smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCCN(CC(=O)NC)C(=O)c1n[nH]cc1[N+](=O)[O-] 137450873 AJDOAZQFEDDLEO-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD CN(C)C1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 158374851 QAXHHVJPROQZRS-UHFFFAOYSA-N 267.289 -0.046 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H](O)C[C@@H]2CO)n1 185175842 LJWMXKDUIBZBJP-BDAKNGLRSA-N 256.262 -0.781 5 20 CBBD NC(=O)[C@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CCO1 192786589 PHIFPKPMVJQZNQ-SNVBAGLBSA-N 266.257 -0.133 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1Cl 227866031 KYRNZLSUPZYGBO-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 227871578 RVGLEKTUDCEYAA-QMMMGPOBSA-N 253.214 -0.829 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CCO1 267342683 SOJXQSJDJQJPGX-SECBINFHSA-N 294.267 -0.497 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H](C)O 274445662 ICNZBPVPOMUUIK-WKEGUHRASA-N 297.267 -0.171 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2COC[C@H]2O)n1 342403408 FNWNBPUWESCTPX-RKDXNWHRSA-N 284.272 -0.357 5 20 CBBD O=C(O)[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 342557978 DZPVOXKSUVCBRM-LURJTMIESA-N 269.217 -0.738 5 20 CBBD NC(=O)CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 348830678 XGGATJZDVNCKTD-UHFFFAOYSA-N 290.239 -0.609 5 20 CBBD CCn1cc(S(=O)(=O)NCCCN)c([N+](=O)[O-])n1 353270145 ZVRQTZZKXCSCHZ-UHFFFAOYSA-N 277.306 -0.562 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 360602657 XNVZVOOVTCSTFD-QMMMGPOBSA-N 297.267 -0.169 5 20 CBBD O=C1NCCN1CCn1cc([N+](=O)[O-])ccc1=O 361084342 BZNQPMILUJLAIQ-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD O=C(NC[C@@H](O)[C@@H]1CCOC1)c1cnc(O)c([N+](=O)[O-])c1 445008147 PWPUSMRMQVVOFH-GMSGAONNSA-N 297.267 -0.177 5 20 CBBD Cc1noc(CN2CC[C@@H]3OCC(=O)N[C@H]3C2)c1[N+](=O)[O-] 595524238 RBLZGILTSKWSHB-IUCAKERBSA-N 296.283 -0.019 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@]1(C)CO 598447091 HBFDLBBVTYEXCO-GZMMTYOYSA-N 283.288 -0.337 5 20 CBBD Cc1c(CC(=O)NC[C@H](O)C(N)=O)cccc1[N+](=O)[O-] 619566050 WBJDQUFIDNPWCS-JTQLQIEISA-N 281.268 -0.592 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC1CN(C(=O)O)C1 831222992 UHSRJHRHJZALRJ-UHFFFAOYSA-N 281.228 -0.137 5 20 CBBD CN(C)C(=O)OCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 855646495 RYNAQERISLYLRB-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnco1 973255033 SVJLQOHHDJHDGF-FNCVBFRFSA-N 294.267 -0.283 5 20 CBBD Cc1ncoc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936633 NHCLTXMAZBTDDA-RKDXNWHRSA-N 268.273 -0.146 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]1(C)CCOC1=O 1261223623 CADINTDXBIPKJY-JTQLQIEISA-N 268.229 -0.236 5 20 CBBD COC[C@H](O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1326062082 CQMHFDCOPZAVQZ-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD O=C(NC[C@@H](O)CN1CCCC1=O)c1ccc([N+](=O)[O-])o1 1334171080 GMCFITVHNKEBEP-MRVPVSSYSA-N 297.267 -0.099 5 20 CBBD N[C@H](CO)C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F 1574262891 RPGDJEYNUBDPTN-MRVPVSSYSA-N 275.211 -0.191 5 20 CBBD NC(=O)c1ccnc(N2CC3(CCNC3)C2)c1[N+](=O)[O-] 1580106789 GMLIKTLKAWKKQH-UHFFFAOYSA-N 277.284 -0.112 5 20 CBBD O=[N+]([O-])c1cnn(-c2cc(-c3nn[nH]n3)ncn2)c1 1593487376 KOLMVVCSAGKFOC-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)N2CC(O)(C(=O)O)C2)c1 1607291804 LKXFSKUXOCLZSA-UHFFFAOYSA-N 296.235 -0.125 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@H](O)C[C@@H](C(=O)O)C1 1608158701 CQGBPKWPMPFROK-RNFRBKRXSA-N 298.255 -0.764 5 20 CBBD C[C@H](CN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1609741246 FKSRTJKYYSWHBO-MRVPVSSYSA-N 297.267 -0.064 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCNCC1 43403913 RESWYZOHJZDZKD-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD NC(=O)c1cnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)s1 193153904 YVIXBBKHXDNJEP-UHFFFAOYSA-N 296.268 -0.015 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2CC[C@@H](O)C2)c1 227691069 PKTZYNWMZWIIKH-MVWJERBFSA-N 284.316 -0.097 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCO1 273243255 QMZOTWUORHLPBS-JTQLQIEISA-N 295.251 -0.373 5 20 CBBD COC(=O)c1cnc(NCC(=O)NCCO)c([N+](=O)[O-])c1 276857860 YRDWENONMDLZJS-UHFFFAOYSA-N 298.255 -0.703 5 20 CBBD COCCN1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 332700085 WUAQPSGREYJEQT-UHFFFAOYSA-N 297.271 -0.783 5 20 CBBD NC[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 428519720 CXUMCCMHAVHINQ-MRVPVSSYSA-N 268.277 -0.474 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 525241251 BJTLSKGFAOYBRR-UHFFFAOYSA-N 295.251 -0.029 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2C[C@H](O)C2)c1 596067400 MDDMCLFZYYKAAL-SZEHBUNVSA-N 256.262 -0.735 5 20 CBBD CC(C)[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 598569866 FRUGVSHZTRVSHV-VIFPVBQESA-N 282.304 -0.357 5 20 CBBD C[C@@H](CO)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 611019427 MSGIJUVZLJODSQ-SSDOTTSWSA-N 275.286 -0.104 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 863709979 TWNOIOQTZUCJHC-RXMQYKEDSA-N 271.233 -0.544 5 20 CBBD CNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])nc1C 1317998373 FFCKCWQHQCQXCR-UHFFFAOYSA-N 269.261 -0.648 5 20 CBBD Cc1nc(CCNC(=O)c2c([N+](=O)[O-])cnn2C)n[nH]1 1319723971 QMFVZCPGBMTMDQ-UHFFFAOYSA-N 279.260 -0.273 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H]2C[C@]2(CO)C1 1320882363 SXMZCTGAFWPCIH-QUBYGPBYSA-N 252.230 -0.228 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCn2cnnc2C1 1321244822 WGVPUNKMOAUOCZ-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD COC1(CO)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1332914154 CMWBZTCVVLUBOK-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD NC[C@H](O)C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 1580325785 NWEWTOYMVYUBAJ-NSHDSACASA-N 281.268 -0.496 5 20 CBBD CC(C)C[C@@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1591179081 ZEQVORCLRXXAOF-SSDOTTSWSA-N 285.260 -0.198 5 20 CBBD CN(CC(=O)O)C(=O)c1cnc(N)c([N+](=O)[O-])c1 1593720738 BUYQMIVJHCZGRZ-UHFFFAOYSA-N 254.202 -0.271 5 20 CBBD CCC[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 179385180 YZSASNYNRNIYAE-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD CN(C(=O)CN1C[C@@H](O)[C@H](O)C1)c1ccc([N+](=O)[O-])cc1 278693878 JJASNJAWWIWECK-VXGBXAGGSA-N 295.295 -0.405 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 341735585 KAJREKRQJANWKS-MRVPVSSYSA-N 292.251 -0.348 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC(C)(CO)CO 346462838 UHZGHHCTRUSDLS-UHFFFAOYSA-N 286.288 -0.651 5 20 CBBD COc1ccnc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 424936049 JGEOWRSLNTXQGR-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCN 428499045 VFFHHDSUVSXANR-UHFFFAOYSA-N 255.278 -0.045 5 20 CBBD CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCNC1 429108906 IVWIKAHBADYSEA-SECBINFHSA-N 282.304 -0.213 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1OC 490248971 LKEZAVNFXXWXAD-HTQZYQBOSA-N 285.260 -0.942 5 20 CBBD CNC(=O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 492846218 HKLOQMFLXBQMDK-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD O=C(O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 535496634 FFGOEISPVYEYMH-UHFFFAOYSA-N 261.215 -0.647 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 594300527 AZRGKKFYTIYJFQ-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD NCCN(Cc1ccccc1[N+](=O)[O-])C[C@@H](O)CO 595902181 LCWZQDZSJJJNSP-LLVKDONJSA-N 269.301 -0.291 5 20 CBBD O=C(N[C@H]1C[C@H](O)C1)c1cc([N+](=O)[O-])cnc1O 598779473 IMGDGHFQNYGKOU-KBTIHESUSA-N 253.214 -0.052 5 20 CBBD CC(C)OC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 729383564 HILGZJHDLSDQHN-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD CNC(=O)NC(=O)[C@H](C)OC(=O)c1nn(C)cc1[N+](=O)[O-] 772056297 GEANZNLZQNKGEE-YFKPBYRVSA-N 299.243 -0.671 5 20 CBBD O=C(OCCN1CCOCC1=O)c1ccc([N+](=O)[O-])[nH]1 785309870 ILEPPFOSTLYATE-UHFFFAOYSA-N 283.240 -0.062 5 20 CBBD CON(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 817667454 RKXGMDNSFNHBAI-UHFFFAOYSA-N 282.256 -0.073 5 20 CBBD O=C(CS(=O)(=O)C1CC1)OCCC[N+](=O)[O-] 860918558 ANJRWHFVPKTXRW-UHFFFAOYSA-N 251.260 -0.226 5 20 CBBD CC(=O)NC[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 979364633 KNZHACAHHUFVDJ-ZYUZMQFOSA-N 255.274 -0.318 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCCN(CCO)CC1 981138162 NQNPRFGKWHJPQX-NXEZZACHSA-N 257.290 -0.822 5 20 CBBD Cn1cc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1157767407 LZPZCHDRXLWITP-NXEZZACHSA-N 282.304 -0.924 5 20 CBBD Cc1[nH]nc(C(=O)NCCn2cnnc2C)c1[N+](=O)[O-] 1319295379 FZMLFNWVKXBDGU-UHFFFAOYSA-N 279.260 -0.044 5 20 CBBD COCCOCCNC(=O)c1c([N+](=O)[O-])cnn1C 1320417642 MDCWCUNZOREAHG-UHFFFAOYSA-N 272.261 -0.279 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)NCCF 1325190746 WTJDFTIKUSFFON-YFKPBYRVSA-N 273.224 -0.478 5 20 CBBD CNC(=O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 25198057 PEAMUGUMODBWAD-UHFFFAOYSA-N 267.241 -0.164 5 20 CBBD NC(=O)NC(=O)CNc1cc([N+](=O)[O-])ccc1NCCO 30493178 ILBHDBVMODKDHY-UHFFFAOYSA-N 297.271 -0.394 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCCO1 55845197 JGSYAPYWMGXRIO-SECBINFHSA-N 270.245 -0.677 5 20 CBBD O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1C[C@H](O)CN1 262471594 ZCNZSNXHUXZASZ-WDEREUQCSA-N 279.296 -0.024 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCN(CC(N)=O)CC1 264491330 SPPKAJDYNWWUCM-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD COc1ccc(CNC(=O)[C@H]2C[C@@H](O)CN2)cc1[N+](=O)[O-] 269256156 PBHCMYDEPHYRQS-NXEZZACHSA-N 295.295 -0.058 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N(C)C[C@H](O)CO 280652589 FSJISMBUHUHBRN-QMMMGPOBSA-N 258.278 -0.091 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 281860093 QROZKXSZCFPTPL-RXMQYKEDSA-N 256.218 -0.049 5 20 CBBD O=C(NCC(F)(F)CO)c1cc([N+](=O)[O-])[nH]n1 285954784 CSBNAJKFYBQLCA-UHFFFAOYSA-N 250.161 -0.325 5 20 CBBD C[C@@](O)(CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 338620518 JVIDGTKRZYCYPX-JTQLQIEISA-N 270.245 -0.955 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2nnn(C)n2)c1=O 340047260 AMIHSWBEFPAOLL-UHFFFAOYSA-N 294.227 -0.885 5 20 CBBD CO[C@H]1C[C@H](CO)N(Cc2c([N+](=O)[O-])ncn2C)C1 344894729 FIYSZSYWMJSWRF-BDAKNGLRSA-N 270.289 -0.090 5 20 CBBD O=C1[C@@H]2COCCN2C(=O)N1CCn1cc([N+](=O)[O-])cn1 348875676 ADYAFZGKDXKUOZ-VIFPVBQESA-N 295.255 -0.546 5 20 CBBD CNC(=O)CCCN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 354249952 BYDOYVKUIPZQDN-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD CNC(=O)c1ccc(N2C[C@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 355549355 VSLFCWCPFBKVSV-NXEZZACHSA-N 295.295 -0.114 5 20 CBBD CN(C)C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CCO1 356208534 DYZADRBFANCGIF-SECBINFHSA-N 297.315 -0.269 5 20 CBBD COC[C@H](CO)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 357708176 OFSAHQZUAVBNLD-QMMMGPOBSA-N 286.288 -0.350 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC(O)(C(F)F)C1 425022419 XFTSXDPPOQVKEE-UHFFFAOYSA-N 262.172 -0.230 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@H](CO)[C@@H](O)C1 546693806 RNUWGOPCRAZIKD-XCBNKYQSSA-N 297.267 -0.489 5 20 CBBD CN(Cc1nnnn1C)c1nccc(C(=O)O)c1[N+](=O)[O-] 576402698 LDVTZIRSSYLXHO-UHFFFAOYSA-N 293.243 -0.152 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC[S@]1=O 581833794 XCFFYEBKTDJXCT-JKNYTWMOSA-N 298.324 0.165 5 20 CBBD CNc1c(C(=O)NC[C@H](O)C(N)=O)cccc1[N+](=O)[O-] 597586774 PWILKZWJAMQYHA-QMMMGPOBSA-N 282.256 -0.788 5 20 CBBD COC(=O)c1cnc(N2C[C@@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 598630582 ZPWFRCLWVMZDEF-WPRPVWTQSA-N 297.267 -0.434 5 20 CBBD O=C1[C@@H]2C[C@H]2C(=O)N1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 611165794 QHUZKJPNXXPYFM-DJLDLDEBSA-N 280.240 -0.843 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1COCCO1 761383797 HUONNOOTOKCMLK-JTQLQIEISA-N 298.251 -0.285 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])cn1 833291500 WPCNNXOUOGECCR-BDAKNGLRSA-N 270.245 -0.689 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)[C@@H]1C[C@H]1[N+](=O)[O-] 839605124 JCZRKHNBUPKMLK-LNFKQOIKSA-N 269.301 -0.369 5 20 CBBD C[C@H](COC(=O)[C@H]1CC(=O)N(c2cnn(C)c2)C1)[N+](=O)[O-] 860777714 UDAFNYVAHUUWDY-BDAKNGLRSA-N 296.283 -0.019 5 20 CBBD CSCC(=O)N1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954234817 LIPKWCLOPHSAEE-RKDXNWHRSA-N 287.341 -0.316 5 20 CBBD CCOCC(=O)NCCCNc1ncc([N+](=O)[O-])c(N)n1 1094291689 NXYJDACANNEESJ-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD CNC[C@@H](C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 1261492241 WDSOPMOULARPHK-SSDOTTSWSA-N 256.266 -0.842 5 20 CBBD O=C(NC1CCS(=O)(=O)CC1)c1cc([N+](=O)[O-])n[nH]1 1321872696 KNZFVCKKYUQYHI-UHFFFAOYSA-N 288.285 -0.375 5 20 CBBD NC(=O)C[C@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 1324141730 NBKJLHYCLBNFQS-SNVBAGLBSA-N 294.311 -0.046 5 20 CBBD O=C(O)c1c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc2n1CCOC2 1595205879 PAJJBCOEWLTXNK-PHDIDXHHSA-N 296.239 -0.285 5 20 CBBD O=C(O)[C@H]1CNCCCN1CCn1cc([N+](=O)[O-])cn1 1601852541 LCRASPOPFIWTAL-SNVBAGLBSA-N 283.288 -0.460 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)N1CCCC1 48682870 OXZCDWKDLPAFLJ-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 110515978 TUOACWNYYKYKBC-LURJTMIESA-N 252.230 -0.117 5 20 CBBD O=C(NC[C@@H]1CNCCO1)c1ccc([N+](=O)[O-])o1 134257588 QMYAQZUYQNFIHF-ZETCQYMHSA-N 255.230 -0.094 5 20 CBBD Cn1cc(CCNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 149015752 YEYAMWXHHXRTML-LBPRGKRZSA-N 294.315 -0.282 5 20 CBBD NC(=O)[C@@]1(O)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1 277108984 XSLXWGYGAWVLAM-LLVKDONJSA-N 293.239 -0.443 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1CCOC1 339401090 JGOBHYXARKIOJU-SECBINFHSA-N 281.268 -0.091 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H](O)C(F)F)c1[N+](=O)[O-] 355140104 UKROMMZTZYFZSY-BYPYZUCNSA-N 264.188 -0.018 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])nn2C)C1 360842331 WDOGQGQFTYQLSL-NSHDSACASA-N 283.288 -0.875 5 20 CBBD Nc1nccc(C(=O)NCC(=O)NC2CC2)c1[N+](=O)[O-] 548713674 ZUSYBWOLCAJOLS-UHFFFAOYSA-N 279.256 -0.420 5 20 CBBD CN1CCC(ONC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 773550819 GGHXTSIGNWJNDI-UHFFFAOYSA-N 283.288 -0.067 5 20 CBBD C[C@@H](COC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)[N+](=O)[O-] 860777208 MJLNUQQKQOPFSK-IUCAKERBSA-N 294.329 -0.134 5 20 CBBD COC(=O)CCN1CCN(CC[N+](=O)[O-])[C@@H](C)C1 930237752 WHLRJRZOQOOTLE-JTQLQIEISA-N 259.306 -0.168 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2ccc[nH]2)C1 954234404 AUFHSUSDJZEKIS-MWLCHTKSSA-N 292.295 -0.037 5 20 CBBD O=C(NCCCNCc1ncccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767831 WRDKASAUXJAMQG-NXEZZACHSA-N 279.300 -0.262 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCCNC1 1332412426 CXZFQDZEQJVUIS-SECBINFHSA-N 280.284 -0.375 5 20 CBBD CN1CCN(Cc2cn(C)nc2[N+](=O)[O-])C[C@H](C(=O)O)C1 1606244478 JIVKZUCAAYREFX-SNVBAGLBSA-N 297.315 -0.224 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 45302386 ZSWOPBZJGMWIAP-LURJTMIESA-N 272.213 -0.158 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1ccccc1[N+](=O)[O-] 45744680 SZHABPKBFAOTOV-UHFFFAOYSA-N 273.270 -0.299 5 20 CBBD CC1(C)COCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 49377671 HHUQVRAFFVCFHP-UHFFFAOYSA-N 269.261 -0.176 5 20 CBBD CN1C[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 164469040 YZMOJOBJGKVYQS-MRVPVSSYSA-N 281.272 -0.614 5 20 CBBD Cn1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cn1 166562998 BYXBFYKYJKIGKF-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD CNC(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-] 284652595 DHZHKMXJOLCBPY-UHFFFAOYSA-N 266.257 -0.131 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1ncnn1C 285539182 BSKQIBOOBVQKDX-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD NC(=O)[C@@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 311239539 YEUKJNXKOCHAKD-ZCFIWIBFSA-N 251.246 -0.116 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC(=O)NC1CC1 338636854 KMAHTYQBTSTXOT-UHFFFAOYSA-N 280.240 -0.255 5 20 CBBD O=C(N[C@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])n[nH]1 353375628 STZZISMMAHJTCS-IEMIWKFJSA-N 258.259 -0.431 5 20 CBBD Cn1nnc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)n1 362944631 OEBWGNUCKFDTRK-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD Cc1nccn1CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 386388677 SYHXQEOTHJRMSB-GFCCVEGCSA-N 294.315 -0.053 5 20 CBBD COC[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 548942608 BJHUOXMNHSSFHN-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD O=C(NC[C@H]1CNCCO1)c1cc([N+](=O)[O-])cnc1O 565891022 GLFGGWIEOPSWSX-MRVPVSSYSA-N 282.256 -0.586 5 20 CBBD CNc1nccc(C(=O)N[C@@]2(CO)CCOC2)c1[N+](=O)[O-] 578203839 AGCLDMLSZWCKTM-GFCCVEGCSA-N 296.283 -0.087 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H](CCO)C(F)F)c1 578651921 PSGNGLYKWNIPGG-BDAKNGLRSA-N 294.258 -0.242 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 584352844 CNLMJHMQYQHIBO-RNFRBKRXSA-N 256.218 -0.539 5 20 CBBD C[C@H](O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594345372 PGIHDSRSMLJFOW-LURJTMIESA-N 254.246 0.073 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1=O 610125335 JJFUQMCVKMRZJZ-UHFFFAOYSA-N 266.257 -0.153 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc(CC(=O)O)n[nH]1 739038527 JGHDCSLGNGKHCV-UHFFFAOYSA-N 294.227 -0.069 5 20 CBBD COCCC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 761947277 KSKXTYRWWJRVQU-UHFFFAOYSA-N 298.251 -0.095 5 20 CBBD O=[N+]([O-])c1cc(S(=O)(=O)N[C@@H]2COC[C@H]2O)cs1 832462611 HEPMWASMKPJHOD-RNFRBKRXSA-N 294.310 -0.306 5 20 CBBD NC(=O)C(=O)NC[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1 1091512381 PATCHHZOGOIIDQ-ZKCHVHJHSA-N 293.283 -0.218 5 20 CBBD O=C(NCCN1C(=O)CSC1=O)c1n[nH]cc1[N+](=O)[O-] 1116415329 PVHUZLUGFUFMBC-UHFFFAOYSA-N 299.268 -0.257 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nncn1C 1116456689 QWOOJSGSSBAJAD-UHFFFAOYSA-N 280.244 -0.028 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CN(C)CCN2C)c1[N+](=O)[O-] 1321717857 HIKGMOIRUNNGAD-SECBINFHSA-N 296.331 -0.398 5 20 CBBD CN(C)CC[C@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1331470769 TWUWDLKGZSHMDG-LBPRGKRZSA-N 299.331 -0.239 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)C(=O)O 1593541673 IXUILLSBHMULEY-YFKPBYRVSA-N 271.185 -0.623 5 20 CBBD Cc1nn(C)c(N2CCO[C@H](C(N)=O)C2)c1[N+](=O)[O-] 50955824 QKXSTXAJQPSNIW-ZETCQYMHSA-N 269.261 -0.673 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC[C@H]1C 125203387 SUQFBNAAPWTEHE-MRVPVSSYSA-N 267.289 -0.080 5 20 CBBD Cn1nnnc1SC[C@H](O)Cn1cc([N+](=O)[O-])cn1 174672935 KZNPNLJYMCGUIH-SSDOTTSWSA-N 285.289 -0.532 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCNC1CC1 178794965 KIRNEDFIUFAZEP-UHFFFAOYSA-N 253.262 -0.341 5 20 CBBD CO[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 263029528 BYPBWCDSLCXVKB-QMMMGPOBSA-N 