])c1NCCNS(N)(=O)=O 2231922113 YIJIUHFILIUUCX-UHFFFAOYSA-N 292.321 -0.423 5 10 CBBE O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2CN[C@H](CO)[C@@H]2C1 2235556535 LIEUADSDVNNVPQ-DJLDLDEBSA-N 281.268 -0.160 5 10 CBBE COC1(C(N)=O)CN(Cc2cccc(N)c2[N+](=O)[O-])C1 2236862148 BPTDVHDXYSDONC-UHFFFAOYSA-N 280.284 -0.137 5 10 CBBE C[C@H](CN=c1[nH]cnc(N)c1[N+](=O)[O-])[C@]1(O)CCNC1 2238412022 MBAXMNXAELOFAF-HQJQHLMTSA-N 282.304 -0.839 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@]23CC[C@H]2CNC3)n1 2240634303 ONNNSBOGVDDAAQ-UFBFGSQYSA-N 279.300 -0.056 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN[C@@H]2C[C@H]3NCCO[C@@H]3C2)n1 2240634979 YMOUBRUCAOJJGC-KBVBSXBZSA-N 281.316 -0.063 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2CCOC[C@@H](N)C2)n1 2258628410 RXKBXBAJZXXUPG-QMMMGPOBSA-N 253.262 -0.143 5 10 CBBE CCCc1ncc([N+](=O)[O-])c(=N[C@H]2COC[C@H]2N)[nH]1 2271111077 HZISCMOXIQEGBH-SFYZADRCSA-N 267.289 -0.103 5 10 CBBE N=c1[nH]c(N2CC(F)(F)C[C@@H]2CN)ncc1[N+](=O)[O-] 2278907890 UZJSIJZTUBXFIB-RXMQYKEDSA-N 274.231 -0.030 5 10 CBBE COCc1ncc([N+](=O)[O-])c(N(C)[C@H]2COC[C@H]2O)n1 2286651815 HSKIURQHWHBRRY-DTWKUNHWSA-N 284.272 -0.273 5 10 CBBE CCc1ncc([N+](=O)[O-])c(N2C[C@H](CO)[C@@H](CO)C2)n1 2286668522 GQTDALDJBCBRID-RKDXNWHRSA-N 282.300 -0.016 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@H]3CNC[C@@H]2C3)nc1[N+](=O)[O-] 2321758334 CHAAWQGEOKXIQG-BIIVOSGPSA-N 252.278 -0.445 5 10 CBBE Cn1cc([N+](=O)[O-])c(OC[C@H]2CO[C@@H]3CNC[C@@H]32)n1 2330883561 KXQSIYKPGMHARJ-NQMVMOMDSA-N 268.273 -0.059 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNCC[C@H]2CNCCO2)n1 2344577270 XKFLKWYTKDRSFG-VIFPVBQESA-N 269.305 -0.204 5 10 CBBE Cn1nc(N2CCO[C@H]3CCNC[C@H]32)nc1[N+](=O)[O-] 2345009612 FPQUODPQQJSGKT-SFYZADRCSA-N 268.277 -0.710 5 10 CBBE C[C@@H](NC(=O)[C@@H](N)CC(N)=O)c1cccc([N+](=O)[O-])c1 37766573 HNFAMWLENGGYGE-XCBNKYQSSA-N 280.284 -0.025 5 10 CBBE NC(=S)NNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 87465897 AVMXHENIXMIJRO-UHFFFAOYSA-N 290.326 -0.238 5 10 CBBE C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])nc2)CCN1 88059504 RUCQFMANVUEMLE-MRVPVSSYSA-N 286.313 -0.028 5 10 CBBE O=C1C(=O)N(Cc2nnn[nH]2)c2ccc([N+](=O)[O-])cc21 95179922 AGNOIDSBTQFGNK-UHFFFAOYSA-N 274.196 -0.163 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CCNC(=O)CC2)n1 123622672 TVANJUCUZCCQCN-UHFFFAOYSA-N 266.261 -0.398 5 10 CBBE NNc1cc(C(=O)NN2CCOCC2)c([N+](=O)[O-])cc1F 150291960 KKJOLDCFWZXJEY-UHFFFAOYSA-N 299.262 -0.004 5 10 CBBE C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])cnc1O 167647063 WBBBKUMMYHQZAA-VXNVDRBHSA-N 297.267 -0.083 5 10 CBBE CC(C)[C@H](Nc1ncnc(NN)c1[N+](=O)[O-])C(N)=O 231064492 CKIVEWNZGJVIET-YFKPBYRVSA-N 269.265 -0.408 5 10 CBBE CNC(=O)[C@@H]1COCCN1c1cc([N+](=O)[O-])cc(N)n1 234380967 HOWWTRXQRMOZMD-QMMMGPOBSA-N 281.272 -0.477 5 10 CBBE COC(=O)[C@H](CF)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 288002021 BOFRIOJQIXOITL-LURJTMIESA-N 287.203 -0.064 5 10 CBBE N[C@@H]1C[C@H]1NS(=O)(=O)c1cncc([N+](=O)[O-])c1 310251056 DOYDJGZFISBFMX-HTQZYQBOSA-N 258.259 -0.632 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1CCNC[C@@H](O)C1 311402672 HTQYFYUHUUBRIS-SECBINFHSA-N 269.305 -0.110 5 10 CBBE CN1C(=O)C[C@H](Nc2nccc(N)c2[N+](=O)[O-])C1=O 311641761 BMTDMTMSBTZLNX-LURJTMIESA-N 265.229 -0.259 5 10 CBBE C[C@@](O)(CO)CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 338623622 FFRZLLNLFMXVEZ-LBPRGKRZSA-N 298.251 -0.203 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1N1CC(O)(CO)C1 583451542 YAGGJZLGALZAGZ-UHFFFAOYSA-N 256.262 -0.337 5 10 CBBE O=C(O)CN1CC[C@@H](n2nccc2[N+](=O)[O-])C1=O 596011061 CWTXULAMXXHCDE-ZCFIWIBFSA-N 254.202 -0.351 5 10 CBBE NC(=O)c1cc([N+](=O)[O-])cnc1NCCN1CC[C@H](O)C1 599199636 NYZVMFKMLQGRHE-VIFPVBQESA-N 295.299 -0.433 5 10 CBBE Cn1c(O)nnc1CNc1nc(F)ncc1[N+](=O)[O-] 689025073 DTDZAGUOQSKWKO-UHFFFAOYSA-N 269.196 -0.030 5 10 CBBE O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CNC[C@@H]1O 699895028 PIFJTNHLPOOULD-APPZFPTMSA-N 287.297 -0.794 5 10 CBBE CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)O 702135323 MIEWVDCVPDMKED-ZETCQYMHSA-N 284.272 -0.322 5 10 CBBE Nc1nc(NC[C@H]2CNC[C@H]2O)ccc1[N+](=O)[O-] 702799378 XXHSSLGBPFDVBN-HTRCEHHLSA-N 253.262 -0.436 5 10 CBBE Cc1nc(NN)nc(N[C@H](C)[C@@H](O)CO)c1[N+](=O)[O-] 705102415 VUWXHMBPRXJRDF-XINAWCOVSA-N 272.265 -0.868 5 10 CBBE O=C(N[C@@H]1COCC[C@@H]1O)c1ccc([N+](=O)[O-])[nH]1 710867866 URUQAZKLVRBXMZ-SFYZADRCSA-N 255.230 -0.198 5 10 CBBE O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@H]2C[C@@]2(CO)C1 803154849 CWSLXJPILHMUQQ-LDWIPMOCSA-N 252.230 -0.228 5 10 CBBE CCN(OC)C(=O)CNC(=O)c1nn(CC)cc1[N+](=O)[O-] 844063566 NHRYXFIPKLGDMO-UHFFFAOYSA-N 299.287 -0.049 5 10 CBBE COC(=O)Cn1cc(CCn2ncc([N+](=O)[O-])n2)nn1 863374066 JSRMIESAWOECSD-UHFFFAOYSA-N 281.232 -0.807 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H]3NCC[C@H]32)c1 923417076 ULYSHYMGTJWNCN-JHJVBQTASA-N 295.343 -0.022 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](NC(N)=O)C1 1116404198 DLCUTQYOZXLXDN-ZCFIWIBFSA-N 254.250 -0.425 5 10 CBBE CNC(=O)C(C)(C)CNC(=O)Cn1c([N+](=O)[O-])cnc1C 1127366661 DKFWHHBYSFQNNI-UHFFFAOYSA-N 297.315 -0.012 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](CO)[C@@H](O)C1 1161335040 BZVVCGQMEZFBRO-CPCISQLKSA-N 282.252 -0.274 5 10 CBBE CN1C[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)CCC1=O 1323235432 ZQMKGZZHHKHESA-SSDOTTSWSA-N 281.272 -0.321 5 10 CBBE CNC(=O)C(C)(C)CNC(=O)c1nn(C)cc1[N+](=O)[O-] 1323577750 JMAJEEBRKMKURU-UHFFFAOYSA-N 283.288 -0.170 5 10 CBBE C[C@]1(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CCNC1=O 1456277330 MCNDWELOZBOVBX-NSHDSACASA-N 280.240 -0.296 5 10 CBBE CN(C(=O)CC(C)(C)O)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1536346831 ZGIRHVANXIQSGX-NXEZZACHSA-N 299.327 -0.518 5 10 CBBE CC[C@@H](NC(=O)Cn1c([N+](=O)[O-])cnc1C)C(=O)NC 1536410049 NURAXHHZZUDYPA-MRVPVSSYSA-N 283.288 -0.259 5 10 CBBE O=C(NC/C=C\CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cnco1 1583312017 ZRVWIVRXMBGDPI-WDESOFOKSA-N 294.267 -0.258 5 10 CBBE CC1=NNC(=O)[C@@H]1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1632758790 SSJDTNYNARUCNV-BWZBUEFSSA-N 254.246 -0.720 5 10 CBBE O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)Nc1cnn[nH]1 1633259566 YHBCXWNNNBBFOU-UHFFFAOYSA-N 264.201 -0.487 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1CC[C@@H](NS(C)(=O)=O)C1 1650744611 HTORZJGLVXBFEA-SSDOTTSWSA-N 289.317 -0.544 5 10 CBBE C[C@]1(CO)C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 1659502001 FQSUDTGJDVWVKB-MWLCHTKSSA-N 270.289 -0.391 5 10 CBBE CCCOCC(=O)NCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1757932151 OQHMOJLWQPELPX-RKDXNWHRSA-N 273.289 -0.689 5 10 CBBE CO[C@]1(C(=O)O)CCN(C(=O)N2CC([N+](=O)[O-])C2)C1 1876137794 XDIKNGNQRMXEQJ-SNVBAGLBSA-N 273.245 -0.757 5 10 CBBE C[C@@H](COCC(=O)O)NCc1nn(C)cc1[N+](=O)[O-] 1878844848 ZUCTYIKKEMMCJR-ZETCQYMHSA-N 272.261 -0.092 5 10 CBBE C[C@]1(C(=O)O)CCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1912414816 JDHWRPFFDALMIQ-SNVBAGLBSA-N 268.229 -0.133 5 10 CBBE CN=c1nc(N2CC(=O)N(C)[C@H](C)C2)c([N+](=O)[O-])c[nH]1 1926004127 HXPJOBWFJFZMCD-SSDOTTSWSA-N 280.288 -0.485 5 10 CBBE NNc1ncnc(N2CC([N+](=O)[O-])C2)c1Br 1989308343 SHJBMGWWDDHSEJ-UHFFFAOYSA-N 289.093 -0.010 5 10 CBBE C[C@@H]1CC[C@@](C(=O)O)(n2cnc([N+](=O)[O-])n2)CN1 2028368895 IHIUPGXHBZQQQZ-HZGVNTEJSA-N 255.234 -0.262 5 10 CBBE CN=c1nc(N=c2ncn(C)[nH]2)c([N+](=O)[O-])c[nH]1 2030336483 NHXQYDJFLQOBDF-UHFFFAOYSA-N 250.222 -0.858 5 10 CBBE C[C@H](CS(N)(=O)=O)NC(=O)c1ccc([N+](=O)[O-])o1 2035446750 CUBZRMLXNKFSBV-RXMQYKEDSA-N 277.258 -0.405 5 10 CBBE O=[N+]([O-])c1cnc(F)[nH]c1=NC[C@H]1COC[C@@H]1O 2036575831 GQOQJNWOLONMIM-FSPLSTOPSA-N 258.209 -0.635 5 10 CBBE CN=c1[nH]c(=NCC2CC(O)C2)[nH]cc1[N+](=O)[O-] 2039924428 KBHGFHXUOQIXRL-UHFFFAOYSA-N 253.262 -0.547 5 10 CBBE CN=c1[nH]c(N2C[C@H](C)[C@H](O)C2)ncc1[N+](=O)[O-] 2039930987 FRYYTJGCULRWIY-POYBYMJQSA-N 253.262 -0.335 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=N[C@@H]1CN[C@@H]2CCC[C@H]12 2041254615 FHEYLBWYJDDTGN-XLPZGREQSA-N 252.278 -0.302 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1C[C@@H](O)C[C@@H](O)C1 2043138593 UFUUFBMFCXVCEX-OLQVQODUSA-N 258.209 -0.544 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@@H](CN)C(F)(F)F 2043295061 KFAAEDZGFRXZOV-SCSAIBSYSA-N 268.199 -0.306 5 10 CBBE O=[N+]([O-])c1cnc(Cl)[nH]c1=NC[C@]1(O)CCNC1 2044037393 BFCBJOLZZUDEHV-VIFPVBQESA-N 273.680 -0.404 5 10 CBBE CN(c1cc(N)c([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 2047192101 PGQLURMXKKPLIX-SSDOTTSWSA-N 251.246 -0.103 5 10 CBBE C[C@H]1CO[C@@H](COc2nc([N+](=O)[O-])nn2C)CN1 2048580526 NNIKOHFQSUINKH-NKWVEPMBSA-N 257.250 -0.521 5 10 CBBE CNCCC[C@](C)(C(=O)O)n1cnc([N+](=O)[O-])n1 2049125243 XDPAQCXMDIOSOI-SECBINFHSA-N 257.250 -0.014 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=N[C@H]2C[C@@H](N)C2)[nH]1 2053712038 MDHLJNBXMASGPM-KNVOCYPGSA-N 252.278 -0.520 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N[C@H]2CCOC[C@@H]2N)[nH]1 2053714946 DLHSPHGAECNQDC-BQBZGAKWSA-N 253.262 -0.070 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@@H]2[C@@H](CO)C[C@H]2C1 2053982116 AONAIYOIBXGNMC-RNJXMRFFSA-N 253.262 -0.212 5 10 CBBE CNC[C@@H](CN(C)C)Oc1c([N+](=O)[O-])cnn1C 2056219546 PHQQYXMEALGTPA-QMMMGPOBSA-N 257.294 -0.143 5 10 CBBE O=C(O)[C@]1(n2cnc([N+](=O)[O-])n2)CO[C@H]2C[C@@H]1C2 2063061613 BUMFAWRHAPDNPV-MYINAIGISA-N 254.202 -0.225 5 10 CBBE Cc1[nH]ccc(=NC[C@H](O)CC(=O)O)c1[N+](=O)[O-] 2063414299 IHBKFUVFGCJTFW-SSDOTTSWSA-N 255.230 -0.032 5 10 CBBE CN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H]1CC[C@H]1N 2066472282 SKSUHMHNNNICBI-RNFRBKRXSA-N 253.262 -0.110 5 10 CBBE Cc1c([N+](=O)[O-])c(=N[C@H]2CCOC[C@@H]2N)[nH]n1C 2086321579 DFNCSFNQCDTCOO-YUMQZZPRSA-N 255.278 -0.413 5 10 CBBE Cc1nn(C)c(N2C[C@H](N(C)C)[C@H](O)C2)c1[N+](=O)[O-] 2089918540 IIVHSJARWZBYDN-DTWKUNHWSA-N 269.305 -0.252 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@@H]2CC(=O)NC2=O)[nH]1 2096087194 DRLRPQHCAVZHKK-ZCFIWIBFSA-N 265.229 -0.720 5 10 CBBE CN(c1ccc([N+](=O)[O-])c(N)n1)[C@H]1CC(=O)NC1=O 2114736604 BYGHPOOCAWNCHP-LURJTMIESA-N 265.229 -0.577 5 10 CBBE Nc1cc(N[C@@H]2CCNC[C@@H]2CO)ncc1[N+](=O)[O-] 2117172615 AVRPTVLKYOLCAV-VXNVDRBHSA-N 267.289 -0.046 5 10 CBBE Cc1[nH]c(=N)[nH]c(=N[C@@H]2C[C@H]3NCC[C@H]23)c1[N+](=O)[O-] 2117386497 BVNQZEOTAMLRGT-XLPZGREQSA-N 264.289 -0.310 5 10 CBBE COCC(O)(CNc1ncc([N+](=O)[O-])cn1)COC 2119289127 QKDXKVBDQACEMZ-UHFFFAOYSA-N 272.261 -0.179 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CC(C[C@H](F)C(=O)O)C1 2121974224 AIIIAWNWGSVJKV-LURJTMIESA-N 273.224 -0.028 5 10 CBBE N[C@H]1CS(=O)(=O)C[C@@H]1Oc1cc([N+](=O)[O-])cc(F)n1 2128224982 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WMIYLOHBYSLWRJ-NSHDSACASA-N 269.305 -0.073 5 10 CBBE Nc1ccc(S(=O)(=O)N2CC[C@@H]2CO)c([N+](=O)[O-])c1 2092547873 FRHCOGCNZHGAHI-MRVPVSSYSA-N 287.297 -0.068 5 10 CBBE O=C1NOC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2092564173 HEFOCBIZNMIMKV-LURJTMIESA-N 287.253 -0.697 5 10 CBBE NCC1(O)CN(C(=O)c2ccc([N+](=O)[O-])c(F)c2)C1 2098505567 YTVYFTZCABQTKC-UHFFFAOYSA-N 269.232 -0.121 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1CCOC[C@@H](C(=O)O)C1 2102942448 XCUBDDYHWMAAJQ-LURJTMIESA-N 271.233 -0.739 5 10 CBBE Cn1nc([N+](=O)[O-])nc1O[C@@H]1CCCOC12CNC2 2103400903 OPCBAUURIACTMN-SSDOTTSWSA-N 269.261 -0.377 5 10 CBBE CCN=c1ccc([N+](=O)[O-])c(N2CC(O)(CO)C2)[nH]1 2115309034 JSFVQGWBDMXEHV-UHFFFAOYSA-N 268.273 -0.613 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N[C@H]2CCNC[C@@H]2CO)[nH]1 2117126346 YNYLZHHMJNDFGG-APPZFPTMSA-N 267.289 -0.215 5 10 CBBE COC[C@H]1CNCCN1c1[nH]c(=N)ccc1[N+](=O)[O-] 2117171462 VIBJGKARVSVYGN-MRVPVSSYSA-N 267.289 -0.173 5 10 CBBE CN=c1cc([N+](=O)[O-])cc(N[C@@H]2CCOC[C@@H]2N)[nH]1 2117392716 PGRKHWGZGUZJHT-DTWKUNHWSA-N 267.289 -0.019 5 10 CBBE C[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H](O)CO 2118154221 GAFQZTZOQMHMQI-QUBYGPBYSA-N 270.241 -0.228 5 10 CBBE Cc1nccc(N2CC[C@@](O)(C(N)=O)C2)c1[N+](=O)[O-] 2126962600 HCECDNZDPOIUCE-NSHDSACASA-N 266.257 -0.275 5 10 CBBE N=c1nc(N2C[C@@H](N)CC(F)(F)C2)c([N+](=O)[O-])c[nH]1 2127790176 XLBWLQZWRKNUHX-YFKPBYRVSA-N 274.231 -0.030 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@@H]3CCCN[C@H]32)n1 2129971553 IBFGBCIRWHCTNJ-FTLITQJKSA-N 265.273 -0.192 5 10 CBBE Cc1nc(CNS(=O)(=O)c2cncc([N+](=O)[O-])c2)n[nH]1 2143765232 ISYFEUZLRGSDBM-UHFFFAOYSA-N 298.284 -0.105 5 10 CBBE CN=c1nc(N2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])c(C)[nH]1 2146321558 RKRJKCOSKKNASZ-PELKAZGASA-N 279.300 -0.025 5 10 CBBE CN=c1nc(N2CC[C@H](C)[C@H]2C(N)=O)c([N+](=O)[O-])c[nH]1 2146456363 GOCYTKAGEPKCEG-XPUUQOCRSA-N 280.288 -0.452 5 10 CBBE CN1C[C@H](O)[C@@H](Nc2nc(C(=O)O)ccc2[N+](=O)[O-])C1 2146526951 YMYMACLWYPNBIO-CBAPKCEASA-N 282.256 -0.225 5 10 CBBE N=c1nc(N2[C@H](CO)C[C@H]3OCC[C@H]32)c([N+](=O)[O-])c[nH]1 2146702265 IUNFJALHATWISV-LKEWCRSYSA-N 281.272 -0.474 5 10 CBBE COc1ncnc(N(C[C@@H](C)O)C[C@@H](C)O)c1[N+](=O)[O-] 2159720980 YSGVOXYKNMEIDX-HTQZYQBOSA-N 286.288 -0.039 5 10 CBBE C[C@H](N=c1[nH]c(NN)ncc1[N+](=O)[O-])[C@@H]1COCCO1 2159993553 IAZCFAHVTCQXDK-XPUUQOCRSA-N 284.276 -0.692 5 10 CBBE O=C(O)C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H]1O 2174351594 MJBBHORWUCEPAW-XPUUQOCRSA-N 283.240 -0.170 5 10 CBBE CC(C)c1nn(C)c(OC2(C(N)=O)CNC2)c1[N+](=O)[O-] 2176412606 CUFCXGPUHHWSTG-UHFFFAOYSA-N 283.288 -0.342 5 10 CBBE C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H](O)C(=O)O 2176871994 XOQJQZYJJUHJFE-MHTLYPKNSA-N 285.212 -0.741 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1CC(O)(C2CCNCC2)C1 2176939284 RTAVWGDTZUREHL-UHFFFAOYSA-N 281.316 -0.121 5 10 CBBE CN=c1nc(N2C[C@H](N)[C@H](OC)C2)c([N+](=O)[O-])c(C)[nH]1 2179206657 NDWWCIRVPGIDDZ-JGVFFNPUSA-N 282.304 -0.681 5 10 CBBE Cn1[nH]c(=NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1F 2182799456 HHESZOGGTJAZPB-MRVPVSSYSA-N 284.251 -0.441 5 10 CBBE O=C(O)[C@@H]1[C@H](O)[C@H](O)CCN1Cc1ccc([N+](=O)[O-])o1 2184016039 MFQQYAPIAQILII-FKTZTGRPSA-N 286.240 -0.432 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@]1(O)CCCNC1 2201307065 WRHQAXQVVWDFGT-NSHDSACASA-N 283.288 -0.827 5 10 CBBE O=C(O)[C@H]1CCO[C@@H]1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2202428854 CELYXBCYWCNNSH-RCOVLWMOSA-N 281.224 -0.160 5 10 CBBE N[C@@H](Cc1ncns1)C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2202432453 QDIRIRRPSJZTEH-LURJTMIESA-N 294.296 -0.228 5 10 CBBE Cn1cc([C@@H](N)C(=O)Nc2cc([N+](=O)[O-])ccn2)nn1 2202442882 MKIHPTGQXQAAOO-SECBINFHSA-N 277.244 -0.243 5 10 CBBE CCn1cc([N+](=O)[O-])c(=NC[C@@H]2CNC[C@H]2O)[nH]1 2223048256 KPTNLVGVBUWZDU-IONNQARKSA-N 255.278 -0.775 5 10 CBBE CCn1ncc([N+](=O)[O-])c1NC1CN(CC(=O)O)C1 2231843057 RZQZIQQQRMAKPT-UHFFFAOYSA-N 269.261 -0.008 5 10 CBBE COC[C@@H]1[C@@H](O)[C@H](O)CN1c1cc([N+](=O)[O-])c(C)cn1 2233863795 VLXGTXDTUQCFAE-CKYFFXLPSA-N 283.284 -0.145 5 10 CBBE C[C@H]1CN(CCN=c2ccc(N)c([N+](=O)[O-])[nH]2)C(=O)N1 2239199368 ABJVEKPCAJOLLA-ZETCQYMHSA-N 280.288 -0.181 5 10 CBBE N=c1[nH]c(N2C[C@@H]3C[C@]3(CN)C2)ncc1[N+](=O)[O-] 2259924276 USNCQFDRUUKLJM-WKEGUHRASA-N 250.262 -0.418 5 10 CBBE CN=c1[nH]c(O[C@]23CCNC[C@H]2C3)ncc1[N+](=O)[O-] 2265221510 URGMIZHZOGXZMZ-HQJQHLMTSA-N 265.273 -0.021 5 10 CBBE CN=c1[nH]c(O[C@@]23CCNC[C@H]2C3)ncc1[N+](=O)[O-] 2265221511 URGMIZHZOGXZMZ-RDDDGLTNSA-N 265.273 -0.021 5 10 CBBE NC(CO)(CO)CNc1c([N+](=O)[O-])ccc(F)c1F 2270667046 BZUILRSFFIUKSC-UHFFFAOYSA-N 277.227 -0.033 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@@H]2CCOC[C@H]2N)[nH]1 2271109349 KYNALZNWXQZAEP-HTQZYQBOSA-N 267.289 -0.103 5 10 CBBE CO[C@@H]1CCN(CCN=c2[nH]c(=N)[nH]cc2[N+](=O)[O-])C1 2283079712 ANGIUVVTXOLZFU-MRVPVSSYSA-N 282.304 -0.648 5 10 CBBE O=[N+]([O-])c1cc(CF)ccc1N1C[C@H](O)[C@H](O)[C@@H]1CO 2283579894 UKRHWLAVHJQLBG-SDDRHHMPSA-N 286.259 -0.033 5 10 CBBE NC(CO)(CO)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 2286189395 WXWXBSFOOSFMEO-UHFFFAOYSA-N 287.247 -0.854 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2CC[C@@H](C(=O)O)[C@@H](O)C2)n1 2295560216 PNJVVHWPYUMMJO-XCBNKYQSSA-N 284.272 -0.404 5 10 CBBE O=C(N[C@]1(C(=O)O)C[C@H](O)C1)c1ccc([N+](=O)[O-])cn1 2295658884 NEGQZJDQMYKKEK-DGFRNANFSA-N 281.224 -0.302 5 10 CBBE O=C(CCNCCO)Nc1cc([N+](=O)[O-])ccn1 2319816454 SYAFUUMUGZZAIP-UHFFFAOYSA-N 254.246 -0.100 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@]1(O)CCCSC1 2320540080 AMGARRJSAVAVQL-SECBINFHSA-N 273.318 -0.185 5 10 CBBE O=C(O)[C@]1(N2CC([N+](=O)[O-])C2)CN[C@H]2CCC[C@H]21 2323716615 HOGOBUCWGBGDII-YWVKMMECSA-N 255.274 -0.457 5 10 CBBE COCC[C@@](COC)(C(=O)O)N1CC([N+](=O)[O-])C1 2323717569 PAWNSNGEWYFESS-SNVBAGLBSA-N 262.262 -0.546 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N[C@H](CS(C)(=O)=O)C(=O)O 2335463205 YMMNGRZPPKXNFP-RXMQYKEDSA-N 292.273 -0.762 5 10 CBBE O=C(O)C(CO)(CO)Nc1cccc(F)c1[N+](=O)[O-] 2344088654 HAHUDCZQSXWMCB-UHFFFAOYSA-N 274.204 -0.046 5 10 CBBE Cn1nc(-n2cnc3c(N)ncnc32)nc1[N+](=O)[O-] 2344957384 IXTPDHWHHXHDPJ-UHFFFAOYSA-N 261.205 -0.566 5 10 CBBE Cn1[nH]c(=N[C@@H]2C[C@H](C(=O)O)[C@@H]3C[C@H]23)nc1[N+](=O)[O-] 2345005541 ZZBFPCOKIILCMY-JRTVQGFMSA-N 267.245 -0.334 5 10 CBBE C[C@@H](NC(=O)c1cc(N)c(F)cc1[N+](=O)[O-])C(N)=O 50703095 MEOVSRKNMIZFBJ-SCSAIBSYSA-N 270.220 -0.080 5 10 CBBE NNc1ccc([N+](=O)[O-])c(C(=O)NCC(N)=O)c1 51095848 KLYKIIYBXPKCSX-UHFFFAOYSA-N 253.218 -0.905 5 10 CBBE O=C1COc2ccc([N+](=O)[O-])nc2N1C[C@@H](O)CO 96552406 LPQOKNUZJYGEAV-ZCFIWIBFSA-N 269.213 -0.932 5 10 CBBE CC1(C)C(=O)NC(=O)CN1CC(=O)c1cc([N+](=O)[O-])c[nH]1 97315923 BDXNMOMQZLBHOM-UHFFFAOYSA-N 294.267 -0.157 5 10 CBBE C[C@](O)(CO)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 134758029 JPBODPDVMUNRBI-NWDGAFQWSA-N 270.285 -0.039 5 10 CBBE O=C(Nc1c(O)cccc1[N+](=O)[O-])[C@@H]1C[C@@H](O)CN1 232400218 SCQPRRYPKHKCOT-RQJHMYQMSA-N 267.241 -0.038 5 10 CBBE C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])nc2)C[C@@H]1N 235674685 KRWYWPBQPLPYGX-CBAPKCEASA-N 286.313 -0.043 5 10 CBBE Cc1nc([N+](=O)[O-])c(NCC(=O)NCC(=O)O)n1C 235827367 BCDHWBZXMIMJML-UHFFFAOYSA-N 271.233 -0.751 5 10 CBBE Cc1nc(N)nc(NC(C)(CO)CO)c1[N+](=O)[O-] 235832498 ZQLHWFXIVKOUQW-UHFFFAOYSA-N 257.250 -0.569 5 10 CBBE