286.244 -0.603 5 20 CBBD COC(=O)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 267833539 RRVCMGNAWPMLNS-JTQLQIEISA-N 282.256 -0.141 5 20 CBBD C[C@H](O)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 270861937 RWHQJVSHYWGKDD-QMMMGPOBSA-N 296.283 -0.412 5 20 CBBD CC[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285390748 NXUDOUTVTSRIBF-VIFPVBQESA-N 297.315 -0.153 5 20 CBBD CC(C)OC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 312709111 OTYQGQYXWNJHNJ-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD CSCC[C@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 353768021 ORNYQACVXIWCKQ-VIFPVBQESA-N 287.345 -0.012 5 20 CBBD CN(CCC(N)=O)C(=O)c1cc([N+](=O)[O-])cnc1O 359964625 RPFIFPVHEZVRMH-UHFFFAOYSA-N 268.229 -0.357 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1CO 362089706 JUQJNGNJBWVYKM-FOGDFJRCSA-N 284.316 -0.288 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C(F)F 426953731 KRGLJUTZWZZGLW-SSDOTTSWSA-N 293.230 -0.284 5 20 CBBD NC(=O)c1ccnc(N[C@H]2C[C@H](C(N)=O)C2)c1[N+](=O)[O-] 599145652 YDEIZJNGFGNXTN-IZLXSQMJSA-N 279.256 -0.236 5 20 CBBD C[C@@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CNC(=O)C1 802197322 IPUBWARWRKMICQ-NSHDSACASA-N 282.256 -0.139 5 20 CBBD CN(C)C(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1116414799 UXIZCVNCBXPQRF-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C1[C@@H]2CNC[C@@H]12 1515553677 LNJWTNCNGMMAKX-RKDXNWHRSA-N 279.300 -0.224 5 20 CBBD CN(C[C@H]1CCN1)C(=O)Cn1cc([N+](=O)[O-])cn1 1578453402 MOMQCCQSGJMLQF-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccc(-c2nn[nH]n2)nc1 1604649879 ZYZLULQCBWMBBU-VXNVDRBHSA-N 289.255 -0.110 5 20 CBBD CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H](C)C(=O)O 1605298215 NSWZYZGAKAJWNH-SSDOTTSWSA-N 285.260 -0.102 5 20 CBBD CO[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C(=O)O)C1 1606751754 ZNIPMBZFZIJGCJ-BGZDPUMWSA-N 272.257 -0.258 5 20 CBBD CCC(CC)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 161828947 DZTVKFWCGYWEGA-UHFFFAOYSA-N 283.288 -0.048 5 20 CBBD CNC(=O)CCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173636123 QSHTUNCFQMOPQU-JTQLQIEISA-N 285.304 -0.780 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274985105 QKVXFJZCKSVQRD-GFCCVEGCSA-N 298.299 -0.262 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 275217986 QPXBVBJMRTWSBR-SSDOTTSWSA-N 283.240 -0.559 5 20 CBBD Nc1nc(NCCCn2cc(CO)nn2)ncc1[N+](=O)[O-] 290940613 BTKCTBLOMSEZJO-UHFFFAOYSA-N 294.275 -0.447 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCC(=O)N1 345554087 DUXYFOLPMJRAPN-QMMMGPOBSA-N 281.272 -0.424 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)N1CCOCC1 351598344 JIAZLLASDLBNLU-SSDOTTSWSA-N 297.271 -0.705 5 20 CBBD NC(=O)c1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)co1 353097449 SWYKYCNXUDTYEG-UHFFFAOYSA-N 293.239 -0.087 5 20 CBBD CCNC(=O)NC(=O)Cn1cc([N+](=O)[O-])cc(F)c1=O 515060082 VBGNSJDMHHSSKC-UHFFFAOYSA-N 286.219 -0.259 5 20 CBBD Nc1nccc(C(=O)NC[C@H](O)C2CC2)c1[N+](=O)[O-] 548712909 LNNXLNPFJCFMOY-QMMMGPOBSA-N 266.257 0.073 5 20 CBBD CNc1nccc(C(=O)NC(COC)COC)c1[N+](=O)[O-] 572974150 MZZSJOYDJNPSHD-UHFFFAOYSA-N 298.299 0.423 5 20 CBBD CN1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1(C)C 574097514 ADTGIPAXKNADGJ-UHFFFAOYSA-N 282.304 -0.261 5 20 CBBD O=C(NCC[C@]1(O)CCCOC1)c1n[nH]cc1[N+](=O)[O-] 593881535 JCSIHSXYWZIIKS-LLVKDONJSA-N 284.272 -0.021 5 20 CBBD N[C@@H]1C[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])o3)CCN2C1=O 594873897 QOMRCZFUNIBJMN-HTQZYQBOSA-N 294.267 -0.428 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCN1CC[C@@H](O)C1 600530149 AXPKQVFGTRVKNM-LLVKDONJSA-N 297.315 -0.636 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)C[C@H]1CO 698122680 INNPDIKVUDCJSW-IUCAKERBSA-N 269.257 -0.499 5 20 CBBD Cn1c(C(=O)OCCN2CCOCC2=O)ccc1[N+](=O)[O-] 785298609 XXGKDVCPDNBHTN-UHFFFAOYSA-N 297.267 -0.051 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C[C@@H]2CCOC2)CC1 839702496 XICYSMDIZUPVRF-QJPTWQEYSA-N 283.328 -0.168 5 20 CBBD Cn1cc(C(=O)NCCNc2ncccc2[N+](=O)[O-])nn1 1093604490 GGYULACFAGOVHF-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD CN(CCNC(=O)c1cnn[nH]1)c1ncccc1[N+](=O)[O-] 1100400933 VRTQLPIHSGCCAF-UHFFFAOYSA-N 291.271 -0.026 5 20 CBBD C[C@H](N)[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261492165 SQKJFHHVHARPKG-IUCAKERBSA-N 282.304 -0.228 5 20 CBBD O=C(O)Cc1noc(Cn2ccc([N+](=O)[O-])n2)n1 1595140636 WZZLKHFYYPVPJS-UHFFFAOYSA-N 253.174 -0.150 5 20 CBBD O=C(O)CCc1nc(Cn2cnc([N+](=O)[O-])n2)no1 1602048175 GTIXCPMPIRVBLZ-UHFFFAOYSA-N 268.189 -0.365 5 20 CBBD O=C1CN(C(=O)CNc2ccccc2[N+](=O)[O-])CCN1 49423227 GIWMWGUTXHNBGI-UHFFFAOYSA-N 278.268 -0.035 5 20 CBBD C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 50418263 JTDRYWUTPHKJOV-WCBMZHEXSA-N 295.303 -0.369 5 20 CBBD CCN(C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 194689772 JHCXKIFAOGNQKO-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1cccc([N+](=O)[O-])c1 265037990 YFXPXVOXTSTNDE-UHFFFAOYSA-N 292.251 -0.124 5 20 CBBD CNC(=O)C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 285407983 ZWHUOEHYWMDLGQ-UHFFFAOYSA-N 267.241 -0.034 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 312299015 UCVKKLGYOHXBNX-NWPZZWLHSA-N 279.252 -0.430 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@@H](CO)[C@@H](O)C2)n1 316920432 VJHRVYLALHTHSH-RCOVLWMOSA-N 283.240 -0.523 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@]1(O)CCO[C@@H]1C 331320632 BVFRGUCBMIFABZ-PELKAZGASA-N 298.299 -0.244 5 20 CBBD Cn1c(C(=O)N[C@@]2(CO)CCOC2)ccc1[N+](=O)[O-] 348228557 RVDGUUVAXLMOAD-LLVKDONJSA-N 269.257 -0.186 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1(CCO)CC1 349250879 VXNYURBFWBGUAH-UHFFFAOYSA-N 281.268 -0.212 5 20 CBBD COC(=O)C1(O)CCN(c2c([N+](=O)[O-])ncn2C)CC1 354724652 HYWSKPCITLMXAH-UHFFFAOYSA-N 284.272 -0.167 5 20 CBBD Cn1nncc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 360692450 ABVBJSLPYJIKAN-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCN(S(C)(=O)=O)C1 400181341 AGGFYCIYJYXOFD-SSDOTTSWSA-N 289.317 -0.226 5 20 CBBD CN1CCC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 517962025 YBVGTYXULDVHSR-QMMMGPOBSA-N 293.283 -0.077 5 20 CBBD CC(C)c1[nH]nc(C(=O)NC[C@H](O)C(=O)O)c1[N+](=O)[O-] 833508276 BHTNCYIXXVAHBX-YFKPBYRVSA-N 286.244 -0.383 5 20 CBBD C[C@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839729749 DNXSOASMPMWLQW-HBNTYKKESA-N 285.344 -0.045 5 20 CBBD CC[C@H](OC(=O)c1ccnc(N)c1[N+](=O)[O-])C(N)=O 848786868 KLAMLBPIZTUUQZ-LURJTMIESA-N 268.229 -0.007 5 20 CBBD Cc1nn(C)c(C(=O)N2CCS(=O)CC2)c1[N+](=O)[O-] 1116009894 YMULMRAUPVKFEE-UHFFFAOYSA-N 286.313 -0.159 5 20 CBBD CC(=O)NCCN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1118274940 KFQFICLQTCBZPE-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1 1251155893 JTKRFBGYTYTFLP-SSDOTTSWSA-N 288.285 -0.905 5 20 CBBD COCCC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1319337392 POLZESBUQNDBPB-UHFFFAOYSA-N 283.240 -0.539 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H]2COCCO2)c1[N+](=O)[O-] 1337778923 HLONAFBAVNGXTD-QMMMGPOBSA-N 284.272 -0.218 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1[C@@H]2CNC[C@@H]21 1578387554 NNOZACOWUCXNOE-BDINMYNLSA-N 251.246 -0.392 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@H]2COC[C@@]2(C(=O)O)C1 1595279124 LXORIDKCIRHVKJ-KGFZYKRKSA-N 296.239 -0.509 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](O)C[C@@H]1C(=O)O 1600720777 YTZUTXYQFCSWGK-HTQZYQBOSA-N 298.255 -0.854 5 20 CBBD O=[N+]([O-])c1ccc(N[C@@H]2COC[C@H]2O)cc1-c1nn[nH]n1 1607081517 CEMMVCYVPOEBER-PSASIEDQSA-N 292.255 -0.054 5 20 CBBD CC(=O)NCCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 31243001 XKOILNSTRQMPRD-UHFFFAOYSA-N 282.256 -0.461 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 81440757 WBUXGOURFZIMTE-QMMMGPOBSA-N 297.315 -0.060 5 20 CBBD CC(C)(C(=O)NS(C)(=O)=O)n1cc([N+](=O)[O-])cn1 102594716 ORPLHQRTSZJUPA-UHFFFAOYSA-N 276.274 -0.398 5 20 CBBD CCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 189696746 YBSREMMHOHGKPG-UHFFFAOYSA-N 255.234 -0.875 5 20 CBBD Cc1nn(C)c(C(=O)NCCN2CCOCC2)c1[N+](=O)[O-] 196767447 YRJWNFXUTPIABA-UHFFFAOYSA-N 297.315 -0.301 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@@H](O)C[C@H]1CO 274851691 YJGKOJNTYXWYNO-QWRGUYRKSA-N 296.279 -0.072 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 286349720 ZESQKMJVNDOULZ-SNVBAGLBSA-N 272.261 -0.165 5 20 CBBD CC(C)[C@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 289472255 ZCLQSGFDRKNHDB-PWSUYJOCSA-N 299.331 -0.358 5 20 CBBD CC(=O)NC1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1 331439894 CQYJLOZSPHBRQC-UHFFFAOYSA-N 281.272 -0.403 5 20 CBBD CC[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)O 386757089 HRTVMCKIUMLTGI-IEBDPFPHSA-N 272.305 -0.099 5 20 CBBD COC[C@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 394602078 DIOHIXHNNJYWCM-SNVBAGLBSA-N 272.261 -0.695 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H](C)C1=O 426397781 URRXLJKYBGAMFF-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD CNC[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 429521313 ZHFKLQSVWBKNSR-MRVPVSSYSA-N 268.277 -0.603 5 20 CBBD COC[C@@](C)(O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 522116320 AZLQHGRVPMRGFB-NSHDSACASA-N 284.272 -0.102 5 20 CBBD CCc1nncn1CCNC(=O)c1cc([N+](=O)[O-])nn1C 547842241 LQFKIQJFKTYKNC-UHFFFAOYSA-N 293.287 -0.088 5 20 CBBD CCN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCNC1=O 555317573 QHBXNOVATUOPTC-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD CC[C@H](O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 572974356 SQKZKSTVECTUDC-ZETCQYMHSA-N 268.273 0.532 5 20 CBBD CNC[C@@H](C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 595268617 IKUKQBZDLVBVOG-MRVPVSSYSA-N 270.293 -0.302 5 20 CBBD COc1ccc(NC(=O)C2(O)CNC2)cc1[N+](=O)[O-] 595950189 CCHFTAPRZLXHFM-UHFFFAOYSA-N 267.241 -0.124 5 20 CBBD CN(CCO)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 596050327 FVTOQAXGNDAGET-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CC[C@@H](O)C2)c1[N+](=O)[O-] 600536668 VALVALKRCBRICH-MRVPVSSYSA-N 283.288 -0.577 5 20 CBBD Cc1nonc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 735820030 BSZUUHHOCSWTIV-UHFFFAOYSA-N 266.217 -0.201 5 20 CBBD CN1C(=O)CC[C@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 752033248 YETHRHISFZMDCJ-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD CN1CC[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)C1=O 772525251 YAEKAUBQUOIZOL-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD C[C@H]1CN(C)C(=O)CN1CCn1ccc([N+](=O)[O-])n1 782583878 MECJMIXIDGTOMY-VIFPVBQESA-N 267.289 -0.046 5 20 CBBD O=C1N[C@H]2CN(C(=O)c3c[nH]nc3[N+](=O)[O-])CC[C@@H]2CO1 844122038 VMQFPYGIZBRWOO-SVRRBLITSA-N 295.255 -0.112 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCc2nn(C)c(=O)cc2C1 892735583 KHBFJJUKZURPCO-UHFFFAOYSA-N 290.283 -0.015 5 20 CBBD C[C@H]1C[C@H](NCC[N+](=O)[O-])C(=O)N1c1cnn(C)c1 905146921 SWBMKHFKJYEZIX-WPRPVWTQSA-N 267.289 -0.220 5 20 CBBD Cn1cc([C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCN2)cn1 913456559 LVQSHODCIVBVLN-GMTAPVOTSA-N 279.300 -0.442 5 20 CBBD O=C(NC1CN(C(=O)c2cnns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991278501 HZLSQRPXPRGCFI-RNFRBKRXSA-N 297.296 -0.856 5 20 CBBD Cc1nc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 1020140093 YGYANWGICFLMTD-ZYUZMQFOSA-N 294.315 -0.485 5 20 CBBD CCC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1070114399 OCLKEIBCHQTHBO-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD CN(CCNC(=O)CNC(N)=O)c1ccc([N+](=O)[O-])cc1 1099910406 AHUKCZUBNNXRCV-UHFFFAOYSA-N 295.299 -0.185 5 20 CBBD COCCO[C@H]1C[C@H](CO)CN(CC[N+](=O)[O-])C1 1119855043 LYELNJURTPXHHN-QWRGUYRKSA-N 262.306 -0.391 5 20 CBBD CN(C)C(=O)CCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1324094602 BXDXXEJVTHKTNZ-UHFFFAOYSA-N 284.276 -0.829 5 20 CBBD C[C@H](CC(=O)O)NC(=O)c1c([N+](=O)[O-])cnn1C 1330746398 VMTCMVUJWVMPMX-RXMQYKEDSA-N 256.218 -0.079 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C(=O)O)C1 1594586073 IZYJJMZXPYTBMJ-UHFFFAOYSA-N 254.202 -0.515 5 20 CBBD C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)C(=O)O 1609794357 FCYVNPPFGQXDGD-YFKPBYRVSA-N 271.185 -0.623 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1610731778 AOSHLRVEYXRTHM-XCBNKYQSSA-N 298.255 -0.772 5 20 CBBD O=C(O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 37435133 QPWLEQQJVJETHT-QMMMGPOBSA-N 268.229 -0.133 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1csc([N+](=O)[O-])c1 51208155 UGPIJRFHJDQPST-UHFFFAOYSA-N 293.326 -0.065 5 20 CBBD CN(CC(N)=O)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 64628765 UTQSZKGZYQKCOG-UHFFFAOYSA-N 292.295 -0.099 5 20 CBBD NC(=O)[C@@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O 90512373 QAEODKDVMRYNRV-JTQLQIEISA-N 280.284 -0.294 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CCOCC1 90623726 DKBOXFVPAOJJTJ-UHFFFAOYSA-N 282.300 -0.005 5 20 CBBD O=C1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CCN1 183590096 CBSLYACXJWFGBB-UHFFFAOYSA-N 265.229 -0.047 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1C(=O)NCC[C@@H]1C 194333019 AQIUOFCYKKZQGE-CPCISQLKSA-N 295.299 -0.259 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@@H](O)C1 236559814 GWEIQNLJAZQSAU-QWRGUYRKSA-N 282.252 -0.462 5 20 CBBD C[C@@H](O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 275868793 VFXYJINGBLKIFJ-MRVPVSSYSA-N 282.304 -0.530 5 20 CBBD CNC(=O)C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 330498436 BBRZGYZYGBIMJF-MRVPVSSYSA-N 293.283 -0.251 5 20 CBBD NC(=O)NC(=O)CCN=c1cc[nH]cc1[N+](=O)[O-] 361057935 AMFDAICOEPDWPL-UHFFFAOYSA-N 253.218 -0.591 5 20 CBBD COCC[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 436982458 XJVWDTZQXUBRMV-QMMMGPOBSA-N 297.267 -0.079 5 20 CBBD CN(C)C(=O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525698196 VMBAXQNZOKFUMG-UHFFFAOYSA-N 288.285 -0.644 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 592195148 JKKBIOBMKWRSQW-GXSJLCMTSA-N 298.299 -0.353 5 20 CBBD Cn1c(C(=O)N2CCOCCN2)ccc1[N+](=O)[O-] 597707193 KSQSJSJOUKGVDU-UHFFFAOYSA-N 254.246 -0.090 5 20 CBBD CS(=O)(=O)NC1CN(c2ccc([N+](=O)[O-])nc2)C1 599148939 RUZHRLWCFRRFAA-UHFFFAOYSA-N 272.286 -0.272 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CN(C)CCO1 610907210 FPWHMRMGTLITMF-GXSJLCMTSA-N 297.315 -0.373 5 20 CBBD Cn1nnnc1CCNc1ncc([N+](=O)[O-])cc1C(N)=O 611306581 LVVIVFXQIJVLAW-UHFFFAOYSA-N 292.259 -0.733 5 20 CBBD NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 702037914 SQMUTVCUVLGLAM-QMMMGPOBSA-N 253.262 -0.402 5 20 CBBD CC[C@H](C)NC(=O)CN1CCN(CC[N+](=O)[O-])CC1 791054413 UYFIOXNJRISONI-NSHDSACASA-N 272.349 -0.205 5 20 CBBD Nc1ccc(NC(=O)Cn2cnnn2)cc1[N+](=O)[O-] 819899429 NOGJKMVPGWKOCR-UHFFFAOYSA-N 263.217 -0.198 5 20 CBBD C[C@H](C(=O)NC1CC1)N1CCN(CC[N+](=O)[O-])CC1 929111660 MDPZPXQUWUVINF-SNVBAGLBSA-N 270.333 -0.452 5 20 CBBD O=C(NC1CN(C(=O)CC2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991279493 LVRPKHGPAXZKBD-NXEZZACHSA-N 267.285 -0.221 5 20 CBBD COC[C@H](CCO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1253647370 YORZOLIERPJTII-QMMMGPOBSA-N 286.288 -0.236 5 20 CBBD C[C@H]1CC(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1324649290 KMPMYGHVTLTEDK-ZETCQYMHSA-N 293.283 -0.197 5 20 CBBD COCCN(C)c1nnc(Cn2cnc([N+](=O)[O-])n2)n1C 1344951212 OSNNUAZESXMRCT-UHFFFAOYSA-N 296.291 -0.554 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC(C(=O)O)C1 1605655505 QKLOFJYVEJEDQL-UHFFFAOYSA-N 266.213 -0.271 5 20 CBBD O=C1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CCN1 21918904 IXTSOATZTSCQLU-UHFFFAOYSA-N 278.268 -0.035 5 20 CBBD C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 57929292 VQTKHKHJWINHDU-SSDOTTSWSA-N 294.267 -0.685 5 20 CBBD CCCS(=O)(=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 122922188 DTGWJPRSRZXSJY-UHFFFAOYSA-N 276.274 -0.353 5 20 CBBD C[C@H](C(=O)NC[C@@H](O)C(N)=O)c1cccc([N+](=O)[O-])c1 228493137 CSRSYQQTVLCPDU-OIBJUYFYSA-N 281.268 -0.339 5 20 CBBD NC(=O)COCCNC(=O)COc1cccc([N+](=O)[O-])c1 268604738 FPFBMCGVIQOHAL-UHFFFAOYSA-N 297.267 -0.408 5 20 CBBD COC(=O)[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 276506464 YVEGYALLLOLGFO-QWRGUYRKSA-N 298.299 -0.307 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 285772878 NHNIFNXIZMBSIB-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD C[C@H](C[S@@](C)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286105557 OXLXBORJWIYUDJ-WXQGDBPDSA-N 260.275 -0.185 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@]1(CCO)CCOC1 331323299 DEQHKXCHJUSFHG-NSHDSACASA-N 284.272 -0.551 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@H]2COC[C@H]2O)c1[N+](=O)[O-] 342299768 BVDGXMHVXYQBSK-JGVFFNPUSA-N 284.272 -0.288 5 20 CBBD Cc1ncc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c(O)n1 345116157 BYNILKBLXWAPMD-UHFFFAOYSA-N 292.255 -0.088 5 20 CBBD Cc1nncn1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 353002653 JKQSETQKENWCOO-UHFFFAOYSA-N 265.233 -0.352 5 20 CBBD CN(C[C@@H](O)CO)C(=O)COc1cccc([N+](=O)[O-])c1 355615131 JOAIDJQRHYQOMM-SNVBAGLBSA-N 284.268 -0.215 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc([N+](=O)[O-])[nH]1 447637440 QDGADQDBUUWVAW-UHFFFAOYSA-N 267.201 -0.428 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@]2(O)CCO[C@@H]2C)c1[N+](=O)[O-] 447741438 KYVMXOGLZMJCTR-RDDDGLTNSA-N 284.272 -0.104 5 20 CBBD CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cn1C 518747812 CKCAMQHNFLBETD-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD O=C(CO)NCCNc1ncnc2ccc([N+](=O)[O-])cc12 563816371 LYAMUAFHYGHASJ-UHFFFAOYSA-N 291.267 0.058 5 20 CBBD CC(C)Oc1nc(NC[C@H](O)C(N)=O)ccc1[N+](=O)[O-] 579140839 SMABHFDKQYSUTL-QMMMGPOBSA-N 284.272 0.035 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 588863774 KQXACLGOBMCGOR-QMMMGPOBSA-N 282.300 -0.171 5 20 CBBD CNc1nccc(C(=O)N[C@H](CO)COC)c1[N+](=O)[O-] 594351888 FRGIALOAQQQVCG-SSDOTTSWSA-N 284.272 -0.231 5 20 CBBD CNC(=O)[C@@H]1CN(Cc2onc(C)c2[N+](=O)[O-])CCO1 595426915 TYDUHYNOELPBIQ-VIFPVBQESA-N 284.272 -0.162 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1CC[C@@H](O)C1 599176386 SIINGAOTSNATMO-MRVPVSSYSA-N 255.278 -0.193 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCOC[C@@H]1CCOC1 609463449 JUTUHJOOULVPDD-SNVBAGLBSA-N 298.299 -0.039 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCn1ccnn1 611795838 BYVISCNNOLDETA-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])[nH]1 737609333 YCWVARZOOJKGBO-UHFFFAOYSA-N 285.212 -0.377 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)OCC(=O)NC(N)=O 750084047 KSVNRBNBPHAFOU-UHFFFAOYSA-N 282.212 -0.350 5 20 CBBD CC(CO)(CO)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 816760312 MLEQXYLSKOWSAQ-UHFFFAOYSA-N 283.284 -0.102 5 20 CBBD O=C(NC1CC1)N[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839725704 ISWOPQALMZMREA-IVZWLZJFSA-N 282.300 -0.286 5 20 CBBD CCc1[nH]nc(C(=O)Nn2cnn(CC)c2=O)c1[N+](=O)[O-] 854630837 LWMQKUDOVNVRGM-UHFFFAOYSA-N 295.259 -0.358 5 20 CBBD CN(C)CCONC(=O)c1c([N+](=O)[O-])cnn1C 854945605 MTHBHELOVAFRSU-UHFFFAOYSA-N 257.250 -0.449 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCNCC1 923279103 FAKUYJBHVYMTKU-LBPRGKRZSA-N 283.332 -0.164 5 20 CBBD Cc1cnc(NC2(CNC(=O)C(N)=O)CC2)c([N+](=O)[O-])c1 1110324316 IRBOYFSWRRBINV-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ncnn1C 1116942499 WYTFIWWDKVZTPZ-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD Cc1noc(COC(=O)CS(C)(=O)=O)c1[N+](=O)[O-] 1118540922 MSNWKLWUZZIJBF-UHFFFAOYSA-N 278.242 -0.021 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN3CCOC[C@]3(CO)C2)nc1 1262708232 VVXYJZMVXYYRRI-CYBMUJFWSA-N 294.311 -0.127 5 20 CBBD CNC(=O)CCCN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1319651493 KVUCHYHVHNJOEW-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CN1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 1322764269 ACDXUZIQMUNNAJ-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD C[C@H](O)CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 120638591 FIHWUWQGTRTQEJ-QMMMGPOBSA-N 281.268 -0.178 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@@H](O)[C@H](O)C2)c2nonc12 236525603 GTUUKRYPQMPYQI-HTQZYQBOSA-N 266.213 -0.327 5 20 CBBD CCc1nn(C)c(NCCN2CCNC(=O)C2)c1[N+](=O)[O-] 272741720 CXBMHSSXBNSZDA-UHFFFAOYSA-N 296.331 -0.266 5 20 CBBD NS(=O)(=O)c1cccc(N2CC(O)C2)c1[N+](=O)[O-] 273468944 JUIPFSBMIVDLOY-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285488193 AEJOQEIXCWNXTD-ZCFIWIBFSA-N 269.261 -0.228 5 20 CBBD COc1ccc(CNC(=O)Cn2cnnn2)cc1[N+](=O)[O-] 298837598 FATMKVQCWGDWEL-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD NC[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 358135808 KVEVQNZQYHTVSL-VIFPVBQESA-N 255.278 -0.549 5 20 CBBD NS(=O)(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 436095804 CDHHMJOBEBMCEN-UHFFFAOYSA-N 271.258 -0.236 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NCCc1nc[nH]n1 531909327 YNPGFXAIFPZNDN-UHFFFAOYSA-N 298.284 -0.371 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](CO)CCF 593380978 AJQVYIKHRFXIBG-QMMMGPOBSA-N 289.267 -0.189 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H]1CCN(C)C1=O 734894512 GKVMXJHJKYUCFX-MRVPVSSYSA-N 282.256 -0.126 5 20 CBBD COC[C@](C)(CC(=O)OC)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840380189 SYIKCAGSFFAJDP-XLDPMVHQSA-N 274.273 -0.264 5 20 CBBD CC(C)(CCC(=O)NCCn1cnnn1)[N+](=O)[O-] 845793823 LSEISRNGIHHEIM-UHFFFAOYSA-N 256.266 -0.375 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NOCCN(C)C 854945389 IIZZTDMCXVKEKM-UHFFFAOYSA-N 271.277 -0.291 5 20 CBBD O=[N+]([O-])CCNCCS(=O)(=O)N1CCCC1 905663901 IPMWFBRUKUHLFB-UHFFFAOYSA-N 251.308 -0.722 5 20 CBBD CN(CC1CC1)C(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 919520286 GMYRMRYAUSXXSJ-UHFFFAOYSA-N 297.271 -0.402 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CCCOCC1 1122328441 KVSLDZCUUIGAIX-UHFFFAOYSA-N 285.304 -0.072 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(NCCCO)CC1 1200472498 PPFGRPRDWJFPSS-GHMZBOCLSA-N 271.317 -0.385 5 20 CBBD C[C@H]1c2nncn2CCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1324513752 GWGXYVDFYIRIKN-QMMMGPOBSA-N 291.271 -0.014 5 20 CBBD CC(C)(CCC(=O)N[C@]1(C(=O)O)C[C@H](O)C1)[N+](=O)[O-] 1590655820 DVZXSVMBRZFGEB-DGFRNANFSA-N 274.273 -0.084 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 7020476 VNZFXJNXBNBKMN-MRVPVSSYSA-N 296.283 -0.603 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 48802627 KKLDSHQFNWTIIA-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CN(CCO)CCO)c1 62351209 FQEMGCHNAGYCOB-GFCCVEGCSA-N 270.285 -0.085 5 20 CBBD NS(=O)(=O)c1cccc(NCCO)c1[N+](=O)[O-] 273456711 HJFFJDQSSQOSPW-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD CC(C)[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(N)=O 276534168 ZBLYFGXHLYLUOW-QMMMGPOBSA-N 282.256 -0.065 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cnc(O)c([N+](=O)[O-])c1)OC 294087295 RCABVYWRGGALAC-QMMMGPOBSA-N 299.239 -0.387 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCN2C(=O)NC[C@@H]2C1 331845813 NJJGFOPEGQQUGX-SSDOTTSWSA-N 279.256 -0.228 5 20 CBBD NC(=O)[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 339022872 UVRFLLOFVMYLAE-RXMQYKEDSA-N 252.234 -0.721 5 20 CBBD CNC(=O)CN(C)c1cccc(C(N)=O)c1[N+](=O)[O-] 341340297 JJNXDZAGVBQUJR-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD COCCN(CCO)Cc1c([N+](=O)[O-])ncn1C 355551768 ZBXVQKRTBBANTO-UHFFFAOYSA-N 258.278 -0.231 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC1[C@H]2COC[C@H]12 357900447 CCWLDDWFUSBYLO-WDSKDSINSA-N 252.230 -0.297 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@](O)(C3CC3)C2)c1 365851940 XQDDKFZPPAVKDZ-QWHCGFSZSA-N 296.327 -0.001 5 20 CBBD C[C@@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)S(N)(=O)=O 398254350 QACVYQRQYQOVPO-LURJTMIESA-N 299.312 -0.018 5 20 CBBD CNCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 429105755 VORJLCWPWRBRFQ-UHFFFAOYSA-N 254.246 -0.908 5 20 CBBD O=C(NC(CO)CO)c1cc2c(c([N+](=O)[O-])c1)OCO2 525953743 NJALCPUEQHMZQH-UHFFFAOYSA-N 284.224 -0.594 5 20 CBBD CN(C)CCN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])n[nH]1 552127436 PIKFYLNSDMIYEZ-UHFFFAOYSA-N 298.347 -0.117 5 20 CBBD Nc1nccc(C(=O)N[C@@H]2CCCCNC2=O)c1[N+](=O)[O-] 572301759 OAKWUPUAJMRPJH-MRVPVSSYSA-N 293.283 -0.030 5 20 CBBD CC(C)Oc1nc(NC(CO)CO)ccc1[N+](=O)[O-] 579004588 LUODQFGNCMVGNH-UHFFFAOYSA-N 271.273 0.542 5 20 CBBD O=C(NC[C@H]1CCCNC1=O)c1cc([N+](=O)[O-])cnc1O 590333498 PVBHXXIMMXIWHO-SSDOTTSWSA-N 294.267 -0.049 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](CO)C1 699456809 FNKNRNGZCSFTLK-SECBINFHSA-N 282.300 -0.318 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCNC[C@H]1O 710425556 ZXGXVILSABKBCA-WCBMZHEXSA-N 268.273 -0.614 5 20 CBBD NC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1O 779665420 ATUCEMZTWWPJGC-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD Cn1cc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1022064130 XKPBBTCOFPWROY-JZSSXWJLSA-N 294.315 -0.783 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H](n2cncn2)C1 1325268184 KSPIFRAEYVECPO-SSDOTTSWSA-N 277.244 -0.003 5 20 CBBD Cc1nn(C)c(C(=O)NCCN2CCCC2=O)c1[N+](=O)[O-] 1326577178 ILGVGAUEYPFUOC-UHFFFAOYSA-N 295.299 -0.011 5 20 CBBD C[C@@H]1CNCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1334337802 LKLQTMOIKKCTTR-KOLCDFICSA-N 269.305 -0.554 5 20 CBBD O=[N+]([O-])c1cnccc1N1CCN2CCOC[C@]2(CO)C1 1348336846 LQDXYBLICHMLAP-CYBMUJFWSA-N 294.311 -0.127 5 20 CBBD COC(=O)[C@H](CC(C)C)NC(=O)Cn1cnc([N+](=O)[O-])n1 53835763 NWWHODMQTVEAFC-QMMMGPOBSA-N 299.287 -0.110 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCCO 123082563 BVXHGZUCDJTLAV-UHFFFAOYSA-N 267.241 -0.567 5 20 CBBD Nc1ccnc(CNc2ncc([N+](=O)[O-])c(N)n2)n1 154289576 RHMYQXNDYNJUJA-UHFFFAOYSA-N 262.233 -0.049 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(C)OCCO1 179034151 DRBXZHSCMNATQR-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD N[C@@H]1CC[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]12 185196980 YIWORVQUTBKBER-IVZWLZJFSA-N 279.300 -0.013 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc(F)ccc1[N+](=O)[O-] 227045573 GRZYYQINRIAQDQ-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD O=C1CNC(=O)N1CCNc1ccc([N+](=O)[O-])cn1 264904705 CNAJDGFLUUOCIG-UHFFFAOYSA-N 265.229 -0.047 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@]1(O)CCSC1 267024778 XHJVHFYRQRGICB-JTQLQIEISA-N 286.313 -0.225 5 20 CBBD CNc1c(C(=O)N[C@@H](CO)C(=O)OC)cccc1[N+](=O)[O-] 360937039 HZAIIQAIMJNCSD-QMMMGPOBSA-N 297.267 -0.100 5 20 CBBD Cc1nn(C)c(N2CC(OCC(=O)N(C)C)C2)c1[N+](=O)[O-] 362131469 XHCWONRUXOSNCM-UHFFFAOYSA-N 297.315 -0.070 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCn2nccc21 367500352 MGTAZIQNRWWREO-UHFFFAOYSA-N 289.251 0.000 5 20 CBBD CC(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 408026011 VFRNPYDVUVEUMA-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1 444384248 QJKRGZFZAOHIBG-SECBINFHSA-N 297.315 -0.533 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCO[C@@H]1CCCCO1 597677585 OWCLKBWZZKVXIE-SNVBAGLBSA-N 299.287 -0.154 5 20 CBBD COC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CCCO1 839747821 FJXZZAGDLDTYBG-UTINFBMNSA-N 258.274 -0.038 5 20 CBBD O=C(NOCCN1CCCC1=O)c1n[nH]cc1[N+](=O)[O-] 856042020 PHLWLCIDFKGEMK-UHFFFAOYSA-N 283.244 -0.398 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCn2ccnc21 857911438 HOGDLAQHIPWUJF-UHFFFAOYSA-N 289.251 0.000 5 20 CBBD Cn1cncc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991291789 ZIGAVCARJHJZFE-RKDXNWHRSA-N 293.283 -0.974 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1COCCO1 1115909992 LOWVTMSHTDWKEN-VIFPVBQESA-N 284.272 -0.369 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@@H]1CCCS1(=O)=O 1326763051 KFPDMUVGEQTJDO-ZETCQYMHSA-N 288.285 -0.156 5 20 CBBD C[S@@](=O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 1327083321 AAJABQNQNAPFKA-GOSISDBHSA-N 272.286 -0.320 5 20 CBBD CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCN(C)C(=O)C1 1342657578 DMIVSVDYAKYBEJ-MRVPVSSYSA-N 282.304 -0.086 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 1344393980 UTNKDBVQCOPWRI-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD Cn1ccnc1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1522493296 AOYBWPRLGUNPKH-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD Cn1nnc(Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)n1 1601041220 XEFNPSRASWENPQ-UHFFFAOYSA-N 280.200 -0.974 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NCCS(N)(=O)=O 91554536 DTHJRGNHTCOADB-UHFFFAOYSA-N 277.306 -0.180 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN1CCn1ccc([N+](=O)[O-])n1 158666771 QLKIDKLCHYQBHB-IUCAKERBSA-N 284.272 -0.601 5 20 CBBD CC(CO)(CO)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 183514328 AIQCLHFCBQJPQZ-UHFFFAOYSA-N 294.267 -0.056 5 20 CBBD COC[C@@H](CCO)NC(=O)Cn1ccc([N+](=O)[O-])n1 229799497 JFJVMTZBNXEYES-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 229975802 JMKFNUGSGVFIMM-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O 270647715 QHXZULBIEBVQLX-MWLCHTKSSA-N 295.295 -0.014 5 20 CBBD C[C@H]1CN(C[C@@H](C)O)CCN1c1ncc([N+](=O)[O-])c(N)n1 275381089 PDPGNIWGUVTANI-DTWKUNHWSA-N 296.331 -0.142 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](O)[C@H](O)C1 278664954 HXIGQKHKHUHNFQ-TXEJJXNPSA-N 295.295 -0.121 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NCc1c([N+](=O)[O-])ncn1C 331274962 PXINDFVFSSVFCG-APPZFPTMSA-N 267.289 -0.058 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@H]1CCNC1=O 340720499 PIJDAIQKKLQOAL-QMMMGPOBSA-N 280.240 -0.344 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCC[C@@H]1CCO 342997224 GTUZDCCAFMEPBY-SECBINFHSA-N 283.288 -0.050 5 20 CBBD O=C(NCC1CCN(CCO)CC1)c1n[nH]cc1[N+](=O)[O-] 344404660 ZJUJHIIAEHXNCM-UHFFFAOYSA-N 297.315 -0.248 5 20 CBBD C[C@@H](N)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 351829761 OUCPNSDKJRVRLX-RKDXNWHRSA-N 267.289 -0.013 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CNC(=O)C1 354049582 UWLZWBHSBKASDO-RXMQYKEDSA-N 265.229 -0.611 5 20 CBBD C[C@@H](CCS(C)(=O)=O)NC(=O)c1cc([N+](=O)[O-])n[nH]1 354065654 RIZHLSCWAYJQIY-LURJTMIESA-N 290.301 -0.129 5 20 CBBD O=C(COC1CCNCC1)NCCn1cc([N+](=O)[O-])cn1 564796342 FOGOPZWDDZTQMK-UHFFFAOYSA-N 297.315 -0.324 5 20 CBBD C[C@]1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCOC1=O 813294592 KUUALNVHIQPSIT-LBPRGKRZSA-N 295.251 -0.422 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C(=O)O 828442048 XCUXWYROEUFIOT-IEBDPFPHSA-N 298.299 -0.195 5 20 CBBD O=C(NC1CN(C(=O)c2ccoc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280365 QGBPSAODDPQTQO-NXEZZACHSA-N 279.252 -0.115 5 20 CBBD Cc1ccnc(N2CCN(C(=O)C(N)=O)CC2)c1[N+](=O)[O-] 1055999524 UAWKOIOZSVIGCL-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD C[C@@H]1NC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1116145478 VQURAKSMRPPECA-XPUUQOCRSA-N 283.244 -0.908 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ncc(CCO)s1 1118706173 HUZZRJWAIAJRLG-UHFFFAOYSA-N 298.284 -0.184 5 20 CBBD CN(CCc1ccccc1[N+](=O)[O-])C(=O)C1(O)CNC1 1573873036 SXRMOSWKRSQIKT-UHFFFAOYSA-N 279.296 -0.070 5 20 CBBD O=C(O)CNS(=O)(=O)c1ncccc1[N+](=O)[O-] 1595102679 ZTNLTPSGHWFFLA-UHFFFAOYSA-N 261.215 -0.647 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCc2cnn[nH]2)c1 1610817224 BLKSHRNBKQJXRV-UHFFFAOYSA-N 279.212 -0.185 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](C(=O)O)C1CC1 54504187 XYXZYWUJJTWAJU-SECBINFHSA-N 268.229 -0.229 5 20 CBBD O=C(CO)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 190337694 SIJCUMIFUADKBS-UHFFFAOYSA-N 272.286 -0.308 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 217689769 QNADOMBZGQVINT-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD CC(C)(CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262273502 VIKCNVLMXUGEIB-UHFFFAOYSA-N 297.267 -0.017 5 20 CBBD O=C1CC[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CN1 277765535 RUMTVGNGEHKDLY-ZETCQYMHSA-N 280.240 -0.296 5 20 CBBD O=C(N[C@H](CO)[C@@H]1CCCO1)c1cnc(O)c([N+](=O)[O-])c1 344820802 HSDURFKMQJOILA-SCZZXKLOSA-N 297.267 -0.035 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1COC[C@H]1O 352801307 JVAKOYWVQAIGFC-WDEREUQCSA-N 283.284 -0.552 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(F)F 354013307 FSFVKLRBTRPXFX-ZCFIWIBFSA-N 276.199 -0.072 5 20 CBBD CC(=O)NCCCNC(=O)CCn1cc([N+](=O)[O-])cn1 357849579 JAGSYLSCKHRASK-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD C[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)S(N)(=O)=O 359608416 DKLCAOSCZCPGII-RXMQYKEDSA-N 276.274 -0.670 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1[C@@H]2CNC[C@@H]21 366526019 HHOCVTWDPQMLDF-GDGBQDQQSA-N 279.300 -0.176 5 20 CBBD CC1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)CCN1 420283029 SPMAEFUOFDWTLF-UHFFFAOYSA-N 252.278 0.155 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)N1 537577234 OWCGRMIZITUFCF-VIFPVBQESA-N 264.241 -0.330 5 20 CBBD Nc1c(C(=O)N2CC[C@H](CO)[C@@H](O)C2)cccc1[N+](=O)[O-] 557629243 MTRFZZPHFXWLIG-KCJUWKMLSA-N 295.295 -0.008 5 20 CBBD Cn1nncc1NC(=O)CCn1cc([N+](=O)[O-])cn1 752952932 PUEUDYATBAAKMN-UHFFFAOYSA-N 265.233 -0.051 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N(C)C[C@@H]1COCCO1 1263020537 WFXLUCATSZPOEN-SECBINFHSA-N 285.304 -0.074 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1c([N+](=O)[O-])cnn1C 1319891168 TVLSHWAYZLVRSO-UHFFFAOYSA-N 281.272 -0.321 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@]2(CCO)CCOC2)c1[N+](=O)[O-] 1320993783 IKOSUZXRQJRVCC-LBPRGKRZSA-N 298.299 -0.092 5 20 CBBD COC(=O)CN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1340909395 DCPMCRVQYCLLMW-UHFFFAOYSA-N 283.240 -0.612 5 20 CBBD COCCN1CCN(Cn2nccc2[N+](=O)[O-])CC1=O 160844156 SFOLWUKUKVDDMT-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD C[C@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])cn1 174842989 MHYYPYPJZSRPSD-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CC(C)COC[C@@H](O)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 341815341 WXHIKAXXABULLY-QMMMGPOBSA-N 285.304 -0.166 5 20 CBBD CC(C)NC(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343175810 VKWLJHCJPHKJFL-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD O=[N+]([O-])c1ccn(CCN2[C@H](CO)CC[C@H]2CO)n1 347292531 BVFQCQLCIXKUOK-UWVGGRQHSA-N 270.289 -0.391 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])cnc2N)C1 350998500 NQDWXJWVVLEPOP-UHFFFAOYSA-N 279.256 -0.468 5 20 CBBD CCC[C@H](O)[C@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 413501093 YMFNSVUSKSGDIM-XPUUQOCRSA-N 271.277 -0.099 5 20 CBBD O=[N+]([O-])c1cccnc1S(=O)(=O)N1CCOC1 594779873 XPMQGHNMRDGFEQ-UHFFFAOYSA-N 259.243 -0.032 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NCCN3CC[C@H](O)C3)nn12 599199833 RYVIVPANFJAEIV-VIFPVBQESA-N 292.299 0.116 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc([N+](=O)[O-])ccc1O 833767960 VRPYGUGNYQUAOI-ZETCQYMHSA-N 270.197 -0.524 5 20 CBBD CO[C@H]1COCC[C@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783665 JZDXGELBDKKLQV-JLIMGVALSA-N 258.274 -0.181 5 20 CBBD Cn1cc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1031662327 BIQGGGSGXTWMIO-GHMZBOCLSA-N 294.315 -0.972 5 20 CBBD CC(C)(O)C1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1320655558 YKEWHMRIPUDHJM-UHFFFAOYSA-N 295.295 -0.014 5 20 CBBD Cn1cncc1CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592590466 IBRZJDJQPGTIPI-UHFFFAOYSA-N 289.259 -0.052 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CC[C@@H](C(=O)O)C1 1594713983 LMOOHMYRFLIZJR-RQJHMYQMSA-N 283.244 -0.444 5 20 CBBD COCCNC(=O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 157529874 OCCXIDFTRBFMSO-GFCCVEGCSA-N 297.311 -0.020 5 20 CBBD C[C@H](C[S@@](C)=O)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 168872089 XHOUQTVUWXGGTF-OYHJMPOTSA-N 290.345 -0.491 5 20 CBBD C[C@@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C(N)=O 194337685 LTCLKTOQBSMWIU-RXMQYKEDSA-N 291.260 -0.114 5 20 CBBD COC(=O)c1cnc(N(C)CC(N)=O)c([N+](=O)[O-])c1 276650964 ZDMWTSKHZZJMIE-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD Cn1[nH]c(CN2CCc3ncc([N+](=O)[O-])cc3C2)nc1=O 332020867 SLNPVRFLGKYRBZ-UHFFFAOYSA-N 290.283 -0.030 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 343565953 KEQRXWXRZWMPJP-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD COC[C@H](O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 346016233 AHCACYVAQZBVCP-SNVBAGLBSA-N 286.288 -0.305 5 20 CBBD CC(C)(CNC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 358324977 PHDIZIMIDPWVOC-UHFFFAOYSA-N 269.261 -0.581 5 20 CBBD CCc1[nH]nc(C(=O)N2CCC[C@H]2C(N)=O)c1[N+](=O)[O-] 444096948 MCQYVTZXTIIUAY-ZETCQYMHSA-N 281.272 -0.030 5 20 CBBD CNc1nccc(C(=O)NC[C@H](COC)OC)c1[N+](=O)[O-] 563390819 XGLRCHIWYTUFLN-MRVPVSSYSA-N 298.299 0.423 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H](O)CO 592430494 UVOYBECDTVDNPI-NXEZZACHSA-N 286.284 -0.723 5 20 CBBD O=[N+]([O-])c1ccc(-n2cc(CN3CCNCC3)nn2)nc1 594649095 GZMVZZYTTFYCQU-UHFFFAOYSA-N 289.299 -0.024 5 20 CBBD O=C([C@H]1CCCCN1CC[N+](=O)[O-])N1CCOCC1 791054162 YDNSATLMHKKIQH-LLVKDONJSA-N 271.317 -0.024 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 793921816 VOISCZJZUWXXDO-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD CCON(C)C(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 848245337 WKWDELDSXGFXJZ-UHFFFAOYSA-N 297.271 -0.288 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1n[nH]cc1F 999184235 MFVARHKCCIMWFA-HTRCEHHLSA-N 297.246 -0.845 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnn(C)c2)C1 1042705248 OHVYPFRHGZPRGT-VXGBXAGGSA-N 293.327 -0.272 5 20 CBBD NC(=O)C(=O)NCCNc1ncccc1[N+](=O)[O-] 1094079740 ZNNRQPHJMHIZDK-UHFFFAOYSA-N 253.218 -0.997 5 20 CBBD CN(CCCNc1ccnc(O)c1[N+](=O)[O-])C(=O)C(N)=O 1109601174 KGYZESYBDNFYSY-UHFFFAOYSA-N 297.271 -0.559 5 20 CBBD Cn1ncc(CCCNC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1117767631 CMBIWCDLLBYEIX-UHFFFAOYSA-N 294.275 -0.936 5 20 CBBD Cc1[nH]nc(C(=O)NN2CCCC2=O)c1[N+](=O)[O-] 1319729602 OJUMGJMFOFBGMP-UHFFFAOYSA-N 253.218 -0.106 5 20 CBBD Cn1cc([C@H](O)CNC(=O)c2n[nH]cc2[N+](=O)[O-])cn1 