NC(=O)[C@@]1(O)CCN(c2c([N+](=O)[O-])ccc3c2CCN3)C1 278667784 FVHLSXPIOIBQHB-CYBMUJFWSA-N 292.295 -0.011 5 10 CBBE C[C@H](Nc1cnc([N+](=O)[O-])cc1C(=O)O)C(N)=O 310633778 NJBILQFLVCNCQU-BYPYZUCNSA-N 254.202 -0.026 5 10 CBBE NC(=O)[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])s2)C1 312023927 WXTHRKNOQDIAOP-SNVBAGLBSA-N 285.281 -0.281 5 10 CBBE O=C(O)c1cc(N2CC[C@@](O)(CO)C2)ncc1[N+](=O)[O-] 313679328 NDJXRTCWXIPTQS-NSHDSACASA-N 283.240 -0.379 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CC[C@](O)(CO)C2)n1 313974697 LOZSZWSLQGIFLD-SNVBAGLBSA-N 269.261 -0.791 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CC[C@@H](O)C1 342491133 KAURKPARNHVIFM-HTQZYQBOSA-N 254.246 -0.179 5 10 CBBE NS(=O)(=O)c1ccc(N2CC(CO)C2)cc1[N+](=O)[O-] 589113422 BZFJBIMIQYHCAX-UHFFFAOYSA-N 287.297 -0.329 5 10 CBBE CN(C)CCNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599202731 GGCBFJARCHPOKL-UHFFFAOYSA-N 277.306 -0.832 5 10 CBBE Cc1nn(C)c(N2CCO[C@H]3CNC[C@H]32)c1[N+](=O)[O-] 686534411 UCZUWFFENDULRX-BDAKNGLRSA-N 267.289 -0.186 5 10 CBBE CNC(=O)[C@H]1CNCCN1c1ccnc(O)c1[N+](=O)[O-] 695458019 XEKYPZQGSOPYIG-MRVPVSSYSA-N 281.272 -0.780 5 10 CBBE CN(c1nc(C(=O)O)ccc1[N+](=O)[O-])[C@H]1COC[C@@H]1O 708573663 IJZPTOSHUNFHPF-IUCAKERBSA-N 283.240 -0.116 5 10 CBBE NOCCS(=O)(=O)NCCc1ccc([N+](=O)[O-])cc1 722209973 WGPROIBWAJSRLI-UHFFFAOYSA-N 289.313 -0.053 5 10 CBBE C[C@@H]1OCC[C@@H]1OC(=O)Cn1cnc([N+](=O)[O-])n1 771047947 FVVVUCSBMGJBQB-BQBZGAKWSA-N 256.218 -0.093 5 10 CBBE C[S@@](=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1147484536 OGKRQWSBFUMYHG-QVMDTKBZSA-N 289.357 -0.826 5 10 CBBE CNC(=O)[C@@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 1162411129 NSQWGGWKPAKODC-SSDOTTSWSA-N 281.272 -0.166 5 10 CBBE CN(CCCNCC(=O)N1CCC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1322505750 QFOZZDITAODUFO-GHMZBOCLSA-N 298.343 -0.678 5 10 CBBE Cc1ncc([N+](=O)[O-])n1CC(=O)NCCCn1cncn1 1438149691 VZVMKPDKEBNEML-UHFFFAOYSA-N 293.287 -0.102 5 10 CBBE O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@@H](O)[C@@H](CO)C1 1451608816 CLBULPMFMGFTNG-LDYMZIIASA-N 281.268 -0.195 5 10 CBBE Cn1cc(CN2C[C@H]3C(=O)NC(=O)[C@H]3C2)c([N+](=O)[O-])n1 1460136935 UQOGFZBLSSGIEV-OCAPTIKFSA-N 279.256 -0.967 5 10 CBBE Cc1nc(N2CCOC[C@H]2CC(N)=O)ncc1[N+](=O)[O-] 1472807997 CYCKVSKYXHHASV-MRVPVSSYSA-N 281.272 -0.226 5 10 CBBE CN(C)S(=O)(=O)CCNC(=O)CCC(C)(C)[N+](=O)[O-] 1535087530 AOAGXDLJFNYUFF-UHFFFAOYSA-N 295.361 -0.171 5 10 CBBE CO[C@@H]1CC[C@@H]1N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 1540206278 YEEOKRFVHBZWPY-JGVFFNPUSA-N 269.261 -0.178 5 10 CBBE NC(=O)C1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 1617907161 IHVVOAHGBWNLKY-UHFFFAOYSA-N 294.267 -0.558 5 10 CBBE CCn1[nH]c(C)nc1=NC(=O)c1n[nH]cc1[N+](=O)[O-] 1640430424 ZMRGXMPNUJYOCZ-UHFFFAOYSA-N 265.233 -0.088 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@H]2C[C@H]1C[C@@H]2O 1647754655 JWEPSBHNXFXRQV-MIMYLULJSA-N 293.279 -0.262 5 10 CBBE Cc1[nH]nc(C(=O)O)c1S(=O)(=O)N1CC([N+](=O)[O-])C1 1876174873 UMDAKSKKHYIAMZ-UHFFFAOYSA-N 290.257 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-0.673 5 10 CBBE Cc1cnc(C2(N)CS(=O)(=O)C2)cc1[N+](=O)[O-] 1942248297 KNFNMGCDGPFGIH-UHFFFAOYSA-N 257.271 -0.119 5 10 CBBE Nc1ccc(=NC[C@@H]2CNC(=O)O2)[nH]c1[N+](=O)[O-] 1963539616 OYULUDLDEOUXOB-RXMQYKEDSA-N 253.218 -0.486 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N1CCNCC(F)(F)C1 1967010813 DQGSTXFZUOCQFK-UHFFFAOYSA-N 289.242 -0.142 5 10 CBBE O=C1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CN1 1969063113 JXWLDPDHMGMRIW-SSDOTTSWSA-N 264.241 -0.002 5 10 CBBE O=[N+]([O-])c1cnc(N[C@@H]2C[C@H](O)[C@@H](O)[C@H]2O)s1 2000868880 RHWIUYIMHACMTN-LPWJYYESSA-N 261.259 -0.682 5 10 CBBE CNC1CC(CS(=O)(=O)N2CC([N+](=O)[O-])C2)C1 2016889363 RNNHPGKQEALSLF-UHFFFAOYSA-N 263.319 -0.725 5 10 CBBE C[C@H](Nc1ncnc(F)c1[N+](=O)[O-])C1(O)CNC1 2044044278 KZCWDGCDRQCDNE-YFKPBYRVSA-N 257.225 -0.341 5 10 CBBE Cc1ccc(N2CC(N)(C(N)=O)C2)c([N+](=O)[O-])c1 2047095096 HAQHDONQWTUFPW-UHFFFAOYSA-N 250.258 -0.094 5 10 CBBE N[C@H]1CS(=O)(=O)C[C@@H]1Oc1ncccc1[N+](=O)[O-] 2057795619 JPRGFITZASDCOB-XPUUQOCRSA-N 273.270 -0.507 5 10 CBBE Cc1[nH]ccc(=NC[C@@]2(O)CCNC2)c1[N+](=O)[O-] 2063420638 ZXFYWCAWEJWRNK-LLVKDONJSA-N 252.274 -0.144 5 10 CBBE Cn1cc([N+](=O)[O-])c(=NC2CC(O)(C(=O)O)C2)[nH]1 2064319523 YGOCBVCXLBJJQT-UHFFFAOYSA-N 256.218 -0.860 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC(N)CC1 2066469798 JPHQEBHCWGVGKI-UHFFFAOYSA-N 253.262 -0.108 5 10 CBBE C[C@H](COCC(=O)O)NC(=O)N1CC([N+](=O)[O-])C1 2071558871 SHBJTQAZPFSXMW-ZCFIWIBFSA-N 261.234 -0.853 5 10 CBBE N[C@@H](CCO)C(=O)NCc1cccc([N+](=O)[O-])c1 2073226045 XNOWXRHDKQRFBI-JTQLQIEISA-N 253.258 -0.079 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CC(OCCCO)C2)n1 2085893416 BGGANAUOJRHUEL-UHFFFAOYSA-N 256.262 -0.084 5 10 CBBE Cc1nc([N+](=O)[O-])c(OC[C@@H]2CCS(=O)(=O)N2)n1C 2089996850 UOHDYSIOEFEVNM-ZETCQYMHSA-N 290.301 -0.293 5 10 CBBE COc1nc(N[C@@H](C)CS(N)(=O)=O)ncc1[N+](=O)[O-] 2101464766 CQEIUSYJZUREQX-YFKPBYRVSA-N 291.289 -0.518 5 10 CBBE CN=c1[nH]c(N(C)[C@H]2CCNC2=O)ncc1[N+](=O)[O-] 2101470223 ILQLJLCOGOCHFU-LURJTMIESA-N 266.261 -0.827 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2CCNC3(CC3)C2)[nH]1 2117382161 FIWKFWNXQWJIQR-ZETCQYMHSA-N 264.289 -0.084 5 10 CBBE Cc1ccc([N+](=O)[O-])c(O[C@]2(C(N)=O)CCNC2)n1 2119886304 VLUSLXFTQZTYQV-LLVKDONJSA-N 266.257 -0.106 5 10 CBBE O=[N+]([O-])c1cnc(Cl)[nH]c1=N[C@@H]1CO[C@H]2CNC[C@@H]12 2121658495 VDNAILJMEZCJDR-BBVRLYRLSA-N 285.691 -0.141 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@@H]2[C@H](CO)CO[C@H]2C1 2121669990 NPZSIQHZEIIQDH-PRJMDXOYSA-N 269.261 -0.833 5 10 CBBE Cc1nc([N+](=O)[O-])c(N2CC[C@H](N)[C@@H](CO)C2)n1C 2122373378 CFWXNZCLJBHRHD-BDAKNGLRSA-N 269.305 -0.217 5 10 CBBE C[C@@](N)(CO)CNc1nc(C(=O)O)ccc1[N+](=O)[O-] 2124712077 MCEMBDRDCPCXJJ-JTQLQIEISA-N 270.245 -0.190 5 10 CBBE CCN=c1cc([N+](=O)[O-])cc(N[C@@H]2CNC[C@H]2O)[nH]1 2126809365 FJKRBNBTMBBCRL-RKDXNWHRSA-N 267.289 -0.412 5 10 CBBE O=[N+]([O-])c1cnccc1N1CC2(C1)OC[C@H](O)[C@@H]2O 2127332909 IUONKFPBXVJCLX-UWVGGRQHSA-N 267.241 -0.699 5 10 CBBE NC[C@@H](Oc1c(C(=O)O)cccc1[N+](=O)[O-])C(N)=O 2128177601 IDPMCOJKZULXDA-SSDOTTSWSA-N 269.213 -0.516 5 10 CBBE C[C@@H]1C[C@@]1(NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 2129999484 VZAWBYOOVXELIU-FWOIEVBISA-N 268.229 -0.079 5 10 CBBE Nc1cc(N2CC[C@@H](O)C[C@H]2CO)ncc1[N+](=O)[O-] 2136083854 HDPMWGNOFBAWJZ-JGVFFNPUSA-N 268.273 -0.106 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NCCN2CCOC2=O)c1[N+](=O)[O-] 2146760184 VXWZONRYTLTMKW-UHFFFAOYSA-N 282.260 -0.608 5 10 CBBE COc1cc(OC)n(-c2nc(NN)ncc2[N+](=O)[O-])n1 2149822526 MRCWLJFTRRTLPO-UHFFFAOYSA-N 281.232 -0.127 5 10 CBBE CN(C)c1nc(N[C@H]2CC(=O)NC2=O)ncc1[N+](=O)[O-] 2157671156 GVVKJXYSBJOFFE-YFKPBYRVSA-N 280.244 -0.722 5 10 CBBE NC[C@@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CCO1 2162805995 NJTRIHXMEJGILF-MRVPVSSYSA-N 282.256 -0.148 5 10 CBBE O=C(O)c1cc(N[C@@H]2C[C@H](O)C[C@@H]2O)ncc1[N+](=O)[O-] 2164979106 NNGBZIMBZTWXAP-KWPFTWCOSA-N 283.240 -0.016 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NC[C@@H]2Cc3nncn3C2)[nH]1 2167647080 CFXXPKARYXZXCE-LURJTMIESA-N 276.260 -0.905 5 10 CBBE Nc1cc(N2CC[C@H](C(CO)CO)C2)ncc1[N+](=O)[O-] 2170641142 AIVVIEWZLJQSGX-QMMMGPOBSA-N 282.300 -0.001 5 10 CBBE Cc1[nH]c(=N)nc(N2CCO[C@H]3CNC[C@H]32)c1[N+](=O)[O-] 2173849853 ATGJQVMGWHZAKI-SFYZADRCSA-N 280.288 -0.717 5 10 CBBE O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCNC[C@H](O)C1 2174806498 LXXZZEIQNUNZGH-VIFPVBQESA-N 281.268 -0.293 5 10 CBBE CO[C@H]1C[C@H](CN=c2nc([N+](=O)[O-])[nH]n2C)C[C@H]1OC 2174849189 YOELZHZZKXRLHR-PSVAKVPMSA-N 285.304 -0.003 5 10 CBBE O=C(O)c1cc(N[C@H]2CNCC[C@@H]2O)ncc1[N+](=O)[O-] 2183254826 OMQYWSPXWLYSGJ-CBAPKCEASA-N 282.256 -0.177 5 10 CBBE O=[N+]([O-])c1ccc(N2CCS(=O)(=O)CC23CNC3)cn1 2183498118 VEEOUVOMUNYJBM-UHFFFAOYSA-N 298.324 -0.433 5 10 CBBE Nc1ccnc(OC2CN([C@@H]3CCNC3)C2)c1[N+](=O)[O-] 2184551938 PEIUBQLERQEMMI-MRVPVSSYSA-N 279.300 -0.003 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NC23COC(CN)(C2)C3)n1 2186526392 BZIPFBHBQGMHBP-UHFFFAOYSA-N 281.272 -0.682 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@H]3CC[C@@H](N3)[C@@H]2F)[nH]1 2193295202 KVWXOLATIRLXKM-JAKMQLQISA-N 282.279 -0.138 5 10 CBBE CC1(C)CN[C@@H](CC(=O)N2CC([N+](=O)[O-])C2)CO1 2217956350 XSOBTFJUOUESBE-QMMMGPOBSA-N 257.290 -0.369 5 10 CBBE O=[N+]([O-])c1c[nH]cc(Cl)c1=NC[C@@H]1NC[C@H](O)[C@H]1O 2225621504 DJISIABNLPBRRC-HKPALBBZSA-N 288.691 -0.829 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NC[C@@H]1C[C@@H]2OCC[C@H]2N1 2227002118 MGKGGTBDZKNBPD-XKSSXDPKSA-N 265.273 -0.262 5 10 CBBE O=[N+]([O-])c1cnc[nH]c1=NCCOC1CCNCC1 2227004082 KJAQWZAOOZEUOG-UHFFFAOYSA-N 267.289 -0.013 5 10 CBBE CO[C@H]1[C@@H](COc2nc([N+](=O)[O-])nn2C)NC[C@H]1OC 2233505251 JVSQTHAHMJCSIS-PRJMDXOYSA-N 287.276 -0.896 5 10 CBBE Cn1ncc([N+](=O)[O-])c1N1C[C@H]2C[C@H](O)[C@H](O)C[C@H]2C1 2236992663 YFVIXIOPRAOMJM-YDRMRZIKSA-N 282.300 -0.104 5 10 CBBE NNc1cc(N2CC[C@@H]2[C@H](O)CO)ccc1[N+](=O)[O-] 2270702624 UYJLCECAEPEMNC-GHMZBOCLSA-N 268.273 -0.188 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@H]2COC[C@@H]2CN)[nH]1 2271116597 IFEMEOBVAJKTJW-YUMQZZPRSA-N 267.289 -0.245 5 10 CBBE COCCN(C[C@@H](C)O)c1ncnc(N)c1[N+](=O)[O-] 2272484018 LNUIEZNOOWXSOV-SSDOTTSWSA-N 271.277 -0.199 5 10 CBBE COc1nccc(N2C[C@@H](N)C[C@@H](O)C2)c1[N+](=O)[O-] 2273009901 ITQDOGHNUCSTPI-JGVFFNPUSA-N 268.273 -0.103 5 10 CBBE O=[N+]([O-])c1cnc(C2CC2)[nH]c1=N[C@H]1CNCC[C@H]1O 2286611127 LCHPNHDEEDFVNB-WCBMZHEXSA-N 279.300 -0.181 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H](CCO)COC)[nH]1 2286647890 OOTGJYMLSZXKOE-QMMMGPOBSA-N 286.288 -0.238 5 10 CBBE O=[N+]([O-])c1ccnc(N2C[C@@H]3C[C@H]2[C@@H](O)[C@@H]3O)c1 2308774768 YPCFEWZAWYTYJB-QRPIXLCVSA-N 251.242 -0.080 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2C[C@@H]3CN[C@H]2C3)[nH]1 2309680266 HROORIADKCEXTG-DSYKOEDSSA-N 250.262 -0.618 5 10 CBBE Cn1cc([N+](=O)[O-])c(=NCCCOC2CNC2)[nH]1 2315587101 MSECKMWNIFTBFA-UHFFFAOYSA-N 255.278 -0.459 5 10 CBBE Cn1nc(OCCOC(C)(C)CN)nc1[N+](=O)[O-] 2321741275 LUYAOSJSRGIUKM-UHFFFAOYSA-N 259.266 -0.144 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@H]3C[C@H](O)[C@H](O)[C@@H]2C3)n1 2330384068 ZMABRBWXEHTGBH-GOZTYBTRSA-N 268.273 -0.351 5 10 CBBE CS(=O)(=O)C[C@@H](Nc1cccnc1[N+](=O)[O-])C(=O)O 2335493898 XGFXCQLLNFUSPT-SSDOTTSWSA-N 289.269 -0.101 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]12CC[C@@H](C1)NC2 2343615629 NTEHEWNEKQCADJ-CPCISQLKSA-N 265.273 -0.047 5 10 CBBE CC[C@]1(COc2nc([N+](=O)[O-])n(C)n2)COCCN1 2344960173 KFUCINMJDNMKLH-SNVBAGLBSA-N 271.277 -0.129 5 10 CBBE Cn1nc(OCCN2CCCNCC2)nc1[N+](=O)[O-] 2345007051 VTAUOHJJTSNRLE-UHFFFAOYSA-N 270.293 -0.603 5 10 CBBE COC(=O)[C@@H](CO)NC(=O)c1ccc(F)c([N+](=O)[O-])c1 35162701 GQTZPHLXJQFHHA-MRVPVSSYSA-N 286.215 -0.002 5 10 CBBE O=[N+]([O-])c1cc(S(=O)(=O)NCO)ccc1NCO 85344915 WFKUDMWUGIUDQZ-UHFFFAOYSA-N 277.258 -0.815 5 10 CBBE CN1C(=O)C[C@H](Nc2ncnc(N)c2[N+](=O)[O-])C1=O 128085019 XGOJILWNGAQIRL-BYPYZUCNSA-N 266.217 -0.864 5 10 CBBE CCNc1ncnc(NCC(=O)NC)c1[N+](=O)[O-] 129009155 UGTVVYQJNKGMFY-UHFFFAOYSA-N 254.250 -0.026 5 10 CBBE CC(=O)NC1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 191480225 FISHJFBLHSAIAA-UHFFFAOYSA-N 253.218 -0.722 5 10 CBBE COC(=O)[C@H](CO)Nc1cc(C(N)=O)ccc1[N+](=O)[O-] 212873842 UENFQXLBWWRGOU-QMMMGPOBSA-N 283.240 -0.361 5 10 CBBE CN1C(=O)C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1=O 217315893 YLBRZVHFQYMPLE-MRVPVSSYSA-N 293.235 -0.213 5 10 CBBE CNc1ncc([N+](=O)[O-])c(SC[C@H](O)CO)n1 234577906 ANPJYKGCVYVZJL-RXMQYKEDSA-N 260.275 -0.128 5 10 CBBE CO[C@@H]1CN(c2ncnc(NN)c2[N+](=O)[O-])C[C@H]1OC 234769684 QSGKOEKUVOUUFV-RNFRBKRXSA-N 284.276 -0.480 5 10 CBBE Nc1ccc(N2CC[C@](O)(CO)C2)nc1[N+](=O)[O-] 314453978 UBEYXDKREZKPSR-SNVBAGLBSA-N 254.246 -0.495 5 10 CBBE CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 357777988 FZLMYIPTAMCCHB-SSDOTTSWSA-N 267.245 -0.434 5 10 CBBE Nc1nc(N2C[C@@H]3C[C@H]2C[S@@]3=O)ncc1[N+](=O)[O-] 593508553 HVANTWUJTCLYLJ-TYDGZRNZSA-N 269.286 -0.323 5 10 CBBE NCCCOCCNc1ncc([N+](=O)[O-])cc1C(N)=O 698364246 UOAXHSLCGTUUCO-UHFFFAOYSA-N 283.288 -0.134 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@@H](CO)[C@@H](CO)C2)n1 705342390 CGKMOJAFAJZVLX-OCAPTIKFSA-N 256.262 -0.635 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N[C@@H]2COCC[C@H]2O)n1 710889350 JNBRQMLWRSAREU-HTRCEHHLSA-N 269.261 -0.163 5 10 CBBE 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O=[N+]([O-])c1cccc(S(=O)(=O)NCC[C@@H](O)CO)c1 1963621677 MYPFPLAZCNHWOK-SECBINFHSA-N 290.297 -0.384 5 10 CBBE CN(Cc1nn(C)cc1[N+](=O)[O-])[C@@]1(CN)CCOC1 1964551141 LFLUTTSRNMIZCK-LLVKDONJSA-N 269.305 -0.122 5 10 CBBE O=[N+]([O-])c1cncc(S(=O)(=O)NC2COC2)c1 2000984812 SNCVQZOFRKMFJM-UHFFFAOYSA-N 259.243 -0.333 5 10 CBBE CN1C[C@@H](O)[C@H](N=c2[nH]c(F)ncc2[N+](=O)[O-])C1 2029889730 YZZBDIJBWXVQRM-IYSWYEEDSA-N 257.225 -0.967 5 10 CBBE O=[N+]([O-])c1cnn(C[C@H](O)CNCC2COC2)c1 2036599982 RICDJSUXIDMVQX-SNVBAGLBSA-N 256.262 -0.612 5 10 CBBE CN(C)c1nc(N2CC[C@H](N)C2)ncc1[N+](=O)[O-] 2039924457 KMZKCGWKJUKTAS-ZETCQYMHSA-N 252.278 -0.012 5 10 CBBE COCC[C@@H](COC)N=c1nc([N+](=O)[O-])[nH]n1C 2041242425 DDVDIQISEDOWBJ-ZETCQYMHSA-N 259.266 -0.391 5 10 CBBE O=[N+]([O-])c1cccnc1N[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O 2046522991 QOZWXHZURYPQAO-RSWFSCQZSA-N 255.230 -0.743 5 10 CBBE Nc1cc(N2C[C@@H](O)C[C@H](O)C2)ncc1[N+](=O)[O-] 2047194886 HRFQSBSUNHWTLV-BQBZGAKWSA-N 254.246 -0.496 5 10 CBBE 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267.245 -0.226 5 10 CBBE O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@@H](CO)[C@@H](O)C1 316494535 UPTJRSWEEOFVKE-XVKPBYJWSA-N 282.252 -0.274 5 10 CBBE Nc1cc(C(=O)N2C[C@H](O)[C@@H](CO)C2)ccc1[N+](=O)[O-] 316571352 LBXYUMAMHFZAAO-KCJUWKMLSA-N 281.268 -0.398 5 10 CBBE CNC(=O)[C@@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 343658496 CFQMWGFAYFAHDT-LURJTMIESA-N 267.245 -0.332 5 10 CBBE COC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cn1 548254518 HZAPOLCQJFCECM-LLVKDONJSA-N 283.240 -0.356 5 10 CBBE C[C@@H](O)[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 574291809 IYYHOIBUISRRBM-VXNVDRBHSA-N 296.283 -0.206 5 10 CBBE O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C[C@H](O)C[C@H]2C1 594385121 DCYMHGXXXLJLRB-JGVFFNPUSA-N 281.272 -0.791 5 10 CBBE O=C1NCC[C@H]1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] 594792592 UJALWLBERNKJHE-SECBINFHSA-N 299.308 -0.097 5 10 CBBE Cn1cnc([N+](=O)[O-])c1NC[C@@]1(OCCO)CCOC1 596422579 FPGLQPAHSBKMMM-NSHDSACASA-N 286.288 -0.092 5 10 CBBE C[C@@H](CO)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 688763277 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Nc1cc(N[C@H]2CS(=O)(=O)C[C@@H]2O)ccc1[N+](=O)[O-] 2121385327 PIHPJQHHBKNMPH-WPRPVWTQSA-N 287.297 -0.253 5 10 CBBE O=[N+]([O-])c1cc(F)nc(N[C@@H]2CS(=O)(=O)C[C@@H]2O)c1 2126848601 IGMRHOVKZBRDBC-RQJHMYQMSA-N 291.260 -0.301 5 10 CBBE CN=c1[nH]c(OC[C@H](N)CN(C)C)ncc1[N+](=O)[O-] 2128256157 OIBYJRIUTVQQCH-SSDOTTSWSA-N 270.293 -0.884 5 10 CBBE CC(C)[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])ON 2129975148 GJPOKLYSMOXYDR-QMMMGPOBSA-N 271.277 -0.027 5 10 CBBE CC1(C)OC[C@@H](N)[C@@]1(C(=O)O)n1cnc([N+](=O)[O-])c1 2136999215 LYOVYQOZXDBMEM-LDWIPMOCSA-N 270.245 -0.293 5 10 CBBE Nc1nc[nH]c(=NC[C@@H]2C[C@@H]3NCC[C@H]32)c1[N+](=O)[O-] 2140719407 QXDZUYRMYXKVLP-FXQIFTODSA-N 264.289 -0.201 5 10 CBBE Cc1nc(NN)[nH]c(=N[C@@H]2C[C@H]3COC[C@@H]32)c1[N+](=O)[O-] 2143877655 NIXPZSYDBONWLI-BIIVOSGPSA-N 280.288 -0.152 5 10 CBBE NNc1ccc([N+](=O)[O-])c(NC2CC(NC(N)=O)C2)n1 2152868342 FLMUBEWBYSYOGV-UHFFFAOYSA-N 281.276 -0.113 5 10 CBBE COc1ccc(N[C@@H]2C[C@H](O)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1 2165124721 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CN(C[C@]1(O)CCOC1)C(=O)c1nn(C)cc1[N+](=O)[O-] 2186540329 MRWXBNJEVKBVQJ-LLVKDONJSA-N 284.272 -0.448 5 10 CBBE CN1C[C@@H](N(C)c2nc(=N)[nH]cc2[N+](=O)[O-])CCC1=O 2188473523 JVEOZXQKWSBYBT-ZETCQYMHSA-N 280.288 -0.146 5 10 CBBE O=C(NC1(C(=O)O)CC(CO)C1)c1ccc([N+](=O)[O-])[nH]1 2193924568 JSXWLPTTZYENMC-UHFFFAOYSA-N 283.240 -0.122 5 10 CBBE CN=c1[nH]c(N2CC[C@H](O)[C@@](C)(O)C2)ncc1[N+](=O)[O-] 2201487163 ROXCPVMAMNGUEW-KWQFWETISA-N 283.288 -0.830 5 10 CBBE Cn1nc(CN)cc1C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2202431873 GFODKZKYJZSETH-UHFFFAOYSA-N 276.256 -0.144 5 10 CBBE O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3C[C@H]2[C@H]3CO)cn1 2203020684 KBCMVTUXHSOUOT-JEZHCXPESA-N 299.308 -0.009 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)C(F)(F)CN)n1 2223842770 XLYQERALLXXHSD-UHFFFAOYSA-N 263.204 -0.462 5 10 CBBE N[C@@H]1CC(=O)N(Oc2ncnc(Cl)c2[N+](=O)[O-])C1 2224109364 KJOWKJITOSSNCF-SCSAIBSYSA-N 273.636 -0.108 5 10 CBBE CCn1cc([N+](=O)[O-])c(N2CCNC[C@H]2C(N)=O)n1 2230796141 DFTXTIHVBYUMNN-ZETCQYMHSA-N 268.277 -0.925 5 10 CBBE C[C@H](N)[C@H]1C[C@@H]1C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2231932577 MCQGDAWJZWBHHR-RNJXMRFFSA-N 267.289 -0.072 5 10 CBBE Cc1[nH]c(=N)nc(N(CCN)C[C@@H](C)O)c1[N+](=O)[O-] 2269795067 DIMYNQBESQYSSL-ZCFIWIBFSA-N 270.293 -0.748 5 10 CBBE O=C(O)[C@@]1(n2cc([N+](=O)[O-])cn2)COC2(COC2)C1 2270797597 UDLFVADPJAQVKZ-JTQLQIEISA-N 269.213 -0.240 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=N[C@@H]2C[C@@H](O)C[C@@H]2O)[nH]1 2271094628 DMTQBOXAXQTGQA-BHNWBGBOSA-N 268.273 -0.335 5 10 CBBE NC[C@@H](CO)N=c1[nH]c(C2CCC2)ncc1[N+](=O)[O-] 2271103220 JZTSCVRZTAPVFA-QMMMGPOBSA-N 267.289 -0.194 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@@H]2CN(C)C[C@H]2O)[nH]1 2286651134 YFJNTCLOBFPAJZ-VXNVDRBHSA-N 283.288 -0.960 5 10 CBBE NC[C@]12C[C@@H]1CN(C(=O)CCn1cnc([N+](=O)[O-])c1)C2 2288241526 UVFNCUASLRUSTI-SKDRFNHKSA-N 279.300 -0.011 5 10 CBBE O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)[C@H](O)[C@@H]2O)cn1 2309041156 MLZDVQUKDVXVHI-WDQPUEAGSA-N 255.230 -0.743 5 10 CBBE NC(CO)(CO)C(=O)Nc1ccccc1[N+](=O)[O-] 2320910525 JZSWRXIDZYXEBU-UHFFFAOYSA-N 255.230 -0.785 5 10 CBBE C[C@@H]1C[C@]1(CN=c1nc([N+](=O)[O-])n(C)[nH]1)C(=O)O 2321740736 DPUZSTADXNODNY-MLUIRONXSA-N 255.234 -0.332 5 10 CBBE Cn1[nH]c(=NC2CC(S(C)(=O)=O)C2)nc1[N+](=O)[O-] 2321759166 