1320365575 KCHFGQRMUKXAIH-MRVPVSSYSA-N 280.244 -0.485 5 20 CBBD NC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1325855300 GFPBHTXYLCOAOX-ZETCQYMHSA-N 254.250 -0.960 5 20 CBBD N[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1326611185 DCEDBWRJLFTIMA-SSDOTTSWSA-N 254.250 -0.960 5 20 CBBD COC[C@@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(N)=O 1339177352 YNJHKUCLEOVNOK-MRVPVSSYSA-N 297.267 -0.167 5 20 CBBD Cn1c(C(=O)N2CCC[C@H](O)[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 1600899004 COTQLZXMOUMDGS-WCBMZHEXSA-N 297.267 -0.017 5 20 CBBD CC(C)NC(=O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 132831773 MJPZYLRWAQBIGT-UHFFFAOYSA-N 298.303 -0.385 5 20 CBBD O=[N+]([O-])c1cc2c(c(CN3C[C@H](O)[C@@H](O)C3)c1)OCOC2 278681805 IWFMSTFTMOEGBU-RYUDHWBXSA-N 296.279 -0.001 5 20 CBBD C[C@@H]1C[C@H](O)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 340973315 PKHWYFCBFFOZFG-MIMYLULJSA-N 270.289 -0.393 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 354343874 DEKHSTICKVOAQR-ZETCQYMHSA-N 283.240 -0.559 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)C[C@H]1CO 368428166 CTLXASLJEYESDH-WDEREUQCSA-N 296.279 -0.072 5 20 CBBD CN(CCCN)C(=O)NCCn1cc([N+](=O)[O-])cn1 514736856 UKSWBQSSQCVNGH-UHFFFAOYSA-N 270.293 -0.219 5 20 CBBD Cn1ccc(=NC(=O)c2ccnc(N)c2[N+](=O)[O-])[nH]1 548079852 XZLLSSOUDGZPMN-UHFFFAOYSA-N 262.229 -0.020 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)NCCN(C)C 567178649 MPNYDJZBSRPNBX-SSDOTTSWSA-N 298.303 -0.886 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CC[C@@H](O)C1 600535706 RFGRBSQGWFZEQY-SNVBAGLBSA-N 297.315 -0.717 5 20 CBBD NC(=O)[C@H](O)CNC(=O)CCNc1ccccc1[N+](=O)[O-] 618923603 ITNOJVRFSWBWJQ-SNVBAGLBSA-N 296.283 -0.641 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H](CO)CC(F)F)c1 717712348 IYWCQJHRJMTPEM-CBAPKCEASA-N 294.258 -0.242 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H]1CCOC1=O 744661717 IKGQHVPAIMXQPO-SSDOTTSWSA-N 269.213 -0.042 5 20 CBBD CC1(C)CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839620287 KEHPVSSMXJHXPP-NXEZZACHSA-N 271.317 -0.121 5 20 CBBD C[C@H]1COCCN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839654575 MPPNBZZEPRRTFV-IVZWLZJFSA-N 257.290 -0.512 5 20 CBBD C[C@@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CCNC1=O 853173515 PLSVVBKAOLQFHP-NSHDSACASA-N 282.256 -0.139 5 20 CBBD O=C(CCC(=O)N1CCOCC1)OCCC[N+](=O)[O-] 860913234 VAYZCMQMVPNNFU-UHFFFAOYSA-N 274.273 -0.165 5 20 CBBD Cn1cc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1022063943 QHMJOYUWBLQVGJ-WRWGMCAJSA-N 293.327 -0.178 5 20 CBBD Cc1cc(N2CCN(C(=O)C(N)=O)CC2)ncc1[N+](=O)[O-] 1055999537 UYZFRWGAERHGTF-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD CN(C[C@@H]1COCCO1)c1nnc(C[N+](=O)[O-])n1C 1121392606 VEOUJIXTKOJHOR-MRVPVSSYSA-N 271.277 -0.557 5 20 CBBD O=[N+]([O-])CCNCCS(=O)(=O)C1CCOCC1 1262490130 PYKAREZWIFYLQO-UHFFFAOYSA-N 266.319 -0.554 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(COCCN)n1 1326214147 NOGJWYIEEKZPQL-UHFFFAOYSA-N 268.233 -0.146 5 20 CBBD COC(=O)COCCNC(=O)c1c([N+](=O)[O-])cnn1C 1329102849 OAQGWPDKOWIQPB-UHFFFAOYSA-N 286.244 -0.752 5 20 CBBD O=C(NCCc1cccc([N+](=O)[O-])c1)C(=O)NC1CNC1 1331469544 IQLPPHIQZZAFKT-UHFFFAOYSA-N 292.295 -0.659 5 20 CBBD NCC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(F)(F)F 1348944720 VFJPEUIEMGIYPK-RXMQYKEDSA-N 296.209 -0.418 5 20 CBBD CC(C)[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1588960514 BHDAZIZSHAAVNW-UWVGGRQHSA-N 286.288 -0.149 5 20 CBBD O=C(NC1(C(=O)O)CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1594723385 XDYWQAVZEPVALU-RNFRBKRXSA-N 258.230 -0.598 5 20 CBBD O=C(O)[C@H](Cn1ccnc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601663231 QXMUHWWVNMQCNT-GJMOJQLCSA-N 268.229 -0.882 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@H](CO)C1 51885011 DVXIAFOTHNMIQQ-ZETCQYMHSA-N 267.241 -0.263 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCO[C@H]2CCC[C@H]21 56193280 TVSRQBDYSAFDSU-BDAKNGLRSA-N 281.272 -0.034 5 20 CBBD Cn1nnc(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)n1 193047231 VKHVFXJEWVVNKT-UHFFFAOYSA-N 288.223 -0.086 5 20 CBBD COC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 274565611 ZNNOMZQAOQEPOU-QMMMGPOBSA-N 269.257 -0.086 5 20 CBBD CNC(=O)CCNc1ncc([N+](=O)[O-])cc1C(N)=O 298737840 PSUVTRSPRHFBGO-UHFFFAOYSA-N 267.245 -0.363 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 343959235 HVVILUXNZOCJOK-UHFFFAOYSA-N 270.201 -0.497 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1[C@H]2CNC[C@H]12 368645791 HOGRRBGSGGIPBA-BQBZGAKWSA-N 251.246 -0.875 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCN1CCNCC1 415391448 WJNORAVNXNESIY-UHFFFAOYSA-N 294.315 -0.562 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCC(=O)N1 447745152 MSTYTNIXVHSLGV-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cc([N+](=O)[O-])cnc1O 448412092 YOIHOVZYHGVPQV-UHFFFAOYSA-N 295.211 -0.656 5 20 CBBD NC(=O)CCCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 567367663 RRQCACAZPBOIJA-UHFFFAOYSA-N 255.234 -0.297 5 20 CBBD Cc1cc([N+](=O)[O-])cn(CC(=O)NCC(=O)O)c1=O 572631232 BOIOIZSCSSVDDB-UHFFFAOYSA-N 269.213 -0.734 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC[S@@]1=O 581833796 XCFFYEBKTDJXCT-SVWIBVJCSA-N 298.324 0.165 5 20 CBBD Nc1nc(N2CC[C@@H]3NC(=O)CC[C@H]3C2)ncc1[N+](=O)[O-] 596458336 HOZMAICKOZSEPK-YUMQZZPRSA-N 292.299 0.072 5 20 CBBD CNc1nccc(C(=O)N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 597654495 RSRKLIURJFFCMU-QMMMGPOBSA-N 297.315 -0.316 5 20 CBBD O=C(O)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 819327508 YBJXZRJIHKTFOL-VIFPVBQESA-N 270.245 -0.423 5 20 CBBD Cc1nn(CC(=O)O[C@@H](C)C[N+](=O)[O-])c(=O)n1C 847716790 QXHYNOMDJZTYII-LURJTMIESA-N 258.234 -0.901 5 20 CBBD Cn1nccc1C(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 848765713 HEGBYUXQGZJNTE-HTRCEHHLSA-N 253.214 -0.189 5 20 CBBD NC(=O)C(=O)NC1CN(Cc2cccc([N+](=O)[O-])c2)C1 1030881906 HDCFYKRAAXKUGH-UHFFFAOYSA-N 278.268 -0.620 5 20 CBBD Cc1ccnc(NC/C=C/CNC(=O)C(N)=O)c1[N+](=O)[O-] 1107480732 RYEUYESYAQBKTL-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD CN(CCNS(C)(=O)=O)C(=O)c1ccc([N+](=O)[O-])o1 1116053831 XVSYLIQLPCZMIK-UHFFFAOYSA-N 291.285 -0.191 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)c1n[nH]cc1[N+](=O)[O-] 1116862442 QAWNMSFLTFWWMB-UHFFFAOYSA-N 251.206 -0.292 5 20 CBBD CSC[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1117394459 BCNQDBUQFUXHHB-RXMQYKEDSA-N 260.275 -0.386 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1324565728 AGVOYZVYTVUEMU-MYJAWHEDSA-N 266.257 -0.512 5 20 CBBD CC[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1326275106 HHLBYYNSNPRBQY-ZETCQYMHSA-N 283.240 -0.264 5 20 CBBD O=C(N[C@H]1CCNC[C@H]1F)c1cc([N+](=O)[O-])n[nH]1 1580615224 BUMUCKJDQQTIOD-RITPCOANSA-N 257.225 -0.252 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])c(O)c1 1601419501 KLPNJFFJSOROLR-ZCFIWIBFSA-N 270.197 -0.524 5 20 CBBD O=C1NC[C@H](Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)O1 1602657846 HAUBTTCMTRCPEB-ZCFIWIBFSA-N 283.196 -0.437 5 20 CBBD COC(=O)[C@H](CO)NC(=O)COc1ccccc1[N+](=O)[O-] 35160326 NCOKDAWKYUACDA-QMMMGPOBSA-N 298.251 -0.376 5 20 CBBD NC(=O)Cn1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cn1 56328635 OFFZYBGXOJCSGW-UHFFFAOYSA-N 278.228 -0.143 5 20 CBBD CNC(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 78619886 QTKKVRUOPXSIOO-SSDOTTSWSA-N 280.288 -0.071 5 20 CBBD CNC(=O)[C@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O 90519163 IYVMZOYMNZWXCF-LLVKDONJSA-N 294.311 -0.033 5 20 CBBD Cc1nn(CCC(=O)NC(CO)CO)c(C)c1[N+](=O)[O-] 132461352 RSTOAKFAGVNHCU-UHFFFAOYSA-N 286.288 -0.732 5 20 CBBD CC[C@@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 135043650 ZBYFAAPDNBZTCR-MNOVXSKESA-N 272.305 -0.097 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN1CCn1cc([N+](=O)[O-])cn1 158798022 FLCIFGNOEFWHAO-UWVGGRQHSA-N 284.272 -0.601 5 20 CBBD C[C@H](CC(=O)O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 263016591 RYTVHPFIWWKZAT-SSDOTTSWSA-N 283.240 -0.264 5 20 CBBD CN(C)C(=O)[C@H]1CSCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286577658 WITFVJUHAMQSID-SSDOTTSWSA-N 299.312 -0.079 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN(CCO)CC2CC2)c1 352469826 ZOEQUSXEQDOEGB-GFCCVEGCSA-N 284.316 -0.144 5 20 CBBD CCN(CCO)c1nccc(C(N)=O)c1[N+](=O)[O-] 357242967 XCFZPUUHLJPGHH-UHFFFAOYSA-N 254.246 -0.093 5 20 CBBD COCCOC1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 359487264 VXSLZKGZWYMRTC-UHFFFAOYSA-N 284.272 -0.335 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@H]1COC[C@@H]1O 359659110 SKUIOHZIIKDOEU-IUCAKERBSA-N 283.240 -0.473 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)C1 599007955 SNZDEEQMDNDLCW-ZKCHVHJHSA-N 296.287 -0.646 5 20 CBBD O=C(O)c1nn(C[C@@H]2COCCO2)cc1[N+](=O)[O-] 690803900 YDMBTRTUQVXUHE-ZCFIWIBFSA-N 257.202 -0.095 5 20 CBBD CC(C)c1[nH]nc(C(=O)NOCC(N)=O)c1[N+](=O)[O-] 772949018 OHAMVWARSYJOJB-UHFFFAOYSA-N 271.233 -0.412 5 20 CBBD CN(CCC(=O)O)C(=O)c1nn(C)cc1[N+](=O)[O-] 820586272 SGWJHNMETSVXHC-UHFFFAOYSA-N 256.218 -0.125 5 20 CBBD COCCN(CCC(=O)OC)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839688080 AELFDWIBCPBJCV-RKDXNWHRSA-N 274.273 -0.310 5 20 CBBD CCONC(=O)CNC(=O)c1ccc([N+](=O)[O-])n1C 846497447 DEOVBBPXXPTDMR-UHFFFAOYSA-N 270.245 -0.269 5 20 CBBD COC(=O)N(C)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 855940794 YFKLJOOJCCDTJZ-UHFFFAOYSA-N 299.287 -0.086 5 20 CBBD C[C@@]1(C2CC2)NC(=O)N(CC(=O)OCCC[N+](=O)[O-])C1=O 860913569 FPWRETVJZNXQTK-LBPRGKRZSA-N 299.283 -0.083 5 20 CBBD CN1CCN(C)[C@@H](CNc2c([N+](=O)[O-])cnn2C)C1 892467664 KCARCXMSNOFGQK-VIFPVBQESA-N 268.321 -0.014 5 20 CBBD Cc1noc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])n1 1325233501 KUXKLHXLLVRZSB-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD O=C(O)CNc1ncnc(N2CCOCC2)c1[N+](=O)[O-] 1606268819 CMBFWLPVGALESG-UHFFFAOYSA-N 283.244 -0.282 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 106362213 JVLIEWSVPGYBDD-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCNC(=O)C1 112207586 KSERWANYYSTPBG-UHFFFAOYSA-N 266.257 -0.105 5 20 CBBD CCOC(=O)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 122287570 SZMBVQWEWUCQAI-UHFFFAOYSA-N 256.218 -0.047 5 20 CBBD C[C@@H](CO)N(CCn1ccc([N+](=O)[O-])n1)C[C@@H](C)O 190817004 QMSURNZKPXZMGW-VHSXEESVSA-N 272.305 -0.145 5 20 CBBD COC(=O)CN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 275075622 XPOIXTIACUDAGA-UHFFFAOYSA-N 269.213 -0.060 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H](C)O 276029704 UDCMFDHCGGBSSU-QUBYGPBYSA-N 298.251 -0.047 5 20 CBBD COC(C)(C)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 281058666 TXUBILSEXILZPM-UHFFFAOYSA-N 297.267 -0.151 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 281765167 ZCNRRAGEAJWSRS-CAHLUQPWSA-N 266.261 -0.097 5 20 CBBD COC[C@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)OC 300562858 CVKGAJNIZCEQDG-QWRGUYRKSA-N 288.304 -0.597 5 20 CBBD C[C@@H](O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 360109202 FBFRUHNYJQDRSR-ZCFIWIBFSA-N 254.246 -0.094 5 20 CBBD COC(=O)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 412780971 RUXOFHWJBBUPOT-OLQVQODUSA-N 268.229 -0.001 5 20 CBBD O=C(NC[C@H]1CNC[C@@H]1O)c1ccc(O)c([N+](=O)[O-])c1 436731150 NYMHMYPRAYYFBR-KCJUWKMLSA-N 281.268 -0.390 5 20 CBBD COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O 436893987 PXQSAZAAWLJPIC-VIFPVBQESA-N 297.267 -0.079 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN(CCO)C2CCC2)c1 439270732 HJLXUUOSSZNSAV-LBPRGKRZSA-N 284.316 -0.001 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cc(F)c1=O)N1CCNC1=O 518533077 MEWVMFLJWRDZMK-UHFFFAOYSA-N 284.203 -0.553 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)NC1CNC1 562823058 QEGQZDYGPQWMNY-UHFFFAOYSA-N 278.268 -0.701 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(c2ncc([N+](=O)[O-])cn2)C1 592001716 BLNBPLOZHCKBAY-IONNQARKSA-N 282.256 -0.255 5 20 CBBD CC(C)[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 766965028 CFPIBDQJPWEMSG-MRVPVSSYSA-N 270.245 -0.005 5 20 CBBD COc1cc(C=O)c([N+](=O)[O-])cc1OCC(=O)NCCO 769034547 PDCBKWOSFUOPFY-UHFFFAOYSA-N 298.251 -0.097 5 20 CBBD CCN(CC)C(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 919519674 APBBCUOUHDFTFK-UHFFFAOYSA-N 285.260 -0.402 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 931279878 RLGCEEPHFMHJEP-WUHRBBMRSA-N 295.343 -0.356 5 20 CBBD CC(C)C(=O)N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21 976193139 XBAICJFUNRVEEZ-NZFPMDFQSA-N 281.312 -0.119 5 20 CBBD O=C(NCCNCc1cnns1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936975 ZIPTWRCFRWSKDM-HTQZYQBOSA-N 271.302 -0.591 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)O[C@@H]1CCC(=O)NC1=O 1321635459 IGCRNRFJUQFDMV-ZCFIWIBFSA-N 282.212 -0.710 5 20 CBBD NC(=O)[C@H](CO)NC(=O)Cc1ccccc1[N+](=O)[O-] 1322670776 OWFXEBUTKNWTTO-QMMMGPOBSA-N 267.241 -0.900 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 1325000025 ZJSOKPTUNKSJKB-MRVPVSSYSA-N 285.256 -0.413 5 20 CBBD C[C@H](CCO)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 1328832939 SYTHLCOZDMPDOC-SSDOTTSWSA-N 257.250 -0.584 5 20 CBBD O=[N+]([O-])c1cn(CCn2ccnc2)nc1-c1nn[nH]n1 1593486741 JSKOOXMFLYSTDS-UHFFFAOYSA-N 275.232 -0.132 5 20 CBBD Cc1ccnc(N2CC(O)(C(=O)O)C2)c1[N+](=O)[O-] 1600601767 IZIPDDDSMLKKQY-UHFFFAOYSA-N 253.214 -0.066 5 20 CBBD O=C(O)C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 1601907790 XXCPNBAZNGSFRV-WDEREUQCSA-N 298.299 -0.005 5 20 CBBD O=C(O)c1cn([C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1602497498 WMYMGZNTFOUOBP-ZXFLCMHBSA-N 295.255 -0.585 5 20 CBBD NC(=O)CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 118866671 ODPYATZYLOEAAH-QMMMGPOBSA-N 265.273 -0.039 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCn2ccnn2)c1 126822333 UJKMAVRUKMNPKW-SNVBAGLBSA-N 281.276 -0.967 5 20 CBBD C[C@@H](CN(C)C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 168904125 IAHNYXZGBHSHDT-GXSJLCMTSA-N 271.321 -0.308 5 20 CBBD COCCN(CCO)C(=O)CCn1cc([N+](=O)[O-])cn1 270199183 GMSXXWUXULKIHZ-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD CNC(=O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273151750 HXKJVYYPUIVHEY-UHFFFAOYSA-N 280.288 -0.747 5 20 CBBD O=C(N[C@@H]1CCCN(CCCO)C1)c1cc([N+](=O)[O-])[nH]n1 295492127 OQJLZTJYLVXWJY-SECBINFHSA-N 297.315 -0.106 5 20 CBBD CN(CC(N)=O)c1nccc(C(=O)O)c1[N+](=O)[O-] 310918116 QSZGMZSFNIXSBY-UHFFFAOYSA-N 254.202 -0.391 5 20 CBBD CN(C)C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 330610844 OAGYLXGTNGZBCX-MRVPVSSYSA-N 283.288 -0.280 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342469815 QUPHYVJWVWKJOG-RQJHMYQMSA-N 270.245 -0.542 5 20 CBBD Cn1nnnc1CNC(=O)c1cccc([N+](=O)[O-])c1O 389378911 BYQXORQGPONYAB-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD O=C(NCCn1ncnn1)c1ccc(O)c([N+](=O)[O-])c1 436976648 POGAXBHBLBAGSH-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD C[C@@H]1[C@@H](CO)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 488810911 WUCCSYUSPSLFCE-CKYFFXLPSA-N 284.316 -0.145 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CC[C@H](CO)[C@H](O)C2)n1 578466855 UTZNJPLECJCDRB-NXEZZACHSA-N 270.289 -0.534 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C1(n2cnnn2)CC1 597410771 QFLWSNJPMUEOGG-UHFFFAOYSA-N 292.259 -0.917 5 20 CBBD CNS(=O)(=O)CCn1cc(Cl)cc([N+](=O)[O-])c1=O 598712119 YTUMAZLOZFPKRK-UHFFFAOYSA-N 295.704 -0.041 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC)C(N)=O 760060816 QDXALBRYFHXUDY-SECBINFHSA-N 297.267 -0.167 5 20 CBBD C[C@H](COC(=O)c1cn(CC(=O)N(C)C)nn1)[N+](=O)[O-] 813103415 QCKKRJHXPFJTHO-SSDOTTSWSA-N 285.260 -0.812 5 20 CBBD CC(=O)c1cn(CC(=O)OCCC[N+](=O)[O-])nn1 860919165 JYRYTARIMHRYGT-UHFFFAOYSA-N 256.218 -0.309 5 20 CBBD Cc1cncc([N+](=O)[O-])c1N1CCN(CC(N)=O)CC1 1116729464 SUXPMMXTJLSOQJ-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD Cn1ccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1=O 1126943741 WAYAIVVPMJCRGO-GHMZBOCLSA-N 294.311 -0.744 5 20 CBBD Cc1nc(=NC(=O)c2n[nH]cc2[N+](=O)[O-])n(C)[nH]1 1325376853 UMEAUNYWTDDGCO-UHFFFAOYSA-N 251.206 -0.571 5 20 CBBD NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1326298412 SJFRLZNYDSFSBP-SECBINFHSA-N 280.284 -0.436 5 20 CBBD CNC(=O)CCN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1330033848 CKOCBYQZJZXEMG-UHFFFAOYSA-N 281.272 -0.339 5 20 CBBD C[C@@H](c1nnc(N2CCS(=O)CC2)n1C)[N+](=O)[O-] 1338832367 JSVUBVOPLZKNAG-ZETCQYMHSA-N 273.318 -0.279 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@](C)(O)C(=O)O)n1 1597899574 MBJYHWKXQAEFDG-SNVBAGLBSA-N 286.244 -0.623 5 20 CBBD COCC(=O)NC[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1756251421 ZQEPHMWAERXCBJ-ZYUZMQFOSA-N 285.300 -0.691 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 185512721 QLKIDKLCHYQBHB-BDAKNGLRSA-N 284.272 -0.601 5 20 CBBD COC[C@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 228343494 KTFIQUQYNPVMEK-ONGXEEELSA-N 288.304 -0.861 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)[C@@H]2C)c1[N+](=O)[O-] 264184994 ALXXQPYPJDDEGI-LURJTMIESA-N 267.245 -0.413 5 20 CBBD COC[C@@H](CCO)Nc1ncc([N+](=O)[O-])c(N)n1 265840022 SEAUNGDIYYIBMJ-ZCFIWIBFSA-N 257.250 -0.224 5 20 CBBD CN1CCO[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 330525977 KNAFLFYMHVRARZ-SSDOTTSWSA-N 269.261 -0.622 5 20 CBBD CCn1cc(S(=O)(=O)NCC(C)(C)O)c([N+](=O)[O-])n1 339048413 MYRWTRRRCILUFP-UHFFFAOYSA-N 292.317 -0.140 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC1(O)CCC1 353476711 AOHKSUCXMMFOHC-NSHDSACASA-N 284.316 -0.001 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN1CCCOCC1 353698287 VMWAGFFKXXMCHC-UHFFFAOYSA-N 297.315 -0.220 5 20 CBBD O=C(NCCNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1cc[nH]n1 354638893 VSKIFHROFNCAPS-UHFFFAOYSA-N 293.243 -0.799 5 20 CBBD CC(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])nn1C 356488631 ZOKXCXKONSOSKJ-UHFFFAOYSA-N 269.261 -0.417 5 20 CBBD COC(=O)c1n[nH]cc1NC(=O)Cn1cc([N+](=O)[O-])cn1 356880093 UGOPWQVJJARHIU-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(CCO)CCOC)n1 427709610 KIAJWHAZCBLERE-UHFFFAOYSA-N 286.288 -0.108 5 20 CBBD CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCNC1=O 442942808 NCQOAZITZBTWLP-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD O=C(NC[C@@H]1CN2CCN1CC2)c1c[nH]nc1[N+](=O)[O-] 548958880 DRBPIBITLBATPE-MRVPVSSYSA-N 280.288 -0.953 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H](O)CO)c1 561383138 WXPCMEXYDPEBBB-QWRGUYRKSA-N 286.284 -0.723 5 20 CBBD Nc1nccc(C(=O)N2CCOC[C@@H](O)C2)c1[N+](=O)[O-] 581558331 MWVZLXMMGYGSMW-ZETCQYMHSA-N 282.256 -0.595 5 20 CBBD NC(=O)C1(NC(=O)CCn2cc([N+](=O)[O-])cn2)CCC1 610976470 HRWJHDBWXOVUKA-UHFFFAOYSA-N 281.272 -0.294 5 20 CBBD O=[N+]([O-])c1cnc(N2CCC(NCCO)CC2)nc1 686270423 ZDAFJYSYRIQHLY-UHFFFAOYSA-N 267.289 -0.065 5 20 CBBD Cn1[nH]c(COC(=O)c2cc([N+](=O)[O-])cnc2N)nc1=O 765501337 GKLKIGVYNNMBSL-UHFFFAOYSA-N 294.227 -0.649 5 20 CBBD C[S@@](=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 770440609 PSWOTSODPMNRHJ-GOSISDBHSA-N 273.270 -0.196 