OOEGKGHJXZMLEY-UHFFFAOYSA-N 275.290 -0.867 5 10 CBBE C[C@H](N=c1nc([N+](=O)[O-])n(C)[nH]1)[C@@H]1CCCNC1 2321765254 TXRHVPZQDPMPPU-JGVFFNPUSA-N 254.294 -0.055 5 10 CBBE Cn1[nH]c(=NC2CC([C@H](F)C(=O)O)C2)nc1[N+](=O)[O-] 2345024399 QGTTUEZGLJVVBV-WRVKLSGPSA-N 273.224 -0.242 5 10 CBBE O=[N+]([O-])c1cnc(F)nc1N1CC[C@@H]2C[C@H]1[C@H](O)[C@H]2O 2357595572 UOTFPXCSEZSDFP-OVLTXKMTSA-N 284.247 -0.156 5 10 CBBE Nc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@@H](O)C1 61713807 MILTYNSQWPNXNT-MRVPVSSYSA-N 287.297 -0.068 5 10 CBBE N[C@@H](CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)C(=O)O 88117085 CDNHIMGLJOBBDM-LURJTMIESA-N 279.208 -0.397 5 10 CBBE biogenic CCCn1cc([N+](=O)[O-])c(=O)n(C[C@H](C)CO)c1=O 128339726 OAMYIBVGLVXNMS-QMMMGPOBSA-N 271.273 -0.043 5 10 CBBE Nc1cc(CN2C[C@@H](O)[C@H](O)C2)ccc1[N+](=O)[O-] 236347322 BFJJDANOSUWTRV-GHMZBOCLSA-N 253.258 -0.286 5 10 CBBE Nc1cc(C(=O)N[C@@H]2CCCNC2=O)c([N+](=O)[O-])cn1 236366607 JGMOZTNNPNULKN-SSDOTTSWSA-N 279.256 -0.420 5 10 CBBE CCn1c(C)nc([N+](=O)[O-])c1N(C)C[C@@H](O)CN 310929409 HHJRNUFKQONRLQ-QMMMGPOBSA-N 257.294 -0.125 5 10 CBBE Cc1nn(C)c(C(=O)N2CC(=O)N(C)C2)c1[N+](=O)[O-] 351966667 CZNCGAPJNYRIFF-UHFFFAOYSA-N 267.245 -0.492 5 10 CBBE Cn1nnc(CNc2ccc3ncc([N+](=O)[O-])n3n2)n1 362843178 OHHOVPANTPDQQA-UHFFFAOYSA-N 275.232 -0.227 5 10 CBBE COc1ncnc(N2CC[C@](CO)(OC)C2)c1[N+](=O)[O-] 401884428 JSVJHFNMPJLUBV-NSHDSACASA-N 284.272 -0.019 5 10 CBBE COc1cc(C(=O)NC2=NCC(=O)N2)ccc1[N+](=O)[O-] 523508905 DGNATHVLRYGTQW-UHFFFAOYSA-N 278.224 -0.181 5 10 CBBE O=c1ccc([N+](=O)[O-])cn1CCN1C[C@@H]2C[C@H]1C[S@@]2=O 593100095 MSWAPRCWBIYQTE-MKXJDEKUSA-N 297.336 -0.038 5 10 CBBE CN1C(=O)C[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1=O 594355451 DCJLXSMMJOWKDW-SSDOTTSWSA-N 293.235 -0.213 5 10 CBBE O=C(CCOc1ccccc1[N+](=O)[O-])N1CC(O)(CO)C1 597706505 UNOXAKSMZVVILZ-UHFFFAOYSA-N 296.279 -0.071 5 10 CBBE CN1CCOC[C@H]1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 600421356 NENVQKYNBZHZAN-SSDOTTSWSA-N 269.261 -0.622 5 10 CBBE O=C(N[C@@H]1CCOC[C@H]1O)c1cc([N+](=O)[O-])n[nH]1 600590596 MBYHIYDGPUPYHE-IYSWYEEDSA-N 256.218 -0.803 5 10 CBBE NC[C@H](O)CC(=O)Nc1ccc([N+](=O)[O-])cc1O 705569727 CCCMPXDQPROTMJ-SSDOTTSWSA-N 255.230 -0.051 5 10 CBBE C[C@H](ONC(=O)c1cc([N+](=O)[O-])cnc1O)C(=O)O 709032056 GIROPFAOUQNCCR-BYPYZUCNSA-N 271.185 -0.170 5 10 CBBE COCC(=O)NCC1(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1288764988 ZSPLVCIQFVPBNC-NXEZZACHSA-N 299.327 -0.299 5 10 CBBE CNC(=O)[C@H](C)NC(=O)c1nn(C)cc1[N+](=O)[O-] 1295099389 RMISRZGYAYRBDY-YFKPBYRVSA-N 255.234 -0.807 5 10 CBBE CCN(CCNC(=O)c1ccon1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1296268103 ZXOPKRXXIFGGOV-PSASIEDQSA-N 296.283 -0.082 5 10 CBBE C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC(=O)N1 1298110309 FGXCCFQVEQDPTA-ZCFIWIBFSA-N 267.245 -0.711 5 10 CBBE C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1O 1337019474 LTVHCXFEDQJUQU-NKWVEPMBSA-N 255.234 -0.975 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@H](CO)C1 1466635465 MOLYYUWEVOZRJQ-SSDOTTSWSA-N 255.234 -0.973 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](c3nn[nH]n3)C2)n1 1471459534 GTUVCQFCAWMFHS-ZCFIWIBFSA-N 292.259 -0.529 5 10 CBBE COC(=O)[C@@H](O)CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 1472433947 GFAJIOWWIAANKM-JTQLQIEISA-N 298.251 -0.046 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](NC(N)=O)C2)n1 1567147522 QRYFTXJOQPZSMY-LURJTMIESA-N 282.260 -0.789 5 10 CBBE COC(=O)[C@@H](F)CNC(=O)CCn1cc([N+](=O)[O-])cn1 1584311247 JGOVXUDNGNZWGA-QMMMGPOBSA-N 288.235 -0.191 5 10 CBBE O=C(NC[C@H]1C[C@@H]2COC[C@@H]2O1)c1c[nH]nc1[N+](=O)[O-] 1634153563 PIQPSHVYYZYVFX-BHNWBGBOSA-N 282.256 -0.148 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NC[C@@H]1CC[C@@H](C(N)=O)O1 1651636425 NHVDKJHVWIUWKH-XPUUQOCRSA-N 269.261 -0.227 5 10 CBBE O=C(Cn1nc([N+](=O)[O-])cc1[N+](=O)[O-])NC1CC1 1652005347 NZQAXBRGHGJOMN-UHFFFAOYSA-N 255.190 -0.022 5 10 CBBE CCN1CCN(CC(=O)OCc2cc([N+](=O)[O-])n[nH]2)CC1 1851539073 UCKGTTCUXTYOKG-UHFFFAOYSA-N 297.315 -0.001 5 10 CBBE N=c1[nH]c(N2CCO[C@@H]3COC[C@H]32)ncc1[N+](=O)[O-] 1877669074 QAGOXJSWNQPPDV-HTQZYQBOSA-N 267.245 -0.599 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2CCC[C@](O)(C(=O)O)C2)n1 1891194393 VFERXFCRYXHIPN-SNVBAGLBSA-N 270.245 -0.256 5 10 CBBE CN(c1cc([N+](=O)[O-])cc(=N)[nH]1)[C@@H]1CCNC1=O 1916818470 MPCSKGHSMNUFIL-SSDOTTSWSA-N 251.246 -0.273 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1CC2CC1(CO)C2 1964988776 KHZLLOUPVMPPLC-UHFFFAOYSA-N 266.257 -0.075 5 10 CBBE NC1(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1972549191 VCEJWAWXGZCVRG-UHFFFAOYSA-N 253.262 -0.211 5 10 CBBE CSC[C@@](C)(O)CN=c1nc([N+](=O)[O-])[nH]n1C 1997013896 MBQDPASTDQZCFW-QMMMGPOBSA-N 261.307 -0.329 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N1CC(OCCO)C1 2034845024 KEEUJNKOHGBNLA-UHFFFAOYSA-N 258.209 -0.279 5 10 CBBE NS(=O)(=O)NCCCN=c1cccc([N+](=O)[O-])[nH]1 2039827772 UJEOIBDRTCOGIH-UHFFFAOYSA-N 275.290 -0.993 5 10 CBBE COc1nc(=NC[C@@H](C)C(=O)O)[nH]cc1[N+](=O)[O-] 2039922936 MYDJXFJELDJCAZ-RXMQYKEDSA-N 256.218 -0.052 5 10 CBBE CN=c1[nH]c(N[C@@H](CO)COC)ncc1[N+](=O)[O-] 2039925403 XYXSEUUEIDDVKV-LURJTMIESA-N 257.250 -0.732 5 10 CBBE CN(C)[C@H]1CC[C@@H]1N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-] 2039968656 TZPJPOBMLLKZRS-BQBZGAKWSA-N 252.278 -0.276 5 10 CBBE CN1CCC[C@@H](N=c2nc([N+](=O)[O-])[nH]n2C)C1=O 2041242915 KATFLKIJVICHCU-ZCFIWIBFSA-N 254.250 -0.822 5 10 CBBE O=[N+]([O-])c1c(Cl)ncnc1N1CCNC[C@@H]1CO 2044442907 CIRPCVNQYPCPCV-ZCFIWIBFSA-N 273.680 -0.191 5 10 CBBE Cc1nc(CN2C[C@H](O)[C@@H](O)C2)ccc1[N+](=O)[O-] 2048567054 SIGNEKXCZPJPGQ-QWRGUYRKSA-N 253.258 -0.164 5 10 CBBE C[C@@H]([C@@H](C)N=c1[nH]n(C)cc1[N+](=O)[O-])S(C)(=O)=O 2051071049 LERYCEVKTXXRSK-RQJHMYQMSA-N 276.318 -0.016 5 10 CBBE C[C@@H](N)[C@H]1CCN(c2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2053524864 ULLAVLKSYHGPBO-RQJHMYQMSA-N 252.278 -0.029 5 10 CBBE CN=c1nc(N(C)[C@@H](C)CN)c([N+](=O)[O-])c(C)[nH]1 2053562915 BSLNVNZBOUVDNV-LURJTMIESA-N 254.294 -0.060 5 10 CBBE CNC[C@@H]1CCN(c2nc(=N)[nH]cc2[N+](=O)[O-])C1 2053563805 DAWRRAAGHCSKQE-ZETCQYMHSA-N 252.278 -0.157 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=N[C@@H]2CCCC[C@@H]2N)[nH]1 2053600375 UXAKDAGVBCAYJV-NKWVEPMBSA-N 252.278 -0.099 5 10 CBBE CCCN=c1[nH]cc([N+](=O)[O-])c(=NC2CNC2)[nH]1 2053602931 XPLBSVRUENZPBS-UHFFFAOYSA-N 252.278 -0.566 5 10 CBBE N=c1nc(N2C[C@H](F)[C@@H](CO)C2)c([N+](=O)[O-])c[nH]1 2057012366 JDKDCFWTJCHBJT-RITPCOANSA-N 257.225 -0.436 5 10 CBBE O=[N+]([O-])c1cnc(Cl)[nH]c1=N[C@@H]1CNCC[C@H]1O 2063348752 PWVLGSSDALGOLD-IYSWYEEDSA-N 273.680 -0.405 5 10 CBBE Nc1nc[nH]c(=NCCC(F)(F)CO)c1[N+](=O)[O-] 2064901027 WZVYVDQBPXDVSE-UHFFFAOYSA-N 263.204 -0.182 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC[C@H]1COCC[C@H]1N 2072984093 JOUUYHDSRHRJGS-RNFRBKRXSA-N 257.250 -0.534 5 10 CBBE N=c1cc([N+](=O)[O-])cc(N2CCC2(CO)CO)[nH]1 2073992033 OURQVWKAMWUGPK-UHFFFAOYSA-N 254.246 -0.664 5 10 CBBE COC(=O)[C@H](CN)Oc1nn(C)c(C)c1[N+](=O)[O-] 2086307655 LOOWNJBALHIWOM-LURJTMIESA-N 258.234 -0.484 5 10 CBBE O=C(O)[C@@]1(n2cnc([N+](=O)[O-])n2)CCN2CC[C@H]1C2 2088718062 WGLLRCPZFJPHIU-OIBJUYFYSA-N 267.245 -0.308 5 10 CBBE O=[N+]([O-])c1ccc(N2CCOC[C@@H]2[C@H](O)CO)nc1 2090135074 CHYWOXIEILGTCI-NXEZZACHSA-N 269.257 -0.452 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1C[C@@H]2CNC[C@@H]21 2095038175 BEKZNQDLSQHMBO-HRDYMLBCSA-N 265.273 -0.485 5 10 CBBE CO[C@H]1CN(Cc2nn(C)cc2[N+](=O)[O-])CC[C@H]1N 2102867217 YIUKMDCGGXCRCY-KCJUWKMLSA-N 269.305 -0.124 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@H]1[C@@H](C(=O)O)C1(F)F 2102944611 SBRSJYYOKVJRNF-IMJSIDKUSA-N 277.187 -0.477 5 10 CBBE CO[C@H](C)[C@H](CC(=O)O)N=c1nc([N+](=O)[O-])[nH]n1C 2109492489 GLHOCKGWJWPISD-RITPCOANSA-N 273.249 -0.565 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@H]2C[C@@H](O)[C@H](O)[C@H]1C2 2116727593 IIFKARDKCKCIFS-FNCVBFRFSA-N 268.273 -0.351 5 10 CBBE Nc1cc(N2CCNC[C@H]2C(=O)O)ncc1[N+](=O)[O-] 2117176638 WEGTVJWXQZENKP-QMMMGPOBSA-N 267.245 -0.565 5 10 CBBE Cc1[nH]c(=N)[nH]c(=NC[C@H]2CCCNC2)c1[N+](=O)[O-] 2117256213 YTRNFNSBQGWKTH-QMMMGPOBSA-N 266.305 -0.061 5 10 CBBE Cn1nc([N+](=O)[O-])nc1O[C@@H]1C[C@H]2CNCCN2C1 2119836145 DOJSNJVBDJVYLS-JGVFFNPUSA-N 268.277 -0.852 5 10 CBBE CN=c1[nH]c(=NC[C@@H]2[C@H]3CCO[C@@H]23)[nH]cc1[N+](=O)[O-] 2119932751 GBGRMBSGWGJSHA-ZXFLCMHBSA-N 265.273 -0.283 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=N[C@H]2C[C@](C)(CO)C2)[nH]1 2123441808 WOKKJCQIOJGZGY-AGGWVSIMSA-N 267.289 -0.157 5 10 CBBE CS(=O)(=O)c1ccc(N[C@@H](CN)CO)c([N+](=O)[O-])c1 2126186753 WMXZHQHTZLOYGC-ZETCQYMHSA-N 289.313 -0.270 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1C[C@@H]1C(=O)O 2129991848 CMBOVQZQCUWAAA-RITPCOANSA-N 268.229 -0.221 5 10 CBBE CN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H]1COC[C@@H]1O 2129994659 XARDFQQWVADDME-YUMQZZPRSA-N 270.245 -0.840 5 10 CBBE O=C(O)C1=C[C@@H](O)[C@@H](N=c2cc[nH]cc2[N+](=O)[O-])C1 2131508052 FVWALJDDEQMFNT-WCBMZHEXSA-N 265.225 -0.032 5 10 CBBE C[C@@H](C(=O)O)N1CC(Nc2ncc([N+](=O)[O-])cn2)C1 2131764176 VNBLXDVTDIVVJZ-LURJTMIESA-N 267.245 -0.046 5 10 CBBE O=[N+]([O-])c1c[nH]ccc1=NS(=O)(=O)C[C@@H]1CCCN1 2137703035 ITMFPZGSPZPHCI-QMMMGPOBSA-N 286.313 -0.095 5 10 CBBE CN(C)C[C@H]1COC[C@@H]1N=c1[nH]n(C)cc1[N+](=O)[O-] 2141458756 FCEDEYJQXBVGMI-IUCAKERBSA-N 269.305 -0.261 5 10 CBBE CN1CCO[C@@H]2CN(c3nc(=N)[nH]cc3[N+](=O)[O-])C[C@H]21 2154055289 XQZNTBITZOOGJD-RKDXNWHRSA-N 280.288 -0.683 5 10 CBBE COc1nc(NC2CC(N)(C(=O)O)C2)ncc1[N+](=O)[O-] 2157670106 CAKGXAJVIVHWJN-UHFFFAOYSA-N 283.244 -0.250 5 10 CBBE COc1ncnc(N2C[C@H](N)[C@H]3COC[C@H]32)c1[N+](=O)[O-] 2158361991 LRXRYDCXBORNRL-GJMOJQLCSA-N 281.272 -0.444 5 10 CBBE COC(=O)[C@@H]1C[C@H](Oc2ccnc(O)c2[N+](=O)[O-])CN1 2167174982 IXPWHGCDUBZBQW-BQBZGAKWSA-N 283.240 -0.022 5 10 CBBE O=C(CCn1cnc([N+](=O)[O-])c1)NC[C@H](F)C1CNC1 2169212404 YQPBTVVFUNJXHA-VIFPVBQESA-N 285.279 -0.145 5 10 CBBE CN=c1[nH]c(=NC[C@H]2C[C@](F)(CN)C2)[nH]cc1[N+](=O)[O-] 2173834622 ADODZWMZSIXYHL-DGFRNANFSA-N 284.295 -0.241 5 10 CBBE C[C@@H]1CNC[C@H](CCN=c2[nH]cnc(N)c2[N+](=O)[O-])O1 2181215367 NPHBZSARRALSFT-SFYZADRCSA-N 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Cn1nncc1CCNc1ncnc(NN)c1[N+](=O)[O-] 2179852537 WQWJRQKDQVCUCG-UHFFFAOYSA-N 279.264 -0.547 5 10 CBBE N=c1[nH]c(Oc2cnn3c2CNCC3)ncc1[N+](=O)[O-] 2184554538 GRVVOICSCSELPX-UHFFFAOYSA-N 277.244 -0.111 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCNC[C@H]2CO)n1 2186532136 KNJDSYCUFBMCEN-JGVFFNPUSA-N 283.288 -0.972 5 10 CBBE CN(C[C@H]1CNCCO1)C(=O)c1c([N+](=O)[O-])cnn1C 2186534855 YBIPMWAREIVTBD-MRVPVSSYSA-N 283.288 -0.611 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN(CC(=O)O)[C@H]2CC[C@@H]2N)n1 2193290525 IMJVVGKTJZEDJG-CBAPKCEASA-N 283.288 -0.295 5 10 CBBE C[C@]1(O)CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)CC[C@@]1(C)O 2194604450 QQEHKAJMLIUTCW-MNOVXSKESA-N 283.288 -0.491 5 10 CBBE NC(=O)c1ccc(CN2CC[C@@H]2C(N)=O)c([N+](=O)[O-])c1 2195515938 IFKSXQUORGANQG-SECBINFHSA-N 278.268 -0.247 5 10 CBBE Cc1ccc(N2C[C@H](O)[C@H](O)[C@H]2C(=O)O)c([N+](=O)[O-])c1 2200869202 ZHWWURGQLUSWDZ-DCAQKATOSA-N 282.252 -0.102 5 10 CBBE Nc1cc(CN2C[C@H](O)[C@@H](O)[C@H]2CO)ccc1[N+](=O)[O-] 2201038713 YANKONQKKJIBFC-WOPDTQHZSA-N 283.284 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O=[N+]([O-])c1cnc(N(CCO)CCOCCO)nc1 1472802652 ARRWIHJYIGDHBB-UHFFFAOYSA-N 272.261 -0.808 5 10 CBBE CCn1ccc(C(=O)NCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1491282161 GXFZWUAAZXYSJB-PSASIEDQSA-N 295.299 -0.586 5 10 CBBE CC(C)OCC(=O)NCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1491622594 NHVJBGNIOHIRCE-NXEZZACHSA-N 287.316 -0.301 5 10 CBBE Cn1ncc([N+](=O)[O-])c1NCCS(=O)(=O)NC1CC1 1559068376 ZHRJQAPOLMKVEA-UHFFFAOYSA-N 289.317 -0.178 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(C(N)=O)C2)n1 1585221748 AXYCCJUGQUMFLH-ZCFIWIBFSA-N 282.260 -0.789 5 10 CBBE CCN1CC[C@@H]1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1625022450 INDLJGPWHZVYCP-MRVPVSSYSA-N 268.277 -0.603 5 10 CBBE C[C@@H](O)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 1629765353 KDKOOOQFYZWZLS-HTRCEHHLSA-N 270.245 -0.460 5 10 CBBE Cn1cncc1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1636025646 BPKHCXUWMZLPMZ-UHFFFAOYSA-N 291.267 -0.194 5 10 CBBE CC1(C)CNC(=O)[C@@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1648204035 HIFRMFVJOHGOAM-ZJUUUORDSA-N 297.315 -0.734 5 10 CBBE CNC(=O)C1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CCOCC1 1652040377 NAZBIVVDYHLVTF-UHFFFAOYSA-N 297.271 -0.657 5 10 CBBE CCNCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1700245940 AIKCSMFNFGVVSB-NXEZZACHSA-N 271.317 -0.074 5 10 CBBE CC(=O)N1CCC(C(=O)N2CCN=C2C[N+](=O)[O-])CC1 1851328791 UGQMPZZUXPZTKQ-UHFFFAOYSA-N 282.300 -0.238 5 10 CBBE CN(C)[C@@H](C(=O)N1CCN=C1C[N+](=O)[O-])c1cnn(C)c1 1852844520 YOWJDSPOQSSFFY-LLVKDONJSA-N 294.315 -0.460 5 10 CBBE CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](N2CC([N+](=O)[O-])C2)C1 1883143523 CRIFHQORBQMCJB-NXEZZACHSA-N 287.316 -0.073 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@]12CCNC[C@@H]1C2 1891121343 ILBJRECHIJKOOS-GZMMTYOYSA-N 265.273 -0.341 5 10 CBBE Nc1ccnc(N2CC(CO)(CO)C2)c1[N+](=O)[O-] 1914970530 DIDWEUOKWSOWDU-UHFFFAOYSA-N 254.246 -0.637 5 10 CBBE Cn1cc([N+](=O)[O-])c(=N[C@@H]2CCNCC[C@H]2CO)[nH]1 1921708650 QPDGFZIVFQTEMS-DTWKUNHWSA-N 269.305 -0.477 5 10 CBBE CC1(C)C[C@@H](S(=O)(=O)N2CC([N+](=O)[O-])C2)CN1 2016888870 JEHLMGBDXLBXGG-MRVPVSSYSA-N 263.319 -0.582 5 10 CBBE C[C@@H]1OCCO[C@@H]1CN=c1[nH]n(C)cc1[N+](=O)[O-] 2027194934 KXKAPBBWGPGQTN-IONNQARKSA-N 256.262 -0.034 5 10 CBBE N=c1[nH]cc([N+](=O)[O-])c(=NCC23CC(CO2)C3)[nH]1 2028716860 UHFFGBWUWRQNMO-UHFFFAOYSA-N 251.246 -0.190 5 10 CBBE O=C(NC[C@@H]1COC[C@@H]1O)c1ccc([N+](=O)[O-])o1 2036574593 DUJUTAJCGAOMOL-RQJHMYQMSA-N 256.214 -0.075 5 10 CBBE NC(=O)NC1CN(c2ncnc(Cl)c2[N+](=O)[O-])C1 2044811546 AALSRDPYDJKGFU-UHFFFAOYSA-N 272.652 -0.105 5 10 CBBE N[C@H]1C[C@@H](O)CN(Cc2ccc([N+](=O)[O-])cn2)C1 2049100013 UDACWGTYGLIJNW-GZMMTYOYSA-N 252.274 -0.116 5 10 CBBE C[C@@H](N=c1nc([N+](=O)[O-])[nH]n1C)[C@@H](C)S(C)(=O)=O 2051067745 BLYKGIXYPZSNNU-PHDIDXHHSA-N 277.306 -0.621 5 10 CBBE C[C@H]1CNC[C@@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 2066471628 JJERJVPNNHGLQU-BQBZGAKWSA-N 253.262 -0.334 5 10 CBBE O=C(N1CC([N+](=O)[O-])C1)N1C[C@@H]2C[C@]2(C(=O)O)C1 2071558807 RKADLBOHTKZOBZ-WKEGUHRASA-N 255.230 -0.526 5 10 CBBE O=C(O)[C@H]1CN(C(=O)N2CC([N+](=O)[O-])C2)C[C@@H]1F 2071563685 MLWNKFGVPMDDDO-BQBZGAKWSA-N 261.209 -0.578 5 10 CBBE Cn1cnc([N+](=O)[O-])c1NC1(C(=O)O)CC(O)C1 2073180179 VNFBXGVVVCIKCE-UHFFFAOYSA-N 256.218 -0.282 5 10 CBBE O=[N+]([O-])c1cnc(N2C[C@H](O)[C@@H](O)[C@@H]2CF)nc1 2084787766 PLHLNHBGKMPLOS-FXQIFTODSA-N 258.209 -0.735 5 10 CBBE Nc1ccc(N2CCS(=O)(=O)CCO2)nc1[N+](=O)[O-] 2090269194 IWKLZOOHKBWCEI-UHFFFAOYSA-N 288.285 -0.262 5 10 CBBE C[C@@H](N=c1[nH]c(=N)[nH]cc1[N+](=O)[O-])c1ncnn1C 2097034136 VXCKUDCNJDEYGG-RXMQYKEDSA-N 264.249 -0.479 5 10 CBBE COc1ncnc(O[C@H]2COC[C@H]2CN)c1[N+](=O)[O-] 2097862774 ZVWIIOYOIRSNQI-RQJHMYQMSA-N 270.245 -0.254 5 10 CBBE Cn1cc([N+](=O)[O-])c(CN2C(=O)OC[C@@H]2C(=O)O)n1 2102863772 WRYVXECEUUUEJV-SSDOTTSWSA-N 270.201 -0.266 5 10 CBBE Cn1nc([N+](=O)[O-])nc1N1C[C@H](CO)OC(C)(C)C1 2102943481 HPXVXTMFMVCRMW-SSDOTTSWSA-N 271.277 -0.301 5 10 CBBE N[C@H]1C[C@@](F)(CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 2108709693 NMWQFEZYRNAUIL-GVJMRKKJSA-N 271.252 -0.263 5 10 CBBE Nc1cc(N2CCCC2(CO)CO)ncc1[N+](=O)[O-] 2109588290 BZYPBRWJGRTCMM-UHFFFAOYSA-N 268.273 -0.104 5 10 CBBE Nc1ccnc(N2CCNC[C@H]2C(=O)O)c1[N+](=O)[O-] 2117175023 MEOYHYMOYFYTRJ-ZETCQYMHSA-N 267.245 -0.565 5 10 CBBE CN=c1[nH]c(C)c([N+](=O)[O-])c(=NC[C@H]2C[C@@H]2CN)[nH]1 2117647893 SOLSVLPCLOJNMN-HTQZYQBOSA-N 266.305 -0.415 5 10 CBBE Cn1nc([N+](=O)[O-])nc1OC[C@@]1(CN)CCCOC1 2119776179 SUYQSNZJUGAQHX-SNVBAGLBSA-N 271.277 -0.142 5 10 CBBE CCC1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CNC1 2121538754 BAYFKWBFVOKSBF-UHFFFAOYSA-N 267.289 -0.093 5 10 CBBE O=[N+]([O-])c1c(F)ncnc1N[C@@H]1CO[C@@H]2CNC[C@@H]12 2121658886 XMKSGCXDCVDYRZ-RRKCRQDMSA-N 269.236 -0.077 5 10 CBBE CO[C@@H]1C[C@@H]1CN=c1[nH]c(NN)nc(C)c1[N+](=O)[O-] 2131640626 UWIJJBGWWPDGBS-RNFRBKRXSA-N 268.277 -0.152 5 10 CBBE Cc1nc([N+](=O)[O-])c(N2CC[C@H](O)[C@](C)(O)C2)n1C 2136883535 JTXJEAZSTWBLCL-GZMMTYOYSA-N 270.289 -0.041 5 10 CBBE O=C1CC[C@H](C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CN1 2137714753 OYAFMIBZIFHVPS-ZETCQYMHSA-N 264.241 -0.124 5 10 CBBE Cc1cc([N+](=O)[O-])nn1[C@@H]1CC(CO)(CO)C[C@@H]1O 2141429154 RPUUWKHPJSSMHG-BDAKNGLRSA-N 271.273 -0.233 5 10 CBBE COc1ccc([N+](=O)[O-])cc1OC[C@]1(O)CNC[C@H]1O 2157170702 DKBRIHALQNPZGI-VXGBXAGGSA-N 284.268 -0.323 5 10 CBBE COc1nc(N(CC(=O)O)CC(=O)O)ncc1[N+](=O)[O-] 2157676696 PFTOFQSAYCSUPG-UHFFFAOYSA-N 286.200 -0.631 5 10 CBBE O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[C@](CO)(C(=O)O)C1 2159945989 BLGWLSNJISDLQL-NSHDSACASA-N 283.240 -0.168 5 10 CBBE NC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H](O)C[C@H]2O)c1 2164983415 VRLGFWLLOAMPTH-BCMRRPTOSA-N 281.268 -0.010 5 10 CBBE COc1cc(N[C@@H]2C[C@H](O)[C@@H](O)[C@@H]2O)ccc1[N+](=O)[O-] 2165121100 KSQBZEIVXDULDL-OAIFWDMCSA-N 284.268 -0.130 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NCC[C@@H]1COC[C@@H]1O 2167600370 LZCOTQVMAISFEJ-SCZZXKLOSA-N 284.272 -0.695 5 10 CBBE CCCNC(=O)C1CN(c2ncc([N+](=O)[O-])c(=N)[nH]2)C1 2168046597 QUIKVDBFHVMXLD-UHFFFAOYSA-N 280.288 -0.240 5 10 CBBE CN=c1nc(N2CCO[C@H](CN)C2)c([N+](=O)[O-])c(C)[nH]1 2173866020 WKPIOXQJVTZTAS-MRVPVSSYSA-N 282.304 -0.679 5 10 CBBE Cn1[nH]c(=NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1F 2182799457 HHESZOGGTJAZPB-QMMMGPOBSA-N 284.251 -0.441 5 10 CBBE Cc1cc(N2CC3(C2)OC[C@H](O)[C@@H]3O)ncc1[N+](=O)[O-] 2183726750 BZEPAIUMEXYQGU-ONGXEEELSA-N 281.268 -0.391 5 10 CBBE N=c1[nH]c(O[C@@H]2C[C@@H]3CNCCN3C2)ncc1[N+](=O)[O-] 2184673489 OHNWEVIMTRSSJE-HTQZYQBOSA-N 280.288 -0.778 5 10 CBBE Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2[C@H](C(=O)O)[C@@H]2C1 2186543394 VZBYAPSVWUYAJG-UQWHLADISA-N 280.240 -0.269 5 10 CBBE CC(C)(O)[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 