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccon1 1001075040 RIFGJSXQPLBSAH-PSASIEDQSA-N 294.267 -0.472 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](N)C1 1326862890 MLDWSTKYCCYBLM-SSDOTTSWSA-N 253.262 -0.108 5 20 CBBD COC[C@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 1336601135 NTAIKRDHXALPBY-SECBINFHSA-N 286.288 -0.387 5 20 CBBD CO[C@H]1CN[C@](C)(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1573960179 GDFACNJZNFQKEW-PWSUYJOCSA-N 297.315 -0.326 5 20 CBBD C[C@@H]1[C@H](C(=O)O)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1594166603 YOASSKKSCBJOTA-FBIMIBRVSA-N 298.299 -0.053 5 20 CBBD COC(=O)CN(CC(=O)O)Cc1onc(C)c1[N+](=O)[O-] 1598862956 WVAYMHYOKVKBRW-UHFFFAOYSA-N 287.228 -0.049 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](CO)[C@H](CO)C2)c1[N+](=O)[O-] 1602480960 PTYMEPHFQBVPST-YUMQZZPRSA-N 297.267 -0.275 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)NCC(=O)O 41031393 PFHQOLDLCUELLY-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD CC1(C)CC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 266611040 RFGFKTIJBWLPGK-SECBINFHSA-N 296.283 -0.063 5 20 CBBD C[C@H]1CC(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)=NO1 270855311 RQGJZTWIWIJUMF-ZETCQYMHSA-N 280.240 -0.005 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285310387 WTZZUVDDNDGWHE-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD C[C@H](O)CN(CCO)c1ncc([N+](=O)[O-])c(N)n1 291140202 NUAIZRWGARONEI-LURJTMIESA-N 257.250 -0.854 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@](F)(CO)C2)c1 338597872 YLCSMJFNSZZEPI-QWRGUYRKSA-N 288.279 -0.442 5 20 CBBD CN1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C(=O)N1 349691956 IOIGHPDCLWLJEJ-JTQLQIEISA-N 278.268 -0.401 5 20 CBBD COC[C@H](CO)NC(=O)CCn1cc([N+](=O)[O-])nc1C 357704371 DCCPCGJVYFUTTE-VIFPVBQESA-N 286.288 -0.387 5 20 CBBD CN1CC[C@](O)(CNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 358486689 UYYYELJUJGXTAO-LBPRGKRZSA-N 295.299 -0.400 5 20 CBBD CO[C@@H]1COC[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 458339268 CNLMJHMQYQHIBO-NKWVEPMBSA-N 256.218 -0.539 5 20 CBBD CN(CCO)S(=O)(=O)c1cccnc1[N+](=O)[O-] 533552613 YWNFXOGIVXGYAT-UHFFFAOYSA-N 261.259 -0.397 5 20 CBBD COC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548410327 QASXTQLAPQNCOE-UHFFFAOYSA-N 254.202 -0.525 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 588863770 KHQRDTXQQWZOFE-QMMMGPOBSA-N 299.331 -0.077 5 20 CBBD CCOC(=O)C[C@H](CO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 590384666 PHIDTROSKMDABZ-ZCFIWIBFSA-N 286.244 -0.638 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)C1CC1 771028091 FMJWBGVVBYRBGH-VIFPVBQESA-N 254.246 -0.322 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)C1CC1 771041567 IWSUULZRQBOCHC-MRVPVSSYSA-N 254.246 -0.322 5 20 CBBD O=C(O)[C@H]1C[C@@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 833181573 PZLMAMXJCPFQPM-WDSKDSINSA-N 270.201 -0.550 5 20 CBBD COC(=O)N(C)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 855938972 WWVNGLXHNBMZJK-UHFFFAOYSA-N 299.287 -0.004 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnco1 1003374845 ZLKWPMREWBOPBX-RKDXNWHRSA-N 294.267 -0.472 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2ncnn2C)c1=O 1116122107 XEYDNNWAOKJIPU-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1C[C@@H](C(=O)O)C1 1118492255 IFUCSKBVQGZUSL-WCABBAIRSA-N 298.299 -0.053 5 20 CBBD COCCNC(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1318438494 CZZCJRMSEMGDAP-UHFFFAOYSA-N 285.260 -0.881 5 20 CBBD Cc1[nH]nc(C(=O)N2CCS(=O)(=O)CC2)c1[N+](=O)[O-] 1318489821 HVHNZNNEEZKRIE-UHFFFAOYSA-N 288.285 -0.503 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@H]2C(=O)O)c1[N+](=O)[O-] 1607500569 RWHCGXVJMOQOEH-YFKPBYRVSA-N 254.202 -0.075 5 20 CBBD COc1cc(CNC[C@@H](O)C(=O)O)c([N+](=O)[O-])cc1O 1777308998 MBYDISBBKCKMGM-SECBINFHSA-N 286.240 -0.156 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)NC(N)=O)c1 43927050 IQACHCKIXRKTCD-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD CC(=O)NC1CN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C1 190529352 PPVJVSNYMSGYST-UHFFFAOYSA-N 295.299 -0.163 5 20 CBBD Nc1nc(NCCN2C(=O)CCC2=O)ncc1[N+](=O)[O-] 265003052 DLCCNHWITZTFDK-UHFFFAOYSA-N 280.244 -0.472 5 20 CBBD COC(=O)c1cc(C(=O)NC(CO)CO)cc([N+](=O)[O-])c1 271373209 QZZQXXMWXRIWCK-UHFFFAOYSA-N 298.251 -0.536 5 20 CBBD CCN1CCN(CCNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 331018303 ZAEFRBWXSWOCEY-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD Nc1ccnc(CNC(=O)c2cnc(O)c([N+](=O)[O-])c2)n1 352061649 YWXXRMUQDLUHTR-UHFFFAOYSA-N 290.239 -0.002 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1c([N+](=O)[O-])cnn1C 357273388 MHEKPECVAPADJG-UHFFFAOYSA-N 286.288 -0.609 5 20 CBBD NC(=O)CC1(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1 569588989 DIRQFIJMBAOQLJ-UHFFFAOYSA-N 293.283 -0.043 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 593814523 AKVMQTGLTCXFIT-HTQZYQBOSA-N 284.272 -0.152 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)CCO)c1[N+](=O)[O-] 594319119 WFUFSMIGATVRFM-SSDOTTSWSA-N 268.273 0.532 5 20 CBBD COC(=O)[C@H](N)Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 594650500 VKGHCESTXQBVOS-SECBINFHSA-N 292.255 -0.387 5 20 CBBD Cn1nnc2c(NCCn3cc([N+](=O)[O-])cn3)ncnc21 596166184 QNYJFPORIZGNHM-UHFFFAOYSA-N 289.259 -0.025 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 597654218 PSCQSZJBWZLISZ-ZETCQYMHSA-N 256.262 -0.425 5 20 CBBD CNc1ccc(C(=O)N[C@H](COC)C(N)=O)cc1[N+](=O)[O-] 760085398 XMCYGBJEASZINN-SECBINFHSA-N 296.283 -0.133 5 20 CBBD COC(=O)CNC(=O)COC(=O)c1ccc([N+](=O)[O-])n1C 805760589 NEQGEALVQXBZQE-UHFFFAOYSA-N 299.239 -0.621 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)CCCN1C(=O)CNC1=O 814040743 KPAOTIBTOHNAKX-ZETCQYMHSA-N 273.245 -0.473 5 20 CBBD C[C@@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC[C@H]1CCCO1 840673238 VGKLSBVTIVZAQQ-ZYUZMQFOSA-N 286.284 -0.122 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NOC(C)(C)CO 857284720 GOIUBTGNYFWXQT-UHFFFAOYSA-N 272.261 -0.082 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCCN(CCCO)C2)C1 981764145 OIDOEDAYDGEOAJ-VXGBXAGGSA-N 297.355 -0.042 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cccnn1 998292552 NQHZNEYJXOIMPZ-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD C[C@@H](C(=O)Nc1c([N+](=O)[O-])cnn1C)S(C)(=O)=O 1255525118 CAXFHOLVDBMYTG-YFKPBYRVSA-N 276.274 -0.300 5 20 CBBD NC(=O)C1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1320949231 PVDUGROKPOESLU-UHFFFAOYSA-N 267.245 -0.345 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(Cc2cn[nH]c2)c1=O 1323521455 ZCULFAVENWKOLG-UHFFFAOYSA-N 263.213 -0.373 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1326995727 FQGTXRHCDCLGTM-SFYZADRCSA-N 284.272 -0.558 5 20 CBBD Cn1cnnc1COC(=O)Cn1cc([N+](=O)[O-])cn1 1524704082 IXZDZYIDPCHMII-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 1601749050 ABUAMAFAGUKUKU-ZJUUUORDSA-N 284.272 -0.299 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCC[C@H]1C(=O)O 1608380226 ITKGRMHSMHIELJ-RNFRBKRXSA-N 283.244 -0.444 5 20 CBBD O=C(O)C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 1608699799 IKFZJPCWSGHFMD-ZCFIWIBFSA-N 284.228 -0.366 5 20 CBBD CNC(=O)c1ccc(N(C)CC(N)=O)c([N+](=O)[O-])c1 48893359 LHVFZACUUYUAIJ-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD O=C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 50127006 RKHDXUFEQVMZBA-UHFFFAOYSA-N 252.230 -0.017 5 20 CBBD Cc1nn(C)c(C(=O)NCCOCCN(C)C)c1[N+](=O)[O-] 345927122 IGTOSFXAVDPRDJ-UHFFFAOYSA-N 299.331 -0.055 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])cnc2O)n1 429646808 NTCUUJRXNLTBQY-UHFFFAOYSA-N 279.216 -0.851 5 20 CBBD C[C@](NC(=O)Cn1cnc([N+](=O)[O-])n1)(C(=O)O)C1CC1 538503428 PZGOCOINAKXESE-SNVBAGLBSA-N 283.244 -0.444 5 20 CBBD NC(=O)COC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 778896172 ILWITXXLWHPSDO-UHFFFAOYSA-N 268.181 -0.034 5 20 CBBD COC[C@](C)(NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)O 831627924 SFIRHAXHWIYRLN-JTQLQIEISA-N 286.244 -0.154 5 20 CBBD O=C(O)Cn1cc(CCn2cc([N+](=O)[O-])cn2)nn1 833273254 FLEIOAQAASZZDK-UHFFFAOYSA-N 266.217 -0.290 5 20 CBBD O=C1CC[C@@H](COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)N1 845109824 ZCZATLGJCJJXQZ-QMMMGPOBSA-N 295.251 -0.422 5 20 CBBD CN(C(=O)C(N)=O)C1CN(Cc2csc([N+](=O)[O-])c2)C1 1043716578 KMFWODARJSWHHD-UHFFFAOYSA-N 298.324 -0.216 5 20 CBBD COC(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1263557850 ISXKMZVIFOBUNI-UHFFFAOYSA-N 284.276 -0.520 5 20 CBBD Cc1nn(C)c(C(=O)NN2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 1323520114 JFKSYUMADNYQOU-UHFFFAOYSA-N 296.243 -0.824 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1328676708 DPCQUACCSIOBND-VIFPVBQESA-N 256.218 -0.801 5 20 CBBD N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 1580397860 HNNYZWHNEBYXER-VHSXEESVSA-N 291.311 -0.014 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc(F)ccc1[N+](=O)[O-] 37669348 NLFUYPGUKIQTTM-QMMMGPOBSA-N 286.215 -0.002 5 20 CBBD CC(C)N(CC(N)=O)C(=O)CCn1cc([N+](=O)[O-])cn1 264032305 MZRLBFHKTNOVOQ-UHFFFAOYSA-N 283.288 -0.096 5 20 CBBD CN(C)C(=O)[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330550468 XDYKFZHRFYKBMF-MRVPVSSYSA-N 296.287 -0.735 5 20 CBBD CC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)CC1 408117323 AJKLHFICQYZDQV-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 445211578 KPTWYPIQQGOSIO-SSDOTTSWSA-N 299.239 -0.651 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@H](CO)[C@H](O)C1 561784858 NAQOLDHVJGWQRK-ZYHUDNBSSA-N 297.311 -0.568 5 20 CBBD COCCN(CCn1ccc([N+](=O)[O-])n1)CC(=O)O 568068130 FAFFXLYUKCVHGL-UHFFFAOYSA-N 272.261 -0.176 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)Cn1nnnc1CN 574808626 FSVKVODAQGJJLR-UHFFFAOYSA-N 291.271 -0.013 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 588865186 YJOMTDDQRPNXAM-SSDOTTSWSA-N 271.277 -0.721 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1cc([N+](=O)[O-])n[nH]1 592468541 BORWSKXAUSOXSI-UHFFFAOYSA-N 282.304 -0.705 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)c1n[nH]cc1[N+](=O)[O-] 598184092 UCDMSMBMTOFMJA-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2ncccn2)c1 702361680 CVYPFOLWHVULCO-JTQLQIEISA-N 278.272 -0.268 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 846493310 VFCKREZVQFBRFC-UHFFFAOYSA-N 282.256 -0.026 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccoc1 990228229 BDGSWZXZCJPFKL-NXEZZACHSA-N 279.252 -0.115 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1118317609 RLHPCHYLCBVUAY-CBAPKCEASA-N 296.283 -0.543 5 20 CBBD O=C(NCCNCCCN1CCCC1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126949776 ZIAHVQYYTTUQAJ-GHMZBOCLSA-N 298.343 -0.630 5 20 CBBD CNC(=O)[C@@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 1326503820 WDZAYSNVSMJLRD-GHMZBOCLSA-N 283.284 -0.675 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1[C@H]2CNC[C@H]12 1580578467 FPZCRQYSGVDACK-UWVGGRQHSA-N 292.295 -0.662 5 20 CBBD NC(=O)NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1 3506510 JYROKPYFPFZZHM-UHFFFAOYSA-N 267.197 -0.054 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)COc1cccc([N+](=O)[O-])c1 36816441 NUSNLIZLNPTASW-SNVBAGLBSA-N 298.251 -0.376 5 20 CBBD NC(=O)CCNS(=O)(=O)c1csc([N+](=O)[O-])c1 119575053 FANNDUKDPBSUIR-UHFFFAOYSA-N 279.299 -0.190 5 20 CBBD COC(=O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173500510 PERDDESQEKOUHH-VIFPVBQESA-N 272.261 -0.743 5 20 CBBD NC(=O)COCCNC(=O)c1cc([N+](=O)[O-])ccc1F 230047951 IDMYABDJXKNPAW-UHFFFAOYSA-N 285.231 -0.034 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 263796383 KWBNNJHHSJYUCG-ZETCQYMHSA-N 270.245 -0.283 5 20 CBBD COC(=O)[C@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 267798289 KNRPTDIRFSLSKP-SNVBAGLBSA-N 284.272 -0.335 5 20 CBBD CN1CC[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 330708098 MYIXBKOXUJHKAH-VIFPVBQESA-N 267.289 -0.141 5 20 CBBD CCCN(CC(N)=O)C(=O)c1c([N+](=O)[O-])c(C)nn1C 346875844 CXMDZSQJMAVAOT-UHFFFAOYSA-N 283.288 -0.026 5 20 CBBD COC(=O)[C@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 361668668 YOQVMGCFRFYBJL-SECBINFHSA-N 271.233 -0.697 5 20 CBBD O=C(CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)NCC1CC1 393084282 TZTOKIFCRLFFDM-NSHDSACASA-N 297.315 -0.732 5 20 CBBD C[S@@](=O)C1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 442936944 VAXKXFOYVVWRTO-LJQANCHMSA-N 286.313 -0.181 5 20 CBBD CNc1nccc(C(=O)N(C)[C@@H]2COC[C@H]2O)c1[N+](=O)[O-] 521641545 LDUDUURPEQFQNT-RKDXNWHRSA-N 296.283 -0.137 5 20 CBBD COCCOCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 540549192 RGYPXXOODYTDOI-UHFFFAOYSA-N 284.272 -0.035 5 20 CBBD CN(C)CCn1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])n1 548948876 QYORNEXRHMXKCS-UHFFFAOYSA-N 293.287 0.328 5 20 CBBD CNc1nccc(C(=O)N(C)CCCO)c1[N+](=O)[O-] 579972116 NSZZVRJJNPHYSZ-UHFFFAOYSA-N 268.273 0.486 5 20 CBBD O=C(C[C@@H]1CCNC1)NCCn1cc([N+](=O)[O-])cn1 592223116 GVNKQUOBZYWWMI-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD Nc1nc(N[C@H]2C[C@@H](C(N)=O)C2)ncc1[N+](=O)[O-] 593491803 IJAGEDARRDGMSJ-URHBZAFASA-N 252.234 -0.357 5 20 CBBD NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1 611504342 ONNUSBGEWWRWAI-UHFFFAOYSA-N 264.201 -0.003 5 20 CBBD CN1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 615928941 LSKUUECLKBIKKP-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD O=C1CC[C@@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CN1 748115999 IQGKCJFWFLGQFL-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD CCS(=O)(=O)CCN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 765289625 YVQCMHBUSYEJHK-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 771632982 KPRAJCSTSBRHOY-VIFPVBQESA-N 283.240 -0.559 5 20 CBBD CON(C)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 776565228 ZBHGOJIPBQMGDD-UHFFFAOYSA-N 271.277 -0.291 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1C(=O)O 828349911 VLUGYAZGBAPHDR-BQBZGAKWSA-N 283.244 -0.635 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@](C)(C(N)=O)C1 1116872052 WXWMHFCTWABSFM-NSHDSACASA-N 281.272 -0.334 5 20 CBBD Cc1conc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126939373 VSWVNFFKMMBBSP-PSASIEDQSA-N 268.273 -0.146 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H]2C[C@@]2(CO)C1 1320882364 SXMZCTGAFWPCIH-WKEGUHRASA-N 252.230 -0.228 5 20 CBBD Cn1ncnc1COC(=O)Cn1cc([N+](=O)[O-])cn1 1321269320 SYAZYICJELQTHR-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD CC(=O)NCCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1322223037 AQXRFWIFTCZNDR-UHFFFAOYSA-N 269.261 -0.118 5 20 CBBD CCN(CCO)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1324433296 MHMDOKKQEPGLGU-UHFFFAOYSA-N 269.257 -0.403 5 20 CBBD Cc1nn(C)c(C(=O)NCCn2ccnn2)c1[N+](=O)[O-] 1352898690 LRKTYRXYXXAUNG-UHFFFAOYSA-N 279.260 -0.342 5 20 CBBD COCC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1599213911 DJQYJGJRCWWSGX-LURJTMIESA-N 286.244 -0.452 5 20 CBBD O=C(O)[C@@H]1CC(F)(F)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1602172074 IASRAPQHCDUMFN-PBXRRBTRSA-N 264.184 -0.028 5 20 CBBD O=C(O)[C@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3069538 IBPLOWHOPAHVSQ-QMMMGPOBSA-N 290.253 -0.681 5 20 CBBD COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC(=O)O 20002222 VEHKQCVMEXBTSJ-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 54333517 SUJVGABBWLNUFI-ZCFIWIBFSA-N 256.218 -0.372 5 20 CBBD COCCNC(=O)CNc1ncc([N+](=O)[O-])cn1 228745933 GJPJKEYYYGUGGU-UHFFFAOYSA-N 255.234 -0.441 5 20 CBBD Cc1nn(CCC(=O)N[C@@H]2CNC(=O)C2)c(C)c1[N+](=O)[O-] 330736696 NKSJUCAKDHWRQG-VIFPVBQESA-N 295.299 -0.197 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)OC 354733411 PVTDGBNJKYJZOQ-LURJTMIESA-N 272.217 -0.764 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CCCCNC1=O 360600302 JFVALXGYEPLALF-SECBINFHSA-N 295.299 -0.082 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)COCC1CC1 360746173 OMNMGVMFRMLWEL-SECBINFHSA-N 298.299 -0.154 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H](C(=O)O)O1 431802370 WWGCUDNGDLRSNQ-HTRCEHHLSA-N 298.255 -0.358 5 20 CBBD CO[C@H]1COCC[C@H]1CN=c1nc(N)c([N+](=O)[O-])c[nH]1 450694058 NQVXCUKKSYRHRE-CBAPKCEASA-N 283.288 -0.148 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 567914435 UMTRTEIQQOPMFL-LURJTMIESA-N 294.223 -0.818 5 20 CBBD C[C@@H](N)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 592985014 ZXYQPJFOASHJDQ-MWLCHTKSSA-N 269.305 -0.161 5 20 CBBD C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)N(C)C 766969223 QOYFSVNPCKRJNJ-LURJTMIESA-N 270.245 -0.038 5 20 CBBD O=C1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CN1 809025959 JICKZVRGDZQOAI-MRVPVSSYSA-N 268.229 -0.387 5 20 CBBD Nc1ccc(NC(=O)C[C@@H]2NC(=O)NC2=O)cc1[N+](=O)[O-] 819905598 RSGWXCHRSWVRRB-ZETCQYMHSA-N 293.239 -0.286 5 20 CBBD NC(=O)[C@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840378250 CKYXTOAKPWOBBZ-UYXSQOIJSA-N 255.274 -0.188 5 20 CBBD CNC(=O)[C@@H](O)CNc1nccc(C(=O)OC)c1[N+](=O)[O-] 856745312 CJRLGKZDWJKWIT-ZETCQYMHSA-N 298.255 -0.705 5 20 CBBD CCOC(=O)C[C@H](O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 859720829 WHOHUWWBLCPRAR-XLPZGREQSA-N 261.230 -0.491 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)CN1CC(=O)N(C)C1=O 860788490 SORVFKDRJRIHEG-LURJTMIESA-N 259.218 -0.911 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCO[C@H](CC(=O)O)C2)n1 1321168693 ASWRESQTMDKKQB-SSDOTTSWSA-N 298.255 -0.356 5 20 CBBD C[C@@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)N(C)C 45107360 PQWHHYUQFNBSSM-ONGXEEELSA-N 271.321 -0.308 5 20 CBBD C[C@](O)(CNC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)O 90275014 NJKXXIPNCIMSCO-LBPRGKRZSA-N 298.251 -0.075 5 20 CBBD COC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 234848932 LZGQROMLQXQHES-SSDOTTSWSA-N 257.246 -0.330 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H](O)C[C@H]1CO 274806586 LPXCRIKXPNONPM-ONGXEEELSA-N 282.252 -0.132 5 20 CBBD CCOC(=O)c1ccnc(N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 277552349 XUJGWQXORJTXHH-IUCAKERBSA-N 297.267 -0.292 5 20 CBBD CNC(=O)CN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 349250617 YQMMNVIWXZJBOM-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1COCCN1 423723040 KZHZCQZLUCVCAE-JTQLQIEISA-N 291.267 0.398 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)CC(=O)N1CCNCC1 430620719 BNUQCRBSMRZPTD-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 444313257 GZDFPFCYAHXPCU-RQJHMYQMSA-N 284.272 -0.552 5 20 CBBD C[C@H](NC(=O)C(=O)NC1CNC1)c1cccc([N+](=O)[O-])c1 576612170 XUWGRYHRMODEAH-QMMMGPOBSA-N 292.295 -0.140 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 580575759 FAOBMWPVLIKGPG-JTQLQIEISA-N 267.245 -0.345 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 588863761 IXRHRPARYQZABG-MRVPVSSYSA-N 285.304 -0.711 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3COC[C@H]3C2)c1 601973328 KMSUOHVKUNXNAZ-JFGNBEQYSA-N 282.300 -0.270 5 20 CBBD COC[C@@](C)(O)C(=O)NCCn1cc([N+](=O)[O-])cn1 610892233 OZVTXCONDHTFEH-SNVBAGLBSA-N 272.261 -0.695 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 763235828 YCOQLSAXOCDOGV-LBPRGKRZSA-N 297.267 -0.169 5 20 CBBD Cc1nn(CN2CC(OCC(=O)N(C)C)C2)cc1[N+](=O)[O-] 779865487 PQUVGBPCLGAEPJ-UHFFFAOYSA-N 297.315 -0.154 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@](F)(C(=O)O)C1 833122596 OYVMXXNXPNCUGL-VIFPVBQESA-N 287.207 -0.789 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CCC1 1111899958 QATGUCQIBCSFOQ-UHFFFAOYSA-N 293.283 -0.074 5 20 CBBD CN1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 1118852497 MERQOYYQXCDZJQ-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD Cc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1C 1126936849 UOKWTRSYXCBAIX-GHMZBOCLSA-N 281.316 -0.400 5 20 CBBD NC[C@@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 1326492362 XWQTWDMTDDIWGL-QMMMGPOBSA-N 286.313 -0.041 5 20 CBBD C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1356533413 DECWMAAWRAUMRP-CBAPKCEASA-N 296.291 -0.974 5 20 CBBD COCCN1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC1 1519606304 MXIZEUGZTUEZOT-JTQLQIEISA-N 298.347 -0.079 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1C(=O)O 1594665040 MUCKQMYIQHVJST-MRVPVSSYSA-N 296.239 -0.502 5 20 CBBD Nc1nccc(C(=O)N[C@@H](CF)C(=O)O)c1[N+](=O)[O-] 1608278400 YTPHSLHIZNBMSP-YFKPBYRVSA-N 272.192 -0.276 5 20 CBBD CN1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 78020996 LVPBZCDPADCKMY-YFKPBYRVSA-N 252.234 -0.390 5 20 CBBD NC[C@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCO1 165009778 MERJKXGJYSIHOL-NSHDSACASA-N 294.311 -0.147 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cn1C 227045224 UHSUHNUCHGKLMN-QMMMGPOBSA-N 271.229 -0.803 5 20 CBBD NC(=O)NC(=O)OCCCn1cccc([N+](=O)[O-])c1=O 269377300 RAPLRGNNSJPZMN-UHFFFAOYSA-N 284.228 -0.049 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[C@H](C(=O)O)O1 276183031 SNZBELCYHVOEQZ-DTWKUNHWSA-N 298.255 -0.460 5 20 CBBD COC(=O)[C@@H](C)N(C)c1ncc([N+](=O)[O-])c(N)n1 280941553 JKHVWAPGIZMCJZ-RXMQYKEDSA-N 255.234 -0.035 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@]1(O)CCO[C@H]1C 331320635 BVFRGUCBMIFABZ-UFBFGSQYSA-N 298.299 -0.244 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 341933529 HLSBHWRAEQNUGA-SSDOTTSWSA-N 294.267 -0.216 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 345000346 OVYREVPBTMEYTK-UHFFFAOYSA-N 270.245 -0.585 5 20 CBBD Cn1c(C(=O)N2C[C@H](O)C[C@@H]2CO)ccc1[N+](=O)[O-] 347735677 RMEHIISGWDNKGA-HTQZYQBOSA-N 269.257 -0.499 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)N2CCCC2)c1[N+](=O)[O-] 348286795 BODVOIAOEDSHKU-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1COC[C@@H]1O 352801304 JVAKOYWVQAIGFC-MNOVXSKESA-N 283.284 -0.552 5 20 CBBD COC(=O)C[C@]1(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCOC1 354690135 IFWMCCYPNXXOCS-LLVKDONJSA-N 298.255 -0.230 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OC[C@H]1CNC(=O)O1 497034840 FDJFHYMFPICGIK-MRVPVSSYSA-N 297.223 -0.592 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1COCCO1 505462958 VWJLKPQOKICMHW-SNVBAGLBSA-N 297.267 -0.712 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCn3cncc3C2)c1 590599683 KNALSAKRHSPOBJ-LBPRGKRZSA-N 292.299 -0.136 5 20 CBBD Cn1c(C(=O)N2CC(N3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-] 593853846 GFEQYQVLMGOMKG-SNVBAGLBSA-N 294.311 -0.176 5 20 CBBD CN(CCC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 818463014 JPPOBRQMQRZTSW-SECBINFHSA-N 272.261 -0.441 5 20 CBBD CC(CO)(CO)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 846224615 ULTNZTJITNROOM-NSHDSACASA-N 298.295 -0.265 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](N2CCOC2=O)C1 855499454 YMRNXDGQBTVFKL-IWSPIJDZSA-N 269.257 -0.295 5 20 CBBD CCOC[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 862956470 XROUPDUHCMBDFY-OPRDCNLKSA-N 258.274 -0.085 5 20 CBBD C[C@H]1CN[C@H](C)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923362404 SMOJBSPALHTUBF-SCVCMEIPSA-N 283.332 -0.166 5 20 CBBD COCC(=O)N(C)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 1105325788 CEEXMUHRGYVFAZ-UHFFFAOYSA-N 298.303 -0.492 5 20 CBBD Cn1cncc1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1119217925 DPGCLOPGTHZFNR-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD NC(=O)c1cc(N2C[C@H](O)[C@H](O)C2)ccc1[N+](=O)[O-] 1330031249 USRMWXXAERKILQ-AOOOYVTPSA-N 267.241 -0.765 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCCNC1 1332412427 CXZFQDZEQJVUIS-VIFPVBQESA-N 280.284 -0.375 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 1344390508 BFGBBPDKMUUYMF-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD CN(C)C(=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 44991889 HQMACJMNVWWSKR-JTQLQIEISA-N 285.304 -0.780 5 20 CBBD NS(=O)(=O)CCNc1nc2ccccn2c1[N+](=O)[O-] 52357188 HISFACCYEZFFJZ-UHFFFAOYSA-N 285.285 -0.057 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C(=O)O 111252185 KCZQLFIXSWJPFH-CBAPKCEASA-N 282.256 -0.030 5 20 CBBD CNS(=O)(=O)CCNc1c([N+](=O)[O-])ncn1C 221045862 LMLFERCXBODZKS-UHFFFAOYSA-N 263.279 -0.711 5 20 CBBD C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](CO)O1 249504323 YBLLSBAKEAUGCJ-UWVGGRQHSA-N 270.289 -0.127 5 20 CBBD Cn1cc([C@@H](O)CNc2ncc([N+](=O)[O-])c(N)n2)cn1 266296163 XPWQKIXIQGXBEX-QMMMGPOBSA-N 279.260 -0.154 5 20 CBBD CC(=O)NC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 276298884 QGTVIZOZRISQPG-UHFFFAOYSA-N 267.245 -0.862 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N(C)C[C@H](O)CO 288884474 MSESDFGROIAPIL-QMMMGPOBSA-N 258.278 -0.091 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H]2CC[C@H](O)C2)c1 300698898 PKTZYNWMZWIIKH-ADEWGFFLSA-N 284.316 -0.097 5 20 CBBD CCCN(CC(N)=O)C(=O)c1n[nH]cc1[N+](=O)[O-] 346860023 BRVRFJGMZKGECX-UHFFFAOYSA-N 255.234 -0.345 5 20 CBBD C[C@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C[C@H]1O 611257458 OILALQIQUSKNRP-JGVFFNPUSA-N 287.297 -0.009 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1C[C@H]1C(=O)O 715294818 ILKHXKIXVPPADX-HTRCEHHLSA-N 268.229 -0.372 5 20 CBBD C[S@@](=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 735115999 WWGICAXNFPYXQI-GOSISDBHSA-N 273.270 -0.196 5 20 CBBD COC[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])C(N)=O 760043457 HMGHRALSGFXMGH-MRVPVSSYSA-N 285.231 -0.036 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCCn1ncnn1 801922053 DTHIRBFHJZWGAM-UHFFFAOYSA-N 295.234 -0.267 5 20 CBBD C/C=C(\C)C(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042976750 RZMBUZFQYGFXTI-ZCFALZCBSA-N 297.311 -0.693 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@H]2C[C@]2(CO)C1 1116942196 KNAIGJBLWSNEQD-LHLIQPBNSA-N 252.230 -0.228 5 20 CBBD Cn1cnc(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 1319688096 FXJFAJQYKYJZRJ-UHFFFAOYSA-N 292.255 -0.799 5 20 CBBD CC(C)S(=O)(=O)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1328771516 LOHBUNJPRMKCHM-RNFRBKRXSA-N 250.276 -0.152 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCc2nn(C)c(=O)cc2C1 1330997203 DLJPUZCBAXBWNE-UHFFFAOYSA-N 290.283 -0.015 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCC(=O)NCCC(=O)O 1608122713 DPJULUCZMDAHTJ-UHFFFAOYSA-N 299.239 -0.319 5 20 CBBD CC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 35203577 QEWSUKXBQDNUKB-LURJTMIESA-N 255.230 -0.216 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1cccc([N+](=O)[O-])c1 40507799 QNFWZCRRIUMNBZ-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD NC(=O)CONC(=O)c1ccc([N+](=O)[O-])cc1F 89508913 KFXNFDPRWCAVSF-UHFFFAOYSA-N 257.177 -0.119 5 20 CBBD Cc1ccn(Cc2n[nH]c(=O)[nH]2)c(=O)c1[N+](=O)[O-] 91588213 COULCIPNROXLDN-UHFFFAOYSA-N 251.202 -0.475 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CNC(CO)CO)cc1 134757653 UAPNQZSNZLAKEC-LLVKDONJSA-N 256.258 -0.429 5 20 CBBD CN1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1=O 156648023 WEMOAOFOGYPJDN-UHFFFAOYSA-N 278.268 -0.028 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](CO)C(=O)O 164790544 BMMIQABCHJZIMF-QMMMGPOBSA-N 284.224 -0.221 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 449703326 VXPSAIWJRMTVNJ-SNVBAGLBSA-N 294.311 -0.066 5 20 CBBD COC(=O)[C@H](C)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 525702020 NLZPYPITWFWZQG-LURJTMIESA-N 289.269 -0.170 5 20 CBBD COC(=O)CN(CCn1cc([N+](=O)[O-])cn1)CC(=O)O 831175745 QTFYVSVDHPIKPI-UHFFFAOYSA-N 286.244 -0.649 5 20 CBBD C[C@H]1CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C)CO1 855405961 BFKGWKHOGUUEHD-UKKRHICBSA-N 271.317 -0.123 5 20 CBBD CC[C@@H]1C(=O)NCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 886503055 AEFPAFUDLPUOHK-IWSPIJDZSA-N 255.274 -0.221 5 20 CBBD O=C1NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]12 1322326273 VLUBNYAEUQDQST-LURJTMIESA-N 294.223 -0.436 5 20 CBBD CNC[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350908264 CAIRCBPLKBETHL-PWSUYJOCSA-N 283.332 -0.307 5 20 CBBD O=C1NCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 1350934587 DAUFCDGIAQXVPO-QMMMGPOBSA-N 267.245 -0.956 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCNC[C@@H]1F 1580579152 ZFSMHYAVJVHNMJ-IUCAKERBSA-N 298.274 -0.427 5 20 CBBD C[C@@](O)(CO)CNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 1589993330 SXPNEDSNXZDUSE-NSHDSACASA-N 294.271 -0.070 5 20 CBBD Cc1nn(C)c(C(=O)O[C@@H](C)C(=O)C(=O)O)c1[N+](=O)[O-] 1610569235 QVHCGCQODZYWQR-YFKPBYRVSA-N 285.212 -0.164 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccccc1[N+](=O)[O-] 35160308 GWTQVCGMPVRDCU-MRVPVSSYSA-N 268.225 -0.142 5 20 CBBD CNC(=O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 105855444 NRCZQCBDUIZPGU-SNVBAGLBSA-N 253.258 -0.036 5 20 CBBD CN(C)C(=O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 127206846 NZQAGDZYTBWSBG-UHFFFAOYSA-N 269.261 -0.662 5 20 CBBD CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 227263765 SMBPVZIJEXINSE-ZETCQYMHSA-N 257.202 -0.248 5 20 CBBD CO[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 227264133 QQCCEDFTQUMKKW-SSDOTTSWSA-N 272.217 -0.993 5 20 CBBD Cc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 227869863 RUDGKAQTDHOOTO-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)CC(=O)O 262162438 CXNBOSXKSPIEAF-MRVPVSSYSA-N 297.267 -0.017 5 20 CBBD Cc1nonc1C(=O)NCCn1cc([N+](=O)[O-])cn1 269163338 VUZJHMVSFXKCDO-UHFFFAOYSA-N 266.217 -0.087 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 387668381 PBKJDGBBTIWMPQ-SVGQVSJJSA-N 271.229 -0.833 5 20 CBBD Cc1nnnn1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 432734364 ROTHAAXFIZKODL-MRVPVSSYSA-N 253.222 -0.853 5 20 CBBD O=C(NCCNC(=O)c1c[nH]nc1[N+](=O)[O-])c1cc[nH]n1 548745368 GXEXCHWTSLOGHB-UHFFFAOYSA-N 293.243 -0.799 5 20 CBBD Cn1cnc(NC(=O)c2cc([N+](=O)[O-])cnc2N)n1 573872193 FBLGCPXAXJFTPI-UHFFFAOYSA-N 263.217 -0.047 5 20 CBBD Nc1nc(N[C@@H]2C[C@H](C(=O)O)C[C@@H]2O)ncc1[N+](=O)[O-] 595977564 GYJUZLISXHORIX-BFHQHQDPSA-N 283.244 -0.397 5 20 CBBD Nc1ccc(NC[C@H]2CC[C@@H](CO)O2)nc1[N+](=O)[O-] 596240156 RVDVRPFPNKKUIN-SFYZADRCSA-N 268.273 0.524 5 20 CBBD NC(=O)CC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 787944422 RAGWORLCPSOOHN-UHFFFAOYSA-N 281.224 -0.388 5 20 CBBD CN(CCCN(C)c1ccc([N+](=O)[O-])cn1)C(=O)C(N)=O 1112175547 JGBXGBAGPTXWRX-UHFFFAOYSA-N 295.299 -0.240 5 20 CBBD O=C(NCCNCc1cccnc1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932284 QFSXLGNMJXPZRK-GHMZBOCLSA-N 264.285 -0.047 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 1348511645 SZBDFYRYGHSXPS-MRVPVSSYSA-N 282.304 -0.707 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC(=O)NC1CC1 10452158 SPYHEEWMQMEBQC-UHFFFAOYSA-N 280.240 -0.255 5 20 CBBD NC(=O)NCC(=O)NCCNc1ccccc1[N+](=O)[O-] 15093581 PCFYSFGLCRXAQE-UHFFFAOYSA-N 281.272 -0.209 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 50702259 FZXORUURBQIWGT-UHFFFAOYSA-N 252.230 -0.347 5 20 CBBD CN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 120599023 QBSFNLKVNLJGAD-UHFFFAOYSA-N 267.245 -0.610 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249582286 RPWNIWADJOUSQK-GXSJLCMTSA-N 297.315 -0.685 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CN2C[C@H](O)[C@H](O)C2)c1 278717476 KMLDZBBXBYPQCP-RTXFEEFZSA-N 298.295 -0.628 5 20 CBBD Cc1cc(OCC(=O)NCC(N)=O)ccc1[N+](=O)[O-] 299624565 IEQVDKSLXAJJIG-UHFFFAOYSA-N 267.241 -0.116 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@]1(CCO)CCOC1 331353179 XXVNUGZKQQFACO-LLVKDONJSA-N 284.272 -0.551 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342299775 BVDGXMHVXYQBSK-YUMQZZPRSA-N 284.272 -0.288 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 352057195 ITDHNJRGAWGHIO-ZETCQYMHSA-N 280.240 -0.215 5 20 CBBD C[S@](=O)CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 352689147 KJJKJGWTFNXENY-KRWDZBQOSA-N 260.275 -0.184 5 20 CBBD C[C@@H]1NCC[C@@H](C)[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 357295158 JTWOCKPBKPGEJD-KHQFGBGNSA-N 282.304 -0.311 5 20 CBBD CO[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1OC 357687601 HHUDFXXPNMNNFR-RKDXNWHRSA-N 296.283 -0.061 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360647004 LICZWPIMJHSDCF-NSHDSACASA-N 285.304 -0.629 5 20 CBBD CN1C[C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C(=O)N1 554452979 ORMTXZPYZJUCED-LLVKDONJSA-N 292.295 -0.011 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 568727437 YOKFLYGTHYKKNA-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(c2c([N+](=O)[O-])ncn2C)C1 592003596 ITKYBBXTMRJIBY-YUMQZZPRSA-N 284.272 -0.312 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592307352 FYVNEPKQNNZGFK-SVRRBLITSA-N 269.261 -0.494 5 20 CBBD NC(=O)NC(=O)COC(=O)c1cc(O)cc([N+](=O)[O-])c1 769044793 DIKLHJBBGKXVFI-UHFFFAOYSA-N 283.196 -0.348 5 20 CBBD CNS(=O)(=O)CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 819894015 ZKGNGPAFLQSPRU-UHFFFAOYSA-N 288.285 -0.335 5 20 CBBD C[C@@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820178009 XSPCUITWGQDHKG-ZCFIWIBFSA-N 270.197 -0.227 5 20 CBBD O=C(Cc1ccoc1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990992218 VDOZHPIJHKKDPY-GHMZBOCLSA-N 293.279 -0.186 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CC[C@H](C(N)=O)C1 1263465423 PSSYLFFTWUTQHT-QMMMGPOBSA-N 282.304 -0.664 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1cnc[nH]1 1318764462 AXJRJOKOXHLAKL-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1323961116 XYPSVZTZTGDXEH-HTQZYQBOSA-N 296.283 -0.325 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCn1cnnc1 1330849207 JCZVKWMMSQFBKX-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD CCc1[nH]nc(C(=O)N=c2nc[nH]n2C)c1[N+](=O)[O-] 1339071830 YUCSXVOUCSVONB-UHFFFAOYSA-N 265.233 -0.317 5 20 CBBD NC(=O)C[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 1342950620 HUMOCJYRKUUCJU-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1356533396 DECWMAAWRAUMRP-APPZFPTMSA-N 296.291 -0.974 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H]1C(=O)O 1601028807 KDGVZLDMTJBDMT-RXMQYKEDSA-N 254.202 -0.373 5 20 CBBD CNC(=O)CNC(=O)COc1ccccc1[N+](=O)[O-] 25199468 FEOXITPWMPTCMZ-UHFFFAOYSA-N 267.241 -0.164 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 40218725 VKDYENOCQLEAKY-UHFFFAOYSA-N 273.270 -0.387 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1cc([N+](=O)[O-])c[nH]1 40507970 CLHKQMSSMCBPKY-UHFFFAOYSA-N 281.272 -0.916 5 20 CBBD COC[C@@H](O)CCNc1ncc([N+](=O)[O-])c(N)n1 270754981 BLMUJEUSLNPRJD-LURJTMIESA-N 257.250 -0.224 5 20 CBBD Nc1nc(NC[C@H]2CCCS2(=O)=O)ncc1[N+](=O)[O-] 301698130 CYQBMFWLNDZFSC-ZCFIWIBFSA-N 287.301 -0.044 5 20 CBBD COC(=O)C1(O)CCN(c2ncc([N+](=O)[O-])cn2)CC1 354590304 UJQSGMRXPFLQGB-UHFFFAOYSA-N 282.256 -0.111 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H](CO)O1 408281701 WGDHVAQWTADZNC-JGVFFNPUSA-N 284.272 -0.450 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2cn(C)nn2)c1 534934875 RJJXACWNIAMVEV-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD Cn1nnc(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)n1 588035695 HNJFKSVDJVMDRK-UHFFFAOYSA-N 279.260 -0.195 5 20 CBBD CNS(=O)(=O)CCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 600665631 OMWQSMWVXDZIDW-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])n1C 761056132 RKGRRRLMQCQXFN-UHFFFAOYSA-N 284.228 -0.454 5 20 CBBD CON(C)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 849408361 HMRJLGGRFWGTDE-UHFFFAOYSA-N 290.301 -0.239 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[S@@](C)=O 1116085176 PMWJIFWHFUNRLP-GOSISDBHSA-N 274.302 -0.406 5 20 CBBD CN1CC[C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 1329965825 ISLMOCRUNQJQFR-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCOC12CNC2 1579869140 SJQKXDYQJOYVJB-UHFFFAOYSA-N 281.272 -0.742 5 20 CBBD CN(CCNC(=O)c1cc([N+](=O)[O-])cnc1O)CC(=O)O 1598492628 PRTMGQJYSBZUKP-UHFFFAOYSA-N 298.255 -0.558 5 20 CBBD CC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 180895419 AQGDIILZGLOQSF-QMMMGPOBSA-N 256.262 -0.013 5 20 CBBD CN(C[C@H](O)CO)C(=O)Cc1ccc([N+](=O)[O-])cc1 271229559 AONPXBAOKDHPKF-NSHDSACASA-N 268.269 -0.051 5 20 CBBD C[C@H](O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@H](C)C1 275381085 PDPGNIWGUVTANI-BDAKNGLRSA-N 296.331 -0.142 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1[C@@H](CO)CC[C@@H]1CO 287614815 ZMLMSMLIBZNTOX-VXGBXAGGSA-N 297.311 -0.426 5 20 CBBD Nc1nc(NCC(=O)NCC2CC2)ncc1[N+](=O)[O-] 302010977 ANKAAYYYOVCPGC-UHFFFAOYSA-N 266.261 -0.095 5 20 CBBD C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[S@@]1=O 343730768 XYEUCVAORKHODK-DMWPKQFHSA-N 272.286 -0.089 5 20 CBBD CN(C)C(=O)CN1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 371438162 ADBGGZRJQWZJGT-GHMZBOCLSA-N 298.343 -0.726 5 20 CBBD C[C@@H]1CC(=O)NCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 375844326 VGJXQIKPKVDCND-MWLCHTKSSA-N 297.315 -0.637 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CC1 563926221 OMWGBHQFHVBTAP-UHFFFAOYSA-N 283.244 -0.292 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CNCCO1 581879275 AXDYNGMHVZPOJS-JTQLQIEISA-N 297.315 -0.406 5 20 CBBD C[C@@H](O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 594414016 FNMKMFYLVDOEEG-SSDOTTSWSA-N 269.261 -0.442 5 20 CBBD CC(=O)NC(C)(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 610874577 MZPQVJPJCQTWCQ-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD CN1CCN(C(=O)CNc2ncc([N+](=O)[O-])c(N)n2)CC1 728051142 JHBMXKBRBLDMPZ-UHFFFAOYSA-N 295.303 -0.847 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H]1CCN(C)C1=O 734894513 GKVMXJHJKYUCFX-QMMMGPOBSA-N 282.256 -0.126 5 20 CBBD Cc1nonc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 801621863 QTBDHCRSNLNIJL-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD C[C@@H](O)[C@@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 843062099 LURSNGXHSPLPQK-FXAINCCUSA-N 270.285 -0.041 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC(=O)NC1CC1 1318979111 SSSQGZYWMWTMHN-UHFFFAOYSA-N 280.240 -0.255 5 20 CBBD COC[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])CCO1 1347399338 XQWWDMWYVSPTEA-MRVPVSSYSA-N 296.283 -0.060 5 20 CBBD CC(=O)NCCN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1349074767 GKTLFVUQMSNGRR-UHFFFAOYSA-N 281.272 -0.339 5 20 CBBD CC(=O)OCCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1573552507 QEPVASWGKJMSNW-UHFFFAOYSA-N 267.205 -0.466 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 50703070 PNOTYIFSGOLPNQ-YFKPBYRVSA-N 252.230 -0.219 5 20 CBBD CCc1nn(C)c(NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 228598941 ZRJURFSZYCJXNL-LURJTMIESA-N 257.250 -0.851 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCC(=O)NCCO)n1 268802636 JSZDZEXKSOFWHX-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD O=C(C[C@@H]1CCCC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 288694148 XRVIILGIRLBYQW-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 340449820 FRJLDRYYFYBAAO-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1C[C@H](F)CN1 368205889 YRPSACWZPZWPAU-YUMQZZPRSA-N 271.252 -0.393 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 553091188 NIDUFMBXVDYZFH-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD CO[C@@H]1COC[C@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 564930290 NUJXGPKCNNQGCL-GMTAPVOTSA-N 286.288 -0.844 5 20 CBBD O=[N+]([O-])c1cc(CNC(CO)CO)c2c(c1)COCO2 568783920 GNSXYOCGPCGQEC-UHFFFAOYSA-N 284.268 -0.096 5 20 CBBD O=c1c(F)cc([N+](=O)[O-])cn1CC1(CO)COC1 576039681 IMQBXSHJHLCMNO-UHFFFAOYSA-N 258.205 -0.096 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC2CNC2)c1=O 592158846 WPKZVXXYAQIOPK-UHFFFAOYSA-N 267.241 -0.238 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCn1cccn1 744503510 AEFIGZUZKITFOY-UHFFFAOYSA-N 266.217 -0.374 5 20 CBBD COc1ccc(NNC(=S)NCC(N)=O)c([N+](=O)[O-])c1 767690232 IUDYJELTCXDXQA-UHFFFAOYSA-N 299.312 -0.120 5 20 CBBD CC(=O)OCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 798258405 RBQWYYXTBIGQLS-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD COC(=O)C(C)(C)C(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840673152 IRZSLUYNYFRIEU-RNFRBKRXSA-N 273.241 -0.037 5 20 CBBD Cc1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)no1 1030292125 VEHABWIOJBTJQX-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[C@@]2(CO)C1 1320586854 LCFVDTVKAHICJX-CPCISQLKSA-N 266.257 -0.217 5 20 CBBD CN1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 1324084949 ILNXSZZWKYMJFS-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD CNC(=O)[C@@H](O)CN=c1c(C)c[nH]cc1[N+](=O)[O-] 1325256679 ZDYVXTGVXBINFE-QMMMGPOBSA-N 254.246 -0.761 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCOCC1 43285073 STMRFRLBRPOCBA-UHFFFAOYSA-N 283.288 -0.760 5 20 CBBD CC(C)[C@H](CO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 92394799 XTQCMHIDUSYWPG-QWRGUYRKSA-N 272.305 -0.241 5 20 CBBD COC[C@H](O)CCNc1ncc([N+](=O)[O-])cc1C(N)=O 270765641 FOBGBXWRDMJUBO-MRVPVSSYSA-N 284.272 -0.102 5 20 CBBD C[C@@]1(C(N)=O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 280820582 USWZXVQKSIMFDJ-LLVKDONJSA-N 267.289 -0.011 5 20 CBBD O=C(NCCn1cncn1)NCCn1cc([N+](=O)[O-])cn1 345525925 QHHDDEWKPRBFHK-UHFFFAOYSA-N 294.275 -0.618 5 20 CBBD COC(=O)[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)OC 347830560 KQHKQPPGTFBPTQ-ZETCQYMHSA-N 286.244 -0.905 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NCCn1ncnn1 353053392 AWZOHCZXMFVSFR-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD CCn1cc(S(=O)(=O)NCCCNC)c([N+](=O)[O-])n1 353253003 PCVVZTRDKOSAGR-UHFFFAOYSA-N 291.333 -0.301 5 20 CBBD C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)N(C)C 357685199 YZAFICHHOKLFAM-ZCFIWIBFSA-N 281.272 -0.023 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])nn2C)C1 360842330 WDOGQGQFTYQLSL-LLVKDONJSA-N 283.288 -0.875 5 20 CBBD Cn1cnc(CCNC(=O)c2cnc(O)c([N+](=O)[O-])c2)n1 444997662 PIYLRTNBUDNKAL-UHFFFAOYSA-N 292.255 -0.204 5 20 CBBD CCCNC(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 558733080 UFKMLZQAUUZQTN-UHFFFAOYSA-N 269.261 -0.036 5 20 CBBD O=C(O)C[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 595253688 WACIOSDWZOYXCF-MRVPVSSYSA-N 297.271 -0.197 5 20 CBBD O=C1CN(NC(=O)Cc2cccc([N+](=O)[O-])c2)C(=O)N1 743288778 ZPHRQGRBMGAFMF-UHFFFAOYSA-N 278.224 -0.280 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1N 758965086 PXFNKRZKMJIVSS-UHFFFAOYSA-N 296.239 -0.211 5 20 CBBD NC(=O)CONC(=O)c1cccc(O)c1[N+](=O)[O-] 798302071 MTARFDDJLVCTNB-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD CC(C)(C)OC(=O)C(=O)N1CCN(CC[N+](=O)[O-])CC1 930711883 OHJXOCHWYUOEBR-UHFFFAOYSA-N 287.316 -0.251 5 20 CBBD NC(=O)[C@@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 1118306762 PAAAHLLFBALXRV-SNVBAGLBSA-N 269.261 -0.975 5 20 CBBD O=C(NCCCNCC(=O)N1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157760282 AKHVTWUOQFJJLQ-GHMZBOCLSA-N 298.343 -0.630 5 20 CBBD CC(C)CNC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1253912475 LFUYBYCAHGRIML-UHFFFAOYSA-N 283.288 -0.170 5 20 CBBD Nc1c(C(=O)N2CCOC23CNC3)cccc1[N+](=O)[O-] 1580431624 PARQGYUVNUIVEN-UHFFFAOYSA-N 278.268 -0.051 5 20 CBBD COC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2CC[C@H]1N2CC[N+](=O)[O-] 1598737105 HXRVSFTYTSZFAN-HXFLIBJXSA-N 272.257 -0.400 5 20 CBBD O=C(O)C1=NO[C@@H](Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1608590152 CIHPDGLTVZLXDQ-ZCFIWIBFSA-N 267.197 -0.014 5 20 CBBD O=C(O)C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 91292507 LEHYHAAFTTVUCC-QMMMGPOBSA-N 298.255 -0.507 5 20 CBBD NC(=O)CONC(=O)COc1ccccc1[N+](=O)[O-] 124285231 IUEAXASZEQTMBX-UHFFFAOYSA-N 269.213 -0.493 5 20 CBBD C[S@](=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 158093346 KARDUUPJHDACBC-DYBLOJMWSA-N 276.318 -0.880 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1Cl 227866040 KYRNZLSUPZYGBO-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD NCCNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 262172182 PCLYBFGHAXYZRL-UHFFFAOYSA-N 294.267 -0.605 5 20 CBBD COC[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 266000536 SCEYLTRBIUWORB-VIFPVBQESA-N 284.272 -0.335 5 20 CBBD Cc1cc(C(=O)N[C@@H]2COC[C@H]2O)c(N)c([N+](=O)[O-])c1 297098350 XDKRNSRNWHAQJZ-PSASIEDQSA-N 281.268 -0.025 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC(=O)N(C)C1 299731087 XZYSRJNHTFMQGX-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD COC(=O)C[C@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 340879473 PWVXPAGXXHAFQQ-ZETCQYMHSA-N 297.271 -0.265 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 343095845 LACNXXYISGLGSM-RXMQYKEDSA-N 255.234 -0.428 5 20 CBBD CCCNC(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 354310134 AMRZRLDROGTQND-UHFFFAOYSA-N 269.261 -0.118 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@H]3CNC[C@@H]3C2)n1 359284823 VDJNDVZNZBZLJC-NXEZZACHSA-N 251.290 -0.058 5 20 CBBD O=C1C[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CN1 445131033 FLPIZUXSXHCKLK-ZCFIWIBFSA-N 266.213 -0.686 5 20 CBBD O=[N+]([O-])c1ccn(CCN[C@H](CO)[C@H]2CCCO2)n1 447921926 NBGJUSNCGNQWIC-NXEZZACHSA-N 270.289 -0.079 5 20 CBBD C[C@H]1CN(CCNC(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 534272151 UEMJUSUVIMCYOF-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 564966211 CJCJTDRMZRCPAK-YFKPBYRVSA-N 254.202 -0.135 5 20 CBBD NC[C@@H]1OCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 595956598 OFRRDKYSUXMRSQ-ZJUUUORDSA-N 283.288 -0.729 5 20 CBBD C[C@@H](CO)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 619250465 RZMYEWGSQCXFKB-ZCFIWIBFSA-N 254.246 -0.070 5 20 CBBD NC(=O)NCCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 822879832 GUAGLVAGYGRPGL-UHFFFAOYSA-N 293.247 -0.750 5 20 CBBD CCON(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 846507174 RSCIKUKCUGRNOY-UHFFFAOYSA-N 297.271 -0.288 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccc[nH]1 1000906318 WASJTRMGUMVPKF-MWLCHTKSSA-N 292.295 -0.132 5 20 CBBD O=C(N[C@H]1CC[C@H](NCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1034645822 WTZILDHMNJAQCL-GWOFURMSSA-N 271.317 -0.339 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCNC1=O 1341406295 YBMDSXGJLBTADD-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD O=C1N[C@@H]2CN(CC[N+](=O)[O-])CC[C@@H]2N1C1CCNCC1 1580855348 SVURZNYOZNDMEY-NEPJUHHUSA-N 297.359 -0.517 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@@](O)(C(=O)O)C1 1607985230 RMTBEQZRYGOTRY-NSHDSACASA-N 298.255 -0.852 5 20 CBBD O=[N+]([O-])c1c(N2C[C@@H](O)[C@H](O)C2)nc2sccn12 236526960 SFSGHMVVVYAVBY-PHDIDXHHSA-N 270.270 -0.154 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)O1 268287384 CPSJPPHAKGIITE-CAHLUQPWSA-N 282.260 -0.588 5 20 CBBD O=C(NC(CO)CO)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 271353104 OQOLLNHUGTZOAN-UHFFFAOYSA-N 285.212 -0.414 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 340484727 PSXDQHLUQQTEQO-SECBINFHSA-N 295.299 -0.127 5 20 CBBD COCCn1ccc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n1 343320586 MYSTWCNSOPDWFL-UHFFFAOYSA-N 280.244 0.413 5 20 CBBD NC(=O)C1(NC(=O)c2cccc([N+](=O)[O-])c2N)CC1 348844191 INQVWFWYFJYKAT-UHFFFAOYSA-N 264.241 -0.075 5 20 CBBD COCC[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 368283225 WRGDRDWTDNDBPZ-OPRDCNLKSA-N 258.274 -0.085 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CCCC1=O 565897608 GZKYUGLUMHQJAD-UHFFFAOYSA-N 295.299 -0.162 5 20 CBBD CCn1cc(S(=O)(=O)NC2CNC2)c([N+](=O)[O-])n1 572761155 ZPISCYZUTDCSOJ-UHFFFAOYSA-N 275.290 -0.939 5 20 CBBD C[C@H](N)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 592547238 UKGSARGPBAHBNE-ZETCQYMHSA-N 255.278 -0.010 5 20 CBBD Cc1noc(CN2CCN(C(=O)[C@@H](C)O)CC2)c1[N+](=O)[O-] 595405073 SKEAPJBHLWWWGV-SECBINFHSA-N 298.299 -0.084 5 20 CBBD CNc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 597583498 FFRBVGVQXGGRKT-VIFPVBQESA-N 282.256 -0.788 5 20 CBBD Nc1ccc(NC(=O)N2C[C@H](O)[C@H](O)C2)cc1[N+](=O)[O-] 823968717 YYMJCOKCRUDJFF-AOOOYVTPSA-N 282.256 -0.254 5 20 CBBD Cn1cc(C(=O)OCCC[N+](=O)[O-])c(O)nc1=O 860916751 WIOBOUHECDJXEE-UHFFFAOYSA-N 257.202 -0.691 5 20 CBBD CCNC(=O)CN1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891702011 PAFLGWQDGXBWDL-UHFFFAOYSA-N 296.331 -0.414 5 20 CBBD O=C(NCC1CCN(CCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001401007 XEDPOQQPQYNCJG-GHMZBOCLSA-N 271.317 -0.528 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)C(N)=O)c1 1100294546 BCYGOWWIYBAYCC-UHFFFAOYSA-N 280.284 -0.059 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345223 KJUFOXUDORKJLS-QMMMGPOBSA-N 297.267 -0.318 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@@H]1CCCN1 1261491753 FEVVIBPLZKWFLD-VIFPVBQESA-N 280.284 -0.375 5 20 CBBD COCC1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1332114385 PIFZKDSIXCNJST-UHFFFAOYSA-N 281.268 -0.139 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1nnc([C@@H](C)[N+](=O)[O-])n1C 1350589435 UXSUSBZPUHFPLL-SFYZADRCSA-N 282.304 -0.180 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H](CF)C(=O)O)n1 1600969256 DHVMWGHKPJJCLS-BYPYZUCNSA-N 260.181 -0.519 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](CO)C(=O)O 1607968918 WLKBKZZHIPQOJM-ZETCQYMHSA-N 286.244 -0.948 5 20 CBBD O=C(O)COCC(=O)OCCn1cc([N+](=O)[O-])cn1 1608756991 OUWTVJKVIHMKOQ-UHFFFAOYSA-N 273.201 -0.564 5 20 CBBD CNS(=O)(=O)c1ccc(NCCO)c([N+](=O)[O-])c1 15205531 VUTFJELMKJPVNB-UHFFFAOYSA-N 275.286 -0.093 5 20 CBBD CCN(CC(=O)OC)C(=O)Cn1ccc([N+](=O)[O-])n1 48866399 JHRXVPSWCJQPFT-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 88375934 VVPCTYDVXZWQJU-QMMMGPOBSA-N 284.228 -0.897 5 20 CBBD Cn1cc(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 94196152 QEHVSPRQFYVUBQ-JTQLQIEISA-N 266.261 -0.002 5 20 CBBD CC(C)(C)N(CC(N)=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 131147529 FSTVDSIGOJNMFS-SNVBAGLBSA-N 299.331 -0.262 5 20 CBBD O=C(NCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 135432747 FJZHCEQDXWVCPU-NSHDSACASA-N 297.315 -0.732 5 20 CBBD O=C(O)CCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 139455849 IXZCCQSWIUTSBI-UHFFFAOYSA-N 295.251 -0.085 5 20 CBBD C[C@@H]1CCNC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 186820296 BUCRDJPIUVKGFK-BDAKNGLRSA-N 267.289 -0.095 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NCCn1ccc([N+](=O)[O-])n1 193582943 CLNPGVMBYWRBEK-PSASIEDQSA-N 267.289 -0.095 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@@H](CO)O1 230007570 LESXYHMDAANYGA-APPZFPTMSA-N 254.246 -0.029 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@@H]2COC[C@H]2O)c1[N+](=O)[O-] 286640341 BVDGXMHVXYQBSK-HTQZYQBOSA-N 284.272 -0.288 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCC(=O)NC1CC1 298419534 KBESZEXPCSRFKH-UHFFFAOYSA-N 279.256 -0.221 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@@H]2CS(=O)(=O)CCO2)s1 336976959 PNISWSGJUZPAJO-ZCFIWIBFSA-N 293.326 0.277 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCO[C@H]1C1CC1 340659322 AABGOFIMRFLXSR-WPRPVWTQSA-N 281.272 -0.130 5 20 CBBD COC1(C)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 353012131 NWRNTIXJYVWHQF-JTQLQIEISA-N 270.289 -0.127 5 20 CBBD C[C@]1(CNc2ncc([N+](=O)[O-])c(N)n2)CCC(=O)N1 413335805 GEGMASJHWYSJBO-SNVBAGLBSA-N 266.261 0.048 5 20 CBBD N=C(O)OCCNC(=O)Cn1cc([N+](=O)[O-])cn1 495991969 LWVCTEYMWOLYLB-UHFFFAOYSA-N 257.206 -0.583 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563369812 QIPIFBKDSMPEOZ-ZCFIWIBFSA-N 281.272 -0.174 5 20 CBBD CNc1nccc(C(=O)NCC[C@@H](O)COC)c1[N+](=O)[O-] 579855609 DMSKYVLUJGJHKR-MRVPVSSYSA-N 298.299 0.159 5 20 CBBD CO[C@](C)(CO)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594398907 SJZDDLSNMIOFIK-NSHDSACASA-N 284.272 -0.301 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 595986092 NZSRXZDJHUAZMV-LURJTMIESA-N 270.201 -0.757 5 20 CBBD O=C(O)COCCNC(=O)c1ccc([N+](=O)[O-])cn1 600872718 AOZSPBOVNWLIFZ-UHFFFAOYSA-N 269.213 -0.179 5 20 CBBD COc1cc(C(=O)NN2CC(=O)NC2=O)ccc1[N+](=O)[O-] 725879376 RKHPXUCYWIVTCH-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD CCNC(=O)NC(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 766971083 HXEWRTGAXZSXEW-UHFFFAOYSA-N 299.243 -0.669 5 20 CBBD C[C@H](C(=O)N1CCCC1)N1CCN(CC[N+](=O)[O-])CC1 791053055 SEXLTAOVYYTFPE-GFCCVEGCSA-N 284.360 -0.108 5 20 CBBD O=C(Nn1c(O)nnc1O)c1cnc(O)c([N+](=O)[O-])c1 816734399 MVFOMPJLZQYTLZ-UHFFFAOYSA-N 282.172 -0.918 5 20 CBBD CCn1ncn(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1=O 816736871 PGUYPIXOKPQTAA-UHFFFAOYSA-N 292.255 -0.061 5 20 CBBD O=C(O)[C@@H]1CCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 821512019 VHIRXIYNDMGAHL-QMMMGPOBSA-N 295.251 -0.168 5 20 CBBD O=C(O)C[C@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 833220445 UOFCRGSEARDHPW-QMMMGPOBSA-N 270.245 -0.076 5 20 CBBD O=C(OCCN1CCOCC1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842333826 KDNGUCKYZFUCNV-HTQZYQBOSA-N 258.230 -0.946 5 20 CBBD CON1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1 854861055 CCRXXAHLNLWNDX-UHFFFAOYSA-N 283.288 -0.044 5 20 CBBD O=C(Cc1nc2ncccn2n1)OCCC[N+](=O)[O-] 860916583 UXMWCWOVPJQSQE-UHFFFAOYSA-N 265.229 -0.123 5 20 CBBD Nc1ncnc2c1ncn2CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 862972153 WWLRQGIOWFMGCV-RNFRBKRXSA-N 291.271 -0.810 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(c2cc(F)ncn2)CC1 908889231 ZRBBJRIAHHJRQQ-RKDXNWHRSA-N 295.274 -0.071 5 20 CBBD CCOC(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 919519918 PMNHFJIYJHMPOS-UHFFFAOYSA-N 258.190 -0.707 5 20 CBBD COCCO[C@@H]1C[C@@H](CO)CN(CC[N+](=O)[O-])C1 1119855041 LYELNJURTPXHHN-GHMZBOCLSA-N 262.306 -0.391 5 20 CBBD Cn1cc(CCNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1157767055 FUIFIKCLQMHZQY-VXGBXAGGSA-N 295.343 -0.276 5 20 CBBD COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(N)=O 1319828852 OMWKIYMPZBUWKL-LURJTMIESA-N 271.229 -0.192 5 20 CBBD CS(=O)(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 1323883109 RBNYUJBJTXOAKD-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD COC(=O)[C@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1324268430 ZKPMUJANZLFNGZ-ZETCQYMHSA-N 283.240 -0.566 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1c[nH]nc1[N+](=O)[O-] 1340015691 FBYNRPMZSNOYTI-RKDXNWHRSA-N 295.299 -0.089 5 20 CBBD C[C@@]1(COC(=O)Cn2cnc([N+](=O)[O-])n2)COC(=O)N1 1343867553 AXJYKGQJKUMDJO-SECBINFHSA-N 285.216 -0.772 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCC[C@@H]1CCNC1=O 1344460162 XWJFCIWJKWFUAX-ZETCQYMHSA-N 283.244 -0.744 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3CCC(O)(CO)CC3)nn12 1350501385 KWZWNQIGQSSZAS-UHFFFAOYSA-N 293.283 -0.039 5 20 CBBD COC(=O)C1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1525358434 CDBNDEZEASXWRA-UHFFFAOYSA-N 283.288 -0.019 5 20 CBBD O=C(N[C@@H]1CNOC1)[C@H](O)c1cccc([N+](=O)[O-])c1 1580749429 VOBXSXSVUBVXIJ-PSASIEDQSA-N 267.241 -0.352 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CCO1 50858441 XMJHAJDXTQJSTH-JTQLQIEISA-N 279.252 -0.079 5 20 CBBD COC(=O)[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 112669018 UJGCLNMWJPBUDJ-MRVPVSSYSA-N 298.255 -0.808 5 20 CBBD NC[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 160353378 CVYVBYQYCSEILE-VIFPVBQESA-N 280.284 -0.294 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](O)C[C@H]1CO 274774229 CBJJWKVBTXHBGQ-IUCAKERBSA-N 282.252 -0.132 5 20 CBBD CC(C)(CC(N)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286056548 LROYTRFKVJXLDA-UHFFFAOYSA-N 255.234 -0.298 5 20 CBBD C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 338601930 GLFJXSJEJPEZRF-LURJTMIESA-N 269.261 -0.484 5 20 CBBD Nc1nc(N2CCS(=O)(=O)CC2)ncc1[N+](=O)[O-] 341820752 VBXGRNXYEKQNAW-UHFFFAOYSA-N 273.274 -0.798 5 20 CBBD COCC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 343945607 LKMKTISRBCZRMN-VIFPVBQESA-N 299.283 -0.730 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)O1 355843620 GYNWJYQUCJJERV-SVRRBLITSA-N 298.255 -0.280 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CCNCC2)c1[N+](=O)[O-] 428647369 YROFBCJSTUUVNT-UHFFFAOYSA-N 282.304 -0.739 5 20 CBBD CCNC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 548407618 WVNWABWQYLSHML-UHFFFAOYSA-N 296.287 -0.195 5 20 CBBD O=C(NCCNc1ncccn1)c1cc([N+](=O)[O-])n[nH]1 586119901 XAAUYAHRLRVANA-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD Nc1ccc(NC[C@H](O)Cn2ccnn2)nc1[N+](=O)[O-] 596271628 RUZCQYSRQQVULX-ZETCQYMHSA-N 279.260 -0.364 5 20 CBBD NC(=O)C(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1 1107480420 JBEIZPKXQNSYBG-UPHRSURJSA-N 279.256 -0.441 5 20 CBBD CCn1nc(C)c(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936949 YFNSHEMZTNUPGF-MWLCHTKSSA-N 296.331 -0.523 5 20 CBBD CN(C[C@@H]1COCCO1)c1nnc(CCC[N+](=O)[O-])n1C 1338166329 IODKUDRVDAHNBY-SNVBAGLBSA-N 299.331 -0.124 5 20 CBBD C[C@@H](/C=C/C(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1592202100 SLIZGXHWDOAYPC-SZKDQXIBSA-N 269.217 -0.668 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NCCC(=O)NCCC(=O)O 1601028625 CCQSLLHUHMQHNP-UHFFFAOYSA-N 285.260 -0.279 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H](CO)C1 51885658 PYNDIMAFPNZGGN-MRVPVSSYSA-N 254.246 -0.368 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)CO 133445132 KVDVCXHLPOQUNS-QMMMGPOBSA-N 269.257 -0.281 5 20 CBBD Cn1cnnc1CNC(=O)c1cc([N+](=O)[O-])cnc1N 227885055 XJIBZWYSLBHCPO-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 276247419 LRPBOUPUAQMNBD-SSDOTTSWSA-N 292.251 -0.045 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 296985995 PKZFATKAHGBLLX-NXEZZACHSA-N 297.223 -0.008 5 20 CBBD CC(=O)N1CC(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 332436771 AVYUHMUJMCFKOJ-UHFFFAOYSA-N 294.267 -0.897 5 20 CBBD CCCN(CC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 346922829 OKRIIAVYISAULG-UHFFFAOYSA-N 269.261 -0.485 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)C2)c1[N+](=O)[O-] 354068900 UUBYGFBJRGGXIF-UHFFFAOYSA-N 253.218 -0.802 5 20 CBBD Cc1nnc(CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1C 355167098 RFZXEZDXJFTEAX-UHFFFAOYSA-N 279.260 -0.273 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCCOCCO 356749710 YIIKFNXVUMOBDC-UHFFFAOYSA-N 272.261 -0.543 5 20 CBBD COCCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525642566 JATABDZKOAYVQP-UHFFFAOYSA-N 261.259 -0.086 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2OCCN[C@H]2C1 572167428 FKQVVJJNULWEMU-ONGXEEELSA-N 281.316 -0.109 5 20 CBBD C[C@@H](O)[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 595765593 JQRKEAHDYVJREI-YUSALJHKSA-N 284.316 -0.003 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@@H]2CCC[C@@H]2O)CC1 839666824 UHYLEGFYOBBUKV-KKOKHZNYSA-N 283.328 -0.291 5 20 CBBD CC(C)NC(=O)NC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672191 NTKPRWWJXUWHMS-BWZBUEFSSA-N 287.272 -0.183 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 841421770 RPLKNRRNKVZNPV-LBPRGKRZSA-N 297.267 -0.169 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[S@](C)=O 1116085178 PMWJIFWHFUNRLP-SFHVURJKSA-N 274.302 -0.406 5 20 CBBD C[C@H]1C[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(=O)O1 1329065848 KPXUWAOSFWQOLO-NTSWFWBYSA-N 268.229 -0.238 5 20 CBBD NC(=O)CSc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1606418929 KBKUSFKYJYTXSM-UHFFFAOYSA-N 281.257 -0.253 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CCO[C@@H](C(=O)O)C1 50442201 FRRWGMWNERVYFS-MRVPVSSYSA-N 296.239 -0.622 5 20 CBBD O=C(O)C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])o1 70215740 WHKXAECIJOLWJX-ZCFIWIBFSA-N 297.223 -0.397 5 20 CBBD NC(=O)CCNC(=O)COc1ccccc1[N+](=O)[O-] 175436637 LNCGIBCMUBSMEY-UHFFFAOYSA-N 267.241 -0.035 5 20 CBBD Cn1cnn(CC(=O)NCc2cccc([N+](=O)[O-])c2)c1=O 181075127 NWQLYCAZYNDXON-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1CCn1cc([N+](=O)[O-])cn1 187001956 FABDIBXJPNSNEO-SECBINFHSA-N 267.289 -0.046 5 20 CBBD COC(=O)[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C1CC1 270856310 YSOYZSNTAKGBNI-ZETCQYMHSA-N 268.229 -0.001 5 20 CBBD CN(C)C(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 275464175 KVENYHLZURTMPG-UHFFFAOYSA-N 268.229 -0.487 5 20 CBBD O=C1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CN1 351787276 YWIKGGPUYLJVLI-YFKPBYRVSA-N 253.218 -0.674 5 20 CBBD NC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)o1 353648008 NQDDPLMOLNBLOF-UHFFFAOYSA-N 279.212 -0.060 5 20 CBBD O=C(NC[C@H](O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 354059145 PBAVCJXOEQUMMZ-SVRRBLITSA-N 270.245 -0.555 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](CO)O1 408281703 WGDHVAQWTADZNC-YUMQZZPRSA-N 284.272 -0.450 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CNC(=O)C1 541709709 KMOXGGPKWGCBQN-LURJTMIESA-N 252.230 -0.448 5 20 CBBD O=C(NC1(c2nn[nH]n2)CC1)c1ccc([N+](=O)[O-])cn1 572573849 NBFVIMIEHVDESO-UHFFFAOYSA-N 275.228 -0.078 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCCO1 578866752 VOAYTIKPDFRSNK-SECBINFHSA-N 296.283 -0.115 5 20 CBBD C[C@@H](C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 582964128 IJMLBLKSKITPKU-ZCFIWIBFSA-N 256.218 -0.372 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1ccc([N+](=O)[O-])cn1 610773969 DZDWKDHUCDOMPT-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD Cn1cc(C(=O)OCCn2ccc([N+](=O)[O-])n2)nn1 808659408 KYGQAYWSHSMTDU-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)c3cc([N+](=O)[O-])n[nH]3)C[C@H]21 816968996 VTOPBADHLVPDCQ-KPCSLPGQSA-N 280.240 -0.191 5 20 CBBD CONC(=O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 857332596 YKYKEYKAMQFCEN-SNVBAGLBSA-N 269.257 -0.105 5 20 CBBD NC(=O)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 1055999240 CJWGTKRCKPBDIF-UHFFFAOYSA-N 278.268 -0.271 5 20 CBBD Cc1ccnc(NCCNC(=O)C(N)=O)c1[N+](=O)[O-] 1094079741 ZOWBINHTMPGAEW-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD O=C(NCC1(CO)COC1)c1cc([N+](=O)[O-])n[nH]1 1322083254 QPWXHJPCWXKPMA-UHFFFAOYSA-N 256.218 -0.943 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CN(C)CCO1 1341460155 LRGNAWMWZPVVMB-WPRPVWTQSA-N 297.315 -0.223 5 20 CBBD C[C@@](CN)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1345596205 BLINZTMQORQANS-JTQLQIEISA-N 268.277 -0.570 5 20 CBBD COC[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 1599182296 ZLKPPNQHQOBXRL-LURJTMIESA-N 273.201 -0.566 5 20 CBBD O=C(O)[C@H]1CNCCCN1CCn1ccc([N+](=O)[O-])n1 1601852598 MTQDNAWCHZYUKV-SECBINFHSA-N 283.288 -0.460 5 20 CBBD CCCc1[nH]nc(C(=O)N2CC(O)(C(=O)O)C2)c1[N+](=O)[O-] 1605360808 GPQLDKGQBRIZOJ-UHFFFAOYSA-N 298.255 -0.458 5 20 CBBD O=C1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1 32774691 WTYXIEZBQQABTB-LLVKDONJSA-N 295.295 -0.234 5 20 CBBD C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C(N)=O 65858713 IXQRAKBXMZIEDY-ZETCQYMHSA-N 266.257 -0.003 5 20 CBBD NC(=O)c1ccc(N[C@H]2CNC(=O)C2)c([N+](=O)[O-])c1 225823887 JIQOMWSKEGWSFX-SSDOTTSWSA-N 264.241 -0.006 5 20 CBBD CCN(CCO)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 274584042 TUTKCOYOHJZUTN-UHFFFAOYSA-N 270.289 -0.033 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1C=C[C@@H](CO)C1 341732771 IOWDFSPMCLEFCT-BDAKNGLRSA-N 266.257 -0.156 5 20 CBBD O=C(NC[C@H](O)[C@H]1CCOC1)c1cc([N+](=O)[O-])cnc1O 347098461 ZCZVVVXJWDSFMC-XVKPBYJWSA-N 297.267 -0.177 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)CNC(=O)CN 347709252 ZPGMJGLWPJUNCM-UHFFFAOYSA-N 296.283 -0.706 5 20 CBBD CCc1ccc(C(=O)N[C@@H](CO)C(N)=O)cc1[N+](=O)[O-] 352993926 TWDDIAXJJRDDIT-VIFPVBQESA-N 281.268 -0.267 5 20 CBBD CNC(=O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 426011970 AASFIWIIYPSVNY-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1 428502781 ZOAFKPVNKOWDGH-VIFPVBQESA-N 297.315 -0.533 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCc1nnc(N)o1 436360587 NFRYZFGTHQKCEK-UHFFFAOYSA-N 253.222 -0.052 5 20 CBBD Cn1cnn(C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1=O 570614780 GFNBPRQLSAXKAI-JTQLQIEISA-N 294.267 -0.070 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@@H]3CNC[C@@H]23)nc1 595112122 SSZRLLZWPWGPDJ-HTQZYQBOSA-N 284.297 -0.514 5 20 CBBD O=C(NCCOc1ccc([N+](=O)[O-])cc1)C1(O)CNC1 595937124 RTAKOFOBUCZSMB-UHFFFAOYSA-N 281.268 -0.576 5 20 CBBD CNc1nccc(C(=O)N[C@H]2C[C@H](O)C2)c1[N+](=O)[O-] 598527843 HEIACFXSOKCMHP-KNVOCYPGSA-N 266.257 0.285 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CN2C[C@H](O)[C@@H](O)C2)c1 599531152 KMLDZBBXBYPQCP-DRZSPHRISA-N 298.295 -0.628 5 20 CBBD Nc1nc(N2C[C@@H]3CNC[C@H]3C2)ncc1[N+](=O)[O-] 609075042 MWSUZMIZTRGYGX-BQBZGAKWSA-N 250.262 -0.377 5 20 CBBD COCCN(CC(=O)O)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 610891141 UTYWZHMUFZURFB-UHFFFAOYSA-N 286.244 -0.200 5 20 CBBD Nc1cc(NC[C@H](O)CO)cc(CO)c1[N+](=O)[O-] 615279935 JJDGBRNOLTWIHR-QMMMGPOBSA-N 257.246 -0.566 5 20 CBBD CNC(=O)CN1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1017544147 MBKKMYSTZJYHKW-LMLFDSFASA-N 296.327 -0.927 5 20 CBBD CC(=O)N1C[C@@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@@H]2C1 1065949459 HMFJDIXJIHJMJD-DTORHVGOSA-N 292.299 -0.119 5 20 CBBD O=C(O)C[C@@]1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CCOC1 1601930654 KNOZDSKMHLGJEL-JTQLQIEISA-N 284.228 -0.319 5 20 CBBD C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 90275092 KZRGQPBTQDIBOT-VIFPVBQESA-N 257.202 -0.512 5 20 CBBD C[C@@H](CCO)CNC(=O)Cn1ccc([N+](=O)[O-])n1 97442338 PPMNPLMSMNWIDB-QMMMGPOBSA-N 256.262 -0.074 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 132919939 PZUOSPHRBPVMGK-SECBINFHSA-N 281.272 -0.086 5 20 CBBD NC(=O)CCCOC(=O)Cn1ccc([N+](=O)[O-])n1 176177951 LJCAMGGNQUPKQY-UHFFFAOYSA-N 256.218 -0.400 5 20 CBBD NC(=O)COCCNC(=O)Cc1ccc([N+](=O)[O-])cc1 268585132 YXDMGQCPNAMKBO-UHFFFAOYSA-N 281.268 -0.245 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 270647717 QHXZULBIEBVQLX-ONGXEEELSA-N 295.295 -0.014 5 20 CBBD CNC(=O)CNC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 299613176 YMMBMNLWKLIVIJ-UHFFFAOYSA-N 295.251 -0.352 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 339894239 YFBQPAYVDCGXGJ-SSDOTTSWSA-N 267.245 -0.732 5 20 CBBD N=c1nc(Cn2cc([N+](=O)[O-])cc(Cl)c2=O)[nH]c(=N)[nH]1 346659502 ZRULTBHFBAYFDV-UHFFFAOYSA-N 297.662 -0.532 5 20 CBBD O=C(NCCO)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 351186327 SWNYSKVUMGELQK-UHFFFAOYSA-N 271.204 -0.219 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)N1CCOCC1 351598345 JIAZLLASDLBNLU-ZETCQYMHSA-N 297.271 -0.705 5 20 CBBD Cc1[nH]nc(C(=O)N2CCn3ncnc3C2)c1[N+](=O)[O-] 354507881 UQFHUJPDPQWECT-UHFFFAOYSA-N 277.244 -0.126 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1nc[nH]n1 355795566 SLFIRMCPEMBXMY-ZETCQYMHSA-N 292.255 -0.248 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1[C@H]2CNC[C@H]12 366532937 SRMOKVRKGGATKE-IUCAKERBSA-N 265.273 -0.485 5 20 CBBD CC(=O)NC[C@@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CCO1 609802878 XJUURDUWLREELP-SNVBAGLBSA-N 297.315 -0.022 5 20 CBBD NC(=O)CONC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 772940101 MPPQXPYFGBBMOL-UHFFFAOYSA-N 293.239 -0.522 5 20 CBBD Cn1nnc(COC(=O)Cn2ccc([N+](=O)[O-])n2)n1 799474147 BGDMLXXYKLZKSU-UHFFFAOYSA-N 267.205 -0.942 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)[C@H](CN)C1 843357093 CEOHGBWOGSXOQF-SNVBAGLBSA-N 293.327 -0.108 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 863630357 YKFPHPSSOBGZNI-LURJTMIESA-N 298.255 -0.167 5 20 CBBD C[C@@H]1NC(=O)[C@H](C)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1C 911805514 AQFWTKGSNGSMMR-OAHBRNHXSA-N 255.274 -0.225 5 20 CBBD Cc1nn(C)c(C(=O)O[C@H](C)C(=O)NC(N)=O)c1[N+](=O)[O-] 920658239 HCTRKDWQLGNICD-RXMQYKEDSA-N 299.243 -0.623 5 20 CBBD CC(C)[C@@](C)(NC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 1117251067 DWUWQUCAIOAGTC-LLVKDONJSA-N 283.288 -0.042 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCC2OCCO2)c1=O 1320280317 ROFCIENKIKJLDD-UHFFFAOYSA-N 283.240 -0.382 5 20 CBBD CN1CCN(CC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 1328720478 BCWRGCRBOZFQOT-VXGBXAGGSA-N 282.344 -0.643 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](n2cncn2)C1 1338403561 RJKPQPUQFUNIET-ZETCQYMHSA-N 277.244 -0.003 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CC3(CNC3)C2)nc1 1580875565 MZYRKDUGTRUBNR-UHFFFAOYSA-N 284.297 -0.416 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN1CCn1ccc([N+](=O)[O-])n1 1601774096 WOVFSBSGMGRJID-JGVFFNPUSA-N 270.245 -0.689 5 20 CBBD O=C(O)c1ccnc(N2CCOCN2)c1[N+](=O)[O-] 1608952917 VYYIVSFJKHDRJT-UHFFFAOYSA-N 254.202 -0.013 5 20 CBBD NC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1 15139236 ODUPSNNOCGCIEJ-UHFFFAOYSA-N 281.272 -0.209 5 20 CBBD CC(=O)NCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 44707339 DBZUATPKLFUJRL-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD O=C(Cn1cnnn1)NCCc1ccc([N+](=O)[O-])cc1 53217640 FPSDTEIZHDPIJY-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD Cc1nn(C)c(NCCC(=O)NC(N)=O)c1[N+](=O)[O-] 268123384 AAANZYXOPYEXHF-UHFFFAOYSA-N 270.249 -0.366 5 20 CBBD O=C(CNC(=O)COc1ccc([N+](=O)[O-])cc1)NCCO 268697883 XQOWFBDYRHBQRW-UHFFFAOYSA-N 297.267 -0.802 5 20 CBBD CCN1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1=O 332706843 YFWXPXPKZQSIKX-UHFFFAOYSA-N 267.245 -0.410 5 20 CBBD Cc1nn(C)c(N2CC(CC(N)=O)C2)c1[N+](=O)[O-] 360062424 GHVNHNQMDIXOBI-UHFFFAOYSA-N 253.262 -0.052 5 20 CBBD COC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 377482751 SDMNHHMMDOHGIS-IWSPIJDZSA-N 272.257 -0.558 5 20 CBBD N[C@@H]1C[C@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 578787362 MHXXJTGEGNADMQ-DTWKUNHWSA-N 277.284 -0.262 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC1CC(CO)(CO)C1 599767479 XCAMVZWJPQFAGR-UHFFFAOYSA-N 296.283 -0.333 5 20 CBBD Cc1[nH]nc(C(=O)N(CCN(C)C)CC(=O)O)c1[N+](=O)[O-] 740034692 ZMKSCAUKUYQZLL-UHFFFAOYSA-N 299.287 -0.285 5 20 CBBD CC1(S(=O)(=O)NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 806030353 DKMOCHHAJINKAJ-UHFFFAOYSA-N 288.285 -0.210 5 20 CBBD CCOC(=O)Cn1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 819737893 BQTHDOYRWKISLP-RNFRBKRXSA-N 283.244 -0.555 5 20 CBBD O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839679200 GGURLMKRYWHWFU-FSDSQADBSA-N 295.217 -0.069 5 20 CBBD COC(=O)C[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 840421061 SQOGQYJBZFCMAF-XLDPMVHQSA-N 272.257 -0.510 5 20 CBBD Cn1cc(C[C@H](CO)CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 846647231 YSUNFLBRPXMMKH-HBNTYKKESA-N 282.300 -0.648 5 20 CBBD COC(=O)[C@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 848119978 VFHQMGSBBRQFEB-OUAUKWLOSA-N 293.279 -0.053 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 1116902479 NREJPQQBNDTWEB-MRVPVSSYSA-N 293.287 -0.160 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@H]3CNC[C@@H]32)c1 1119682764 UOFYRBJDFQPFDY-JLLWLGSASA-N 281.316 -0.554 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC2(C1)OCCO2 1319651999 PJXVHSLZSFYGPK-UHFFFAOYSA-N 282.256 -0.083 5 20 CBBD NC1(CO)CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 1347219373 DKOSMCSWBMQSSM-UHFFFAOYSA-N 268.273 -0.015 5 20 CBBD CN1CCN(Cc2cccnc2[N+](=O)[O-])S1(=O)=O 1353926950 XYVJUAOMOUSZBX-UHFFFAOYSA-N 272.286 -0.018 5 20 CBBD COc1cc([N+](=O)[O-])cn(Cc2cnn[nH]2)c1=O 1577057220 NKAFYPOLCGXIEY-UHFFFAOYSA-N 251.202 -0.069 5 20 CBBD CC(=O)NCCNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1588865513 WDXGXVGMIATLBB-UHFFFAOYSA-N 292.259 -0.282 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)c(F)cc1NC[C@@H](O)CO 1593467715 CSRTZECLJWPZPP-RXMQYKEDSA-N 298.234 -0.321 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-] 1601910268 HKELKLNQJLCPRU-ZETCQYMHSA-N 284.224 -0.134 5 20 CBBD COC[C@@H](O)CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1605128826 YYNMZUMRAWPQIW-ZETCQYMHSA-N 295.259 -0.411 5 20 CBBD Cn1c(C(=O)N[C@H](CO)C(=O)O)ccc1[N+](=O)[O-] 20215163 VUOTWFQRZUCRCB-RXMQYKEDSA-N 257.202 -0.891 5 20 CBBD C[C@H](CN1CCCC1=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 55811779 WQUSBFAWZSASMJ-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CCc1[nH]nc(C(=O)NN2CCCNC2=O)c1[N+](=O)[O-] 273315501 DDGZKVNCAHHNHP-UHFFFAOYSA-N 282.260 -0.060 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)CC[C@H]2C1 331902905 QLRHHKOASSINHS-ZETCQYMHSA-N 279.256 -0.235 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)[C@@H](C)O 347922674 QALSRZOZXYJMLV-GMSGAONNSA-N 297.267 -0.050 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)CCN 349918100 UEHCSCBONSRTFH-ZETCQYMHSA-N 255.278 -0.047 5 20 CBBD Cn1nnc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 428515700 KTUPWGWEXNFRLT-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN[C@H](CO)[C@@H]1CCCO1 447921117 JLQSDNVIMBPPGB-NEPJUHHUSA-N 297.311 -0.114 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@H](c2nn[nH]n2)C1 552378319 WKUPBAIPDIWRMS-LURJTMIESA-N 292.259 -0.149 5 20 CBBD Nc1nccc(C(=O)N[C@@H]2CCOC2)c1[N+](=O)[O-] 594371969 OBCIFTGGPYRCSG-ZCFIWIBFSA-N 252.230 0.091 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC(=O)N(C)CC2)c1[N+](=O)[O-] 598294328 RWGZQSGQILTRPJ-UHFFFAOYSA-N 281.272 -0.069 5 20 CBBD C[C@@H](CC(=O)O)NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600650725 APBNMSKOBSYBNX-YFKPBYRVSA-N 292.273 -0.530 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC(n2cncn2)C1 770404185 CUCINTPBAKUMFL-UHFFFAOYSA-N 290.239 -0.016 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])Nn1c(O)nnc1O 816734118 ZSQSKVYNBCWZNF-UHFFFAOYSA-N 295.211 -0.253 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)CN1CC(=O)N(C)C1=O 860788493 SORVFKDRJRIHEG-ZCFIWIBFSA-N 259.218 -0.911 5 20 CBBD C[C@@]1(CO)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@]1(C)CO 862995351 MUJFPYVSKMEOEW-IQIPOGNMSA-N 272.301 -0.509 5 20 CBBD CC(C)n1cc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)nn1 1332906174 GENRSZVITWBSTR-UHFFFAOYSA-N 294.275 -0.325 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H](C(=O)O)C1 1604745331 PWNWXALOYKWJQY-JGVFFNPUSA-N 297.271 -0.102 5 20 CBBD Cn1cc(CN2C[C@H](O)C[C@@H](C(=O)O)C2)c([N+](=O)[O-])n1 1608113944 WNOMAJGQQJXCSX-VXNVDRBHSA-N 284.272 -0.404 5 20 CBBD COC(=O)[C@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1 35160484 NMJFXVMXIMGEJW-JTQLQIEISA-N 282.252 -0.213 5 20 CBBD Cc1noc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 38034834 HWBKIACPBJWDKT-VIFPVBQESA-N 282.260 -0.367 5 20 CBBD Cn1c(C(=O)N2CCO[C@H](C(=O)O)C2)ccc1[N+](=O)[O-] 43700695 UTCVYWAXBJEXCG-QMMMGPOBSA-N 283.240 -0.141 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 48316429 LMPZXCWKVCMOCK-ZETCQYMHSA-N 255.234 -0.566 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCn2cccn2)c1 49076336 CHGCKZXXBNRQNL-NSHDSACASA-N 280.288 -0.362 5 20 CBBD CN(CC(N)=O)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 52830965 SQZXSBOFKYENOJ-UHFFFAOYSA-N 280.284 -0.025 5 20 CBBD Cc1ccnc(NCCS(N)(=O)=O)c1[N+](=O)[O-] 70495895 XVHWBOFAZCIXBV-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 227044158 ZAEFTRVWNSLJCM-SECBINFHSA-N 298.251 -0.133 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H](O)C1 298564909 ZVQRTNDRLKFURI-JGZJWPJOSA-N 293.279 -0.036 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2CC[C@H](O)C2)c1 300698899 PKTZYNWMZWIIKH-ZMLRMANQSA-N 284.316 -0.097 5 20 CBBD COC[C@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 338682492 AYIBQROLQRFUPW-SECBINFHSA-N 272.261 -0.695 5 20 CBBD CC[C@@H](C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339345265 FMVGCVHHZLNWDD-SVRRBLITSA-N 285.260 -0.198 5 20 CBBD C[C@@H](NC(N)=O)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 340347875 YHULNIAVNUQCDR-RXMQYKEDSA-N 292.255 0.466 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@@H](NC(N)=O)C2)c1[N+](=O)[O-] 343067549 BNBFIVBWHIQHEO-ZCFIWIBFSA-N 296.287 -0.237 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354056208 FLGMBFJYABJPJH-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 354631818 NQFCMVYCZLSNQP-QMMMGPOBSA-N 283.240 -0.559 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N 428578222 GSRRMFNYUQSZGO-ZETCQYMHSA-N 293.283 -0.125 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC(CO)CO)n1 516070833 QVADCMYLTOJWNN-UHFFFAOYSA-N 271.229 -0.238 5 20 CBBD C[C@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cc(F)c2=O)C1=O 517144977 RVGXNJIMNVHXCS-ZCFIWIBFSA-N 298.230 -0.164 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(C)C[C@@H]2CN)c1[N+](=O)[O-] 564944275 KGIAHMSYNVMFOT-VIFPVBQESA-N 296.331 -0.648 5 20 CBBD O=C(NC[C@@H]1C[C@H](F)CN1)c1cc([N+](=O)[O-])n[nH]1 592338681 YUDRJTBGJJATFA-WDSKDSINSA-N 257.225 -0.252 5 20 CBBD CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(N)=O 593596525 DCPOQTXJVNJODY-SSDOTTSWSA-