2188014922 VQYSMSVTVXCLOX-MRVPVSSYSA-N 286.244 -0.868 5 10 CBBE N=c1nc(N2CCCCC2)[nH]c(N2CC([N+](=O)[O-])C2)n1 2191528688 FORRTUZRYYCDNV-UHFFFAOYSA-N 279.304 -0.260 5 10 CBBE CO[C@@H]1CCN(C(=O)N2CC([N+](=O)[O-])C2)[C@H](C(=O)O)C1 2191530793 PVRUUCQEPGTEKD-BDAKNGLRSA-N 287.272 -0.369 5 10 CBBE Cc1[nH]c(=N)nc(N2CCO[C@@H]3COC[C@H]32)c1[N+](=O)[O-] 2192635807 CGPWFUXUUDNQCH-HTQZYQBOSA-N 281.272 -0.290 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCOC[C@@H]1CO 2193216123 CHWTULRZICJUSY-IUCAKERBSA-N 284.272 -0.695 5 10 CBBE NC(=O)c1ccccc1NC(=O)CN1CC([N+](=O)[O-])C1 2195527176 GWAYXKMOVLEXRY-UHFFFAOYSA-N 278.268 -0.315 5 10 CBBE O=C(O)c1ccnc(NCC2(CO)CNC2)c1[N+](=O)[O-] 2201715550 AGOKGHRICMLABM-UHFFFAOYSA-N 282.256 -0.318 5 10 CBBE O=[N+]([O-])c1cncnc1N1C[C@H](O)[C@H]2COC[C@H]21 2219802514 JTCYQXMXHNILHK-ZQARSLAVSA-N 252.230 -0.419 5 10 CBBE CNC[C@H]1CN(c2ncncc2[N+](=O)[O-])CCO1 2219825557 FHNJIQXIDTVLFQ-QMMMGPOBSA-N 253.262 -0.191 5 10 CBBE CCn1cc([N+](=O)[O-])c(=N[C@@H]2CCO[C@H]2C(=O)O)[nH]1 2230794762 JLZSLJJRYZZEHE-HTRCEHHLSA-N 270.245 -0.113 5 10 CBBE C[C@@H]1CN[C@H](C(=O)NCc2nn(C)cc2[N+](=O)[O-])C1 2231918279 ABFJKMAKIXZZQW-YUMQZZPRSA-N 267.289 -0.058 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNC(=O)[C@H]2CNC[C@H]2F)n1 2231931860 CXVMDWRZXRVSQQ-NKWVEPMBSA-N 271.252 -0.498 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N[C@H](C(=O)O)[C@@H](C)O)n1 2258618065 WMSKCUKONIITFO-FBCQKBJTSA-N 256.218 -0.061 5 10 CBBE CCc1ncc([N+](=O)[O-])c(O[C@@H](CN)C(=O)O)n1 2258640872 KNGGZHCEOUUKPT-LURJTMIESA-N 256.218 -0.262 5 10 CBBE Nc1ncnc(N2CC[C@H](O)[C@H](O)CC2)c1[N+](=O)[O-] 2269139095 RRKHKLFTINSSKL-KNVOCYPGSA-N 269.261 -0.711 5 10 CBBE Cc1ncc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)[C@H]2CF)n1 2271065004 JAXZHJVFFMQHOX-BWVDBABLSA-N 272.236 -0.427 5 10 CBBE O=[N+]([O-])c1cnc(C2CC2)[nH]c1=N[C@H]1CNC[C@@H]1O 2271071513 FFFBUUQOZFIJEO-CBAPKCEASA-N 265.273 -0.571 5 10 CBBE CCc1ncc([N+](=O)[O-])c(=NCc2nc(=O)o[nH]2)[nH]1 2271099425 UMDFEGILKURATK-UHFFFAOYSA-N 266.217 -0.343 5 10 CBBE CN=c1[nH]c(N2C[C@H]3C[C@]3(CN)C2)ncc1[N+](=O)[O-] 2272637061 RIMMJICSTXVYKW-HQJQHLMTSA-N 264.289 -0.367 5 10 CBBE COCc1ncc([N+](=O)[O-])c(=N[C@H]2COCC[C@@H]2O)[nH]1 2286736716 RDTVRUGMAWQMLL-CBAPKCEASA-N 284.272 -0.485 5 10 CBBE COC(=O)N[C@H](C)CN=c1[nH]c(NN)ncc1[N+](=O)[O-] 2290394389 PLNVEUHQVYYMSH-RXMQYKEDSA-N 285.264 -0.751 5 10 CBBE CN=c1[nH]c(=NCCOC(C)(C)CN)[nH]cc1[N+](=O)[O-] 2295852741 NSXCAGIUTUWIQS-UHFFFAOYSA-N 284.320 -0.564 5 10 CBBE Cn1[nH]c(=NC[C@H](N)c2ccco2)nc1[N+](=O)[O-] 2321765257 TYMYYZPHIMAFNM-LURJTMIESA-N 252.234 -0.150 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3C[C@H]2CN3)n1 2341171298 JUATWFRGBAQIDK-BIIVOSGPSA-N 265.273 -0.192 5 10 CBBE Cn1[nH]c([N+](=O)[O-])nc1=NC[C@]1(O)C[C@@H]1C(F)(F)F 2344278547 NGLHUMVKBPPGTE-MHTLYPKNSA-N 281.194 -0.130 5 10 CBBE CC(C)[C@H]1C[C@](C(=O)O)(n2cnc([N+](=O)[O-])n2)CN1 2344595501 OLUOAAKMFCODKK-XCBNKYQSSA-N 269.261 -0.016 5 10 CBBE COC[C@@]1(CN=c2nc([N+](=O)[O-])n(C)[nH]2)CCCO1 2344968647 RIIIVWDVSLKZBB-JTQLQIEISA-N 271.277 -0.247 5 10 CBBE Cn1[nH]c(=N[C@@H]2COCC[C@H]2C(=O)O)nc1[N+](=O)[O-] 2345006217 JZQFGOVMIAFFIP-PHDIDXHHSA-N 271.233 -0.953 5 10 CBBE O=C(CN1C(=O)CCc2cc([N+](=O)[O-])ccc21)NCCO 35650008 VVDNFHPUXQUKRU-UHFFFAOYSA-N 293.279 -0.018 5 10 CBBE NC(=O)C[C@H](N)C(=O)Nc1ccccc1[N+](=O)[O-] 37629000 AUGUJROJKBRFMM-LURJTMIESA-N 252.230 -0.264 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1COC[C@@H]1C(=O)O 90360972 XAMLSRDKSVYYOP-NKWVEPMBSA-N 284.228 -0.993 5 10 CBBE Nc1nc(Sc2nnnn2CC(=O)O)ccc1[N+](=O)[O-] 94261141 CGDDRLKLYIEHCV-UHFFFAOYSA-N 297.256 -0.206 5 10 CBBE COc1ncnc(NCCNS(C)(=O)=O)c1[N+](=O)[O-] 94738964 BGMWJCSVNXDZNL-UHFFFAOYSA-N 291.289 -0.646 5 10 CBBE CCn1cc([N+](=O)[O-])c(=O)n(Cc2cccnc2N)c1=O 111545494 GMSAYJJOHDAIFD-UHFFFAOYSA-N 291.267 -0.036 5 10 CBBE Cc1noc(CNc2ncnc(NN)c2[N+](=O)[O-])n1 123352321 JWKVTSOKGAUQGF-UHFFFAOYSA-N 266.221 -0.026 5 10 CBBE COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)[C@H](O)C2)c1 234576508 QKCYHIIIQMETCB-GHMZBOCLSA-N 282.252 -0.077 5 10 CBBE COCCNC(=O)CNc1nc(N)nc(C)c1[N+](=O)[O-] 234658036 QMNSGURLPMBVDH-UHFFFAOYSA-N 284.276 -0.550 5 10 CBBE Cc1cc([N+](=O)[O-])nn1[C@@H]1CS(=O)(=O)C[C@@H]1O 302311703 OEKFMOFOFYDBSG-RQJHMYQMSA-N 261.259 -0.570 5 10 CBBE NNc1cc(CN2CCNS2(=O)=O)ccc1[N+](=O)[O-] 308400146 HZMBIOOFKPNJTA-UHFFFAOYSA-N 287.301 -0.470 5 10 CBBE CNC(=O)C(C)(C)Nc1nc(NN)nc(C)c1[N+](=O)[O-] 313196494 HXNAXPGIHXWPGE-UHFFFAOYSA-N 283.292 -0.085 5 10 CBBE CCc1nn(C)c(N2C[C@@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 317436614 MCBIFYBPQWUPBN-IONNQARKSA-N 270.289 -0.320 5 10 CBBE CC[C@](C)(CCO)NC(=O)Cn1cnc([N+](=O)[O-])n1 351628169 LRICBQFJMBSEGY-SNVBAGLBSA-N 271.277 -0.146 5 10 CBBE Cc1ncc([N+](=O)[O-])cc1C(=O)NCCC(N)=O 362610824 NXOXMIHOVXTYPD-UHFFFAOYSA-N 252.230 -0.097 5 10 CBBE NNc1cc([N+](=O)[O-])cc(=NCC[C@@]2(O)CCOC2)[nH]1 404191340 FUAMPIBHBJYGOZ-LLVKDONJSA-N 283.288 -0.349 5 10 CBBE O=C(N[C@H]1CCNC1=O)c1cnc(O)c([N+](=O)[O-])c1 597853803 AYCDGZABXZAROR-LURJTMIESA-N 266.213 -0.686 5 10 CBBE NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1 600241627 LZXJOUIKMNTYEC-ZJUUUORDSA-N 279.252 -0.345 5 10 CBBE O=C(NC[C@@H](O)[C@@H]1CCCO1)c1cc([N+](=O)[O-])n[nH]1 600242787 RBGKPNGJNBIKBQ-SFYZADRCSA-N 270.245 -0.412 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC(=O)N(C3CC3)C2)n1 611335220 AJFQUQFFLCUOIO-ZETCQYMHSA-N 293.283 -0.179 5 10 CBBE CCN1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 619794627 PGWKKONXBVDABG-ZCFIWIBFSA-N 266.261 0.000 5 10 CBBE CCNc1ncc([N+](=O)[O-])c(N[C@H](C)[C@H](O)CO)n1 698949973 JXCDYCWDNQMYAX-HTRCEHHLSA-N 271.277 -0.030 5 10 CBBE O=C(N[C@H]1CNC[C@H]1O)c1ccc(F)cc1[N+](=O)[O-] 699899509 LNUWHFOLHJUKHT-WCBMZHEXSA-N 269.232 -0.204 5 10 CBBE O=C(N[C@@H]1CNC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 699988983 MMSMFUWRMIWKNG-ZJUUUORDSA-N 251.242 -0.343 5 10 CBBE CN(Cc1nn[nH]n1)C(=O)c1cc([N+](=O)[O-])ccc1N 706614647 WHWIEAPHHQUXAQ-UHFFFAOYSA-N 277.244 -0.038 5 10 CBBE O=[N+]([O-])c1cnc(N2CCC[C@H](CO)[C@H]2CO)nc1 709881225 OBEUEUNVEOYJTJ-PSASIEDQSA-N 268.273 -0.046 5 10 CBBE Cn1ccnc1C(=O)NCCn1cc([N+](=O)[O-])cn1 768506269 XTKRIKLRSMWHLO-UHFFFAOYSA-N 264.245 -0.045 5 10 CBBE Cc1nncn1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1147433675 XXZSKVWVLCMTQQ-UHFFFAOYSA-N 265.233 -0.352 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)NCc2nccn2C)n1 1319894987 JAVISDQDNKWJCP-UHFFFAOYSA-N 264.245 -0.008 5 10 CBBE COC(=O)CC1(NCC[N+](=O)[O-])CCS(=O)(=O)CC1 1459988709 JZFNHOIFNFLBPM-UHFFFAOYSA-N 294.329 -0.637 5 10 CBBE O=C(NC1CC1)c1c[nH]nc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1463367585 RLAZOCOJRNETOC-HTRCEHHLSA-N 279.256 -0.094 5 10 CBBE 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NNc1c(C(=O)NCCNC(N)=O)cccc1[N+](=O)[O-] 161586967 JVFIYQORIZMGEH-UHFFFAOYSA-N 282.260 -0.722 5 10 CBBE Cc1nc(NN)nc(NCCN(C)C)c1[N+](=O)[O-] 234252292 FBKVHBMTUIMPTD-UHFFFAOYSA-N 255.282 -0.048 5 10 CBBE Cn1nnc(NC(=O)c2cc([N+](=O)[O-])ncc2N)n1 311374822 HWRWYFZCOQSICQ-UHFFFAOYSA-N 264.205 -0.652 5 10 CBBE O=C(c1cc([N+](=O)[O-])cnc1O)N1C[C@H]2COC[C@@H](C1)O2 338955383 VGMJVCJMSXUFHN-DTORHVGOSA-N 295.251 -0.065 5 10 CBBE NC(=O)CN1CCN(c2c(F)cccc2[N+](=O)[O-])CC1=O 413418147 DVVZTEDPGFHSSP-UHFFFAOYSA-N 296.258 -0.132 5 10 CBBE C[C@@H]1C(=O)N(C)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 592901901 PIRZQODQSZASJB-RXMQYKEDSA-N 253.218 -0.422 5 10 CBBE CN(C)C[C@@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-] 597653573 LWALPOMREKBALK-QMMMGPOBSA-N 283.284 -0.047 5 10 CBBE C[C@H]1CN(CCNC(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 608778045 QKYAFHJOOIXXLA-VIFPVBQESA-N 298.303 -0.977 5 10 CBBE CN(C)C[C@@H](O)CN(C)c1nc(NN)ncc1[N+](=O)[O-] 690213366 RINAGWIWXSCMCT-SSDOTTSWSA-N 285.308 -0.971 5 10 CBBE 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269.261 -0.537 5 10 CBBE Cn1cc([N+](=O)[O-])c(C(=O)Nc2cnnn2C)n1 1436205681 SMBFLNUXPBSARJ-UHFFFAOYSA-N 251.206 -0.291 5 10 CBBE CS(=O)(=O)C[C@@H](O)CN=c1cc[nH]cc1[N+](=O)[O-] 1458666257 NBKMCKNFXAJARU-ZETCQYMHSA-N 275.286 -0.771 5 10 CBBE O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@]2(CCOC2=O)C1 1463459538 VPTBOPOTJYYBPZ-NSHDSACASA-N 295.255 -0.648 5 10 CBBE CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](CO)C1 1630706957 FPWINZZAOXEQBA-SSDOTTSWSA-N 269.261 -0.934 5 10 CBBE O=C(Nc1ccc([N+](=O)[O-])cn1)[C@@H]1C[C@H](O)CN1 1866041805 FNNZDAWNTLNJHL-YUMQZZPRSA-N 252.230 -0.349 5 10 CBBE Nc1c([N+](=O)[O-])ccc(NCC(O)(CO)CO)c1F 1913789303 IDMZJUCKNYMSER-UHFFFAOYSA-N 275.236 -0.556 5 10 CBBE O=C(NCC(O)(CO)CO)c1c(F)cccc1[N+](=O)[O-] 1913801202 BEAOOFDFMGIGLC-UHFFFAOYSA-N 288.231 -0.821 5 10 CBBE CCN=c1nc(N(C)[C@H]2CCNC2=O)c([N+](=O)[O-])c[nH]1 1916840594 WUJVLDLNUXCAQN-ZETCQYMHSA-N 280.288 -0.437 5 10 CBBE CN(C)C(=O)[C@H]1CNCCN1c1cccc([N+](=O)[O-])n1 1925546998 CWSUHPLBKWGZRF-SECBINFHSA-N 279.300 -0.144 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@H](O)C(F)(F)C1 1965219480 DTUXEYTUSSGNFW-ZETCQYMHSA-N 276.199 -0.370 5 10 CBBE CN=c1[nH]c(N2CC[C@@](C)(O)C2)ncc1[N+](=O)[O-] 2039923714 YFLNLWKINPAFTE-SNVBAGLBSA-N 253.262 -0.191 5 10 CBBE O=[N+]([O-])c1ccccc1NS(=O)(=O)N1CC(O)C1 2054419198 ZSHUMXSYAVOZOR-UHFFFAOYSA-N 273.270 -0.072 5 10 CBBE NC[C@H](O)COc1c(C(=O)O)cccc1[N+](=O)[O-] 2059044688 UHILFHPEUOMYOI-LURJTMIESA-N 256.214 -0.009 5 10 CBBE CNc1nc[nH]c(=NCC[C@@H](O)CO)c1[N+](=O)[O-] 2061855446 XWVXIYHHKZESMA-ZCFIWIBFSA-N 257.250 -0.996 5 10 CBBE CN(CCN)S(=O)(=O)Nc1ncccc1[N+](=O)[O-] 2082426295 ZSHAHTTWSCINBH-UHFFFAOYSA-N 275.290 -0.463 5 10 CBBE CO[C@H](CCN)C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 2082428233 ZXYXAKOQJZNGNX-SECBINFHSA-N 254.246 -0.286 5 10 CBBE Cc1c([N+](=O)[O-])c(=NC[C@@H](C)S(C)(=O)=O)[nH]n1C 2086320581 LFKAZVLEFMCDHF-ZCFIWIBFSA-N 276.318 -0.096 5 10 CBBE CNC(=O)CC[S@](=O)CC(=O)c1cc([N+](=O)[O-])c[nH]1 2089656739 FAETYDJQZJTEPI-IBGZPJMESA-N 287.297 -0.010 5 10 CBBE O=[N+]([O-])c1ccc(N2CCOC[C@H]2[C@H](O)CO)nc1 2090135076 CHYWOXIEILGTCI-VHSXEESVSA-N 269.257 -0.452 5 10 CBBE N[C@H]1COC[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 2093583453 PIJDHKCHZNTOBK-YUMQZZPRSA-N 287.297 -0.401 5 10 CBBE Cc1cc(OC[C@@]2(O)CNC[C@@H]2O)ccc1[N+](=O)[O-] 2100933094 VMXMCSIVEPCKDZ-RYUDHWBXSA-N 268.269 -0.023 5 10 CBBE Cn1cc([N+](=O)[O-])c(CNCC(=O)NCC2CC2)n1 2102873157 PLGQLGSCUOVONF-UHFFFAOYSA-N 267.289 -0.056 5 10 CBBE COCC1(Nc2nc([N+](=O)[O-])nn2C)CCNCC1 2102939916 XSXAEMLSSIBQDU-UHFFFAOYSA-N 270.293 -0.096 5 10 CBBE CCO[C@H]1CNCC[C@@H]1N=c1nc([N+](=O)[O-])[nH]n1C 2102943538 IARRNJFBIRMDIC-YUMQZZPRSA-N 270.293 -0.676 5 10 CBBE NC1(CN=c2[nH]c(F)ncc2[N+](=O)[O-])CCOCC1 2106061604 WIHCKULKFFYYDJ-UHFFFAOYSA-N 271.252 -0.134 5 10 CBBE Nc1nc(O[C@H]2CN[C@H](C(=O)O)C2)ccc1[N+](=O)[O-] 2110861080 WBHCDWMSZDULCM-RITPCOANSA-N 268.229 -0.234 5 10 CBBE CN(c1ncnc(F)c1[N+](=O)[O-])[C@@H]1CC(=O)NC1=O 2114737149 IKANWTZJAGKVQE-SCSAIBSYSA-N 269.192 -0.625 5 10 CBBE CN=c1[nH]cc([N+](=O)[O-])c(=NCc2cnc(C)[nH]2)[nH]1 2117106277 FYPKXXYJYAWKMS-UHFFFAOYSA-N 263.261 -0.086 5 10 CBBE N=c1ccc([N+](=O)[O-])c(N[C@@H]2CNCC[C@H]2CO)[nH]1 2117107551 FFAICCCYIFBRBK-JGVFFNPUSA-N 267.289 -0.215 5 10 CBBE Nc1ccnc(N2CCO[C@@H]3CNC[C@H]32)c1[N+](=O)[O-] 2117174141 IRVAXACGPHTEGD-RKDXNWHRSA-N 265.273 -0.251 5 10 CBBE CN(C[C@@H]1COCCN1)c1nccc(N)c1[N+](=O)[O-] 2117175413 OGSGVEZCWCOJBH-MRVPVSSYSA-N 267.289 -0.003 5 10 CBBE CNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 2118655228 LLHAWEIZWVFPJH-UHFFFAOYSA-N 287.253 -0.166 5 10 CBBE O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](CO)[C@H](O)[C@H]2O)cn1 2121471995 BVCMBBIYVSPYNE-OYYDVUBZSA-N 269.257 -0.496 5 10 CBBE COc1nc(N2C[C@H](O)C[C@@H]2CN)ncc1[N+](=O)[O-] 2124714429 SZTWMTNLMRNZSS-RNFRBKRXSA-N 269.261 -0.708 5 10 CBBE O=C(O)c1ccc([N+](=O)[O-])c(NCC[C@H](O)CO)n1 2125821925 KZRWJTOUUOTJER-LURJTMIESA-N 271.229 -0.157 5 10 CBBE CN(C(=O)c1cc(=N)[nH]cc1[N+](=O)[O-])C1(CO)CC1 2128185133 CLAWUTHKYKXDHC-UHFFFAOYSA-N 266.257 -0.001 5 10 CBBE Cn1cnc([N+](=O)[O-])c1N1C[C@@H](N)CC[C@H]1C(=O)O 2132275326 WWIRJHMNEQIAIP-BQBZGAKWSA-N 269.261 -0.291 5 10 CBBE NNc1ncc([N+](=O)[O-])c(=NC[C@@H]2[C@H]3CCOC[C@H]32)[nH]1 2150062528 IKROKRXNSAHMDO-BWZBUEFSSA-N 280.288 -0.213 5 10 CBBE NC(=O)[C@@H]1C[C@@H](N)CN(C(=O)c2ccc([N+](=O)[O-])s2)C1 2151040045 AXABUSPJFMEXQQ-RNFRBKRXSA-N 298.324 -0.069 5 10 CBBE NNc1cc([N+](=O)[O-])cc(=NC[C@H]2C[C@@H](O)CCO2)[nH]1 2154218506 BDLSFQPDUMEEQN-DTWKUNHWSA-N 283.288 -0.351 5 10 CBBE COc1nc(=NCC[C@H](OC)C(=O)O)[nH]cc1[N+](=O)[O-] 2157678288 IUBJTQKTKJMLPE-ZETCQYMHSA-N 286.244 -0.283 5 10 CBBE CN1CCCC[C@H](N=c2[nH]c(NN)ncc2[N+](=O)[O-])C1 2158574608 SGEKINHYWXNGGT-QMMMGPOBSA-N 281.320 -0.012 5 10 CBBE N=c1cc(C(=O)N[C@@H]2CN3CC[C@H]2C3)c([N+](=O)[O-])c[nH]1 2158771477 AOTGIJSTVYRWTB-IONNQARKSA-N 277.284 -0.164 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC(F)(F)CN1 2159052299 PLPCPZLXZCHBGV-ZETCQYMHSA-N 289.242 -0.095 5 10 CBBE COc1ncnc(N[C@@H](CC(N)=O)C(=O)O)c1[N+](=O)[O-] 2159076924 IUDOUPVVSMIDAJ-BYPYZUCNSA-N 285.216 -0.866 5 10 CBBE NCCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 2159496283 UIDRXQKSBTWRES-QMMMGPOBSA-N 285.260 -0.900 5 10 CBBE O=C(O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H](O)C[C@@H]2O)n1 2164984292 XYPJDUCQNDHOJP-KWPFTWCOSA-N 283.240 -0.016 5 10 CBBE O=C(N[C@@H]1C[C@H](O)C[C@H]1O)c1cc([N+](=O)[O-])cnc1O 2164988564 QOHICRQJZZGNET-NBEYISGCSA-N 283.240 -0.691 5 10 CBBE CNc1ncnc(N2CC[C@@](N)(C(=O)O)C2)c1[N+](=O)[O-] 2173855225 FWLPFTHYQQGIHI-JTQLQIEISA-N 282.260 -0.581 5 10 CBBE CN=c1nc(N2C[C@@H]3CNC[C@@H]3C2)c([N+](=O)[O-])c(C)[nH]1 2173868150 YRKZHULSTLYPIR-DTORHVGOSA-N 278.316 -0.188 5 10 CBBE COc1ncnc(O[C@@H]2CNC[C@H]2N(C)C)c1[N+](=O)[O-] 2176296096 FJFWXUQWTHVPSW-HTQZYQBOSA-N 283.288 -0.326 5 10 CBBE NNc1ccc([N+](=O)[O-])c(N2CCC[C@H]2[C@@H](O)CO)n1 2179794964 MGJGXFAHCUSPNS-CBAPKCEASA-N 283.288 -0.403 5 10 CBBE N[C@H]1C[C@H]2CN(c3cncc([N+](=O)[O-])c3)CCN2C1=O 2182746231 NBWNGSXPOFJPKG-QWRGUYRKSA-N 277.284 -0.262 5 10 CBBE C[C@@H](C[C@H]1COCCN1)Oc1ncc([N+](=O)[O-])c(=N)[nH]1 2185358974 VNZMPJQETGPPDM-YUMQZZPRSA-N 283.288 -0.057 5 10 CBBE CN(CCc1nn[nH]n1)C(=O)c1nn(C)cc1[N+](=O)[O-] 2186534081 SKLJTKGYRCKACU-UHFFFAOYSA-N 280.248 -0.844 5 10 CBBE O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCOC[C@H]1CO 2193216124 CHWTULRZICJUSY-RKDXNWHRSA-N 284.272 -0.695 5 10 CBBE O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H](O)C[C@H]1CO 2200805654 CXJHNTZAYYDWGV-WCBMZHEXSA-N 284.272 -0.865 5 10 CBBE Cn1c(C(=O)N2CC[C@@H](O)C[C@H]2CO)ccc1[N+](=O)[O-] 2200807415 WXSLRUYFKGTUEZ-DTWKUNHWSA-N 283.284 -0.109 5 10 CBBE CCn1nc(C)c([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)[C@H]1CO 2200871489 DVZJUOAHBJBZQJ-WEDXCCLWSA-N 286.288 -0.978 5 10 CBBE NCc1cn(CC(=O)Nc2cc([N+](=O)[O-])ccn2)nn1 2202439539 KRCJCMPQZNUNED-UHFFFAOYSA-N 277.244 -0.321 5 10 CBBE NS(=O)(=O)N[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 2213567498 MGHNITGJWOLQGJ-QMMMGPOBSA-N 257.271 -0.145 5 10 CBBE CN1CC[C@@H](CN=c2[nH]cncc2[N+](=O)[O-])C1=O 2219826088 LATGOAZYRDSKKR-ZETCQYMHSA-N 251.246 -0.303 5 10 CBBE Nc1ccc(ON2C[C@H](N)CC2=O)nc1[N+](=O)[O-] 2224108801 GTFLMABXYIMWIF-RXMQYKEDSA-N 253.218 -0.575 5 10 CBBE C[C@@H]1CCN[C@H]1C(=O)NCc1nn(C)cc1[N+](=O)[O-] 2231933812 ZWHIVQVFJKSDKO-GMSGAONNSA-N 267.289 -0.058 5 10 CBBE O=[N+]([O-])c1c(Cl)ncnc1N1CC[C@H]1[C@@H](O)CO 2258309481 UTXYWGJXTLKNCK-WDSKDSINSA-N 274.664 -0.030 5 10 CBBE CN1CCN(CCn2ncc([N+](=O)[O-])c2N)CC1 2263640029 WDYJVPPXXKGNBP-UHFFFAOYSA-N 254.294 -0.379 5 10 CBBE C[C@@H](N=c1ccn2ncc([N+](=O)[O-])c2[nH]1)C(N)=O 2263866930 BELVXAUNQSTBTG-RXMQYKEDSA-N 250.218 -0.655 5 10 CBBE Cn1cc([N+](=O)[O-])c(N2C[C@H](O)CC[C@@H]2C(=O)O)n1 2264538011 MUOGQCYDUQMODR-RNFRBKRXSA-N 270.245 -0.257 5 10 CBBE CN=c1nc(N2CC[C@@]3(O)C[C@@H]3C2)c([N+](=O)[O-])c[nH]1 2265253803 BLMBRDBAIYDXEQ-RDDDGLTNSA-N 265.273 -0.191 5 10 CBBE COCc1ncc([N+](=O)[O-])c(OC2(COC)CNC2)n1 2286646056 CSQBJYZXBVMIGY-UHFFFAOYSA-N 284.272 -0.102 5 10 CBBE CCCc1ncc([N+](=O)[O-])c(=N[C@H]2CC(=O)NC2=O)[nH]1 2286684452 ZZXYGKAIKYKULW-LURJTMIESA-N 279.256 -0.414 5 10 CBBE CN(C)C[C@@H](O)CN=c1ccn2ncc([N+](=O)[O-])c2[nH]1 2295879906 ZFXPAZROSWVTBD-QMMMGPOBSA-N 280.288 -0.606 5 10 CBBE O=C(O)[C@@]1(N2CC([N+](=O)[O-])C2)CNC12CCCC2 2323702926 CZBANNMFLWKJCR-NSHDSACASA-N 255.274 -0.313 5 10 CBBE CCN1CCC[C@](C(=O)O)(N2CC([N+](=O)[O-])C2)C1 2323934404 AMGCYTCQOHQNHW-NSHDSACASA-N 257.290 -0.114 5 10 CBBE Cc1cnc(NC[C@H]2NC[C@@H](O)[C@H]2O)cc1[N+](=O)[O-] 2333603689 JVAPLIMXIVQBIV-ZOFUNIGCSA-N 268.273 -0.596 5 10 CBBE Cc1ncc([N+](=O)[O-])c(OCCS(=O)(=O)CCN)n1 2335876718 MVXDIDKAIMATIR-UHFFFAOYSA-N 290.301 -0.554 5 10 CBBE CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CNC[C@H]1F 2343603789 OIGOLBFBMOYUDD-BDAKNGLRSA-N 271.252 -0.440 5 10 CBBE Cn1nc(OC[C@]23CNC[C@H]2COC3)nc1[N+](=O)[O-] 2344955639 RIEQKPBVZLFJIO-OIBJUYFYSA-N 269.261 -0.662 5 10 CBBE Cn1[nH]c(=NC[C@H]2COCC(C)(C)O2)nc1[N+](=O)[O-] 2344967908 JFLZPZAJOZPFDV-ZETCQYMHSA-N 271.277 -0.249 5 10 CBBE Cn1nc(OC[C@H]2CNC3(CC3)CO2)nc1[N+](=O)[O-] 2344968357 OOEKPDYYKLJFEV-SSDOTTSWSA-N 269.261 -0.377 5 10 CBBE COCc1nocc1CN=c1nc([N+](=O)[O-])n(C)[nH]1 2345007781 GGULBJGDSYYWMO-UHFFFAOYSA-N 268.233 -0.108 5 10 CBBE NC(=O)c1ccc(N(CC(=O)O)CC(=O)O)c([N+](=O)[O-])c1 110970709 FZOUFNCQEWZCCM-UHFFFAOYSA-N 297.223 -0.331 5 10 CBBE O=c1[nH]c(=O)n(CCCNC2CC2)cc1[N+](=O)[O-] 111545292 XVCCSOQAWKQYPI-UHFFFAOYSA-N 254.246 -0.413 5 10 CBBE C[N+](C)(C)C[C@@H](CC(=O)O)OC(=O)/C=C\C(=O)O 143711016 QMRSJQVUNCCUCI-PULIVWKDSA-O 260.266 -0.280 5 10 CBBE CN1CCO[C@@H](Cn2cc([N+](=O)[O-])c(C(=O)O)n2)C1 229736521 YKGFXKMULSNDGO-SSDOTTSWSA-N 270.245 -0.180 5 10 CBBE CNC(=O)[C@@H](C)Nc1nc(NN)nc(C)c1[N+](=O)[O-] 234343412 NYARCGWCJXDRIM-RXMQYKEDSA-N 269.265 -0.475 5 10 CBBE CNc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](O)[C@H](O)C2)c1 234515978 LDFBWVQSMYEVBX-PHIMTYICSA-N 281.268 -0.186 5 10 CBBE CNc1cc([N+](=O)[O-])cc(N2C[C@H](O)[C@H](O)C2)n1 234520163 PCVYWCXGKSHGMV-OCAPTIKFSA-N 254.246 -0.427 5 10 CBBE Cc1nc(NN)nc(NC(C)(C)C(N)=O)c1[N+](=O)[O-] 235788024 MQBAULWMDCIYJG-UHFFFAOYSA-N 269.265 -0.345 5 10 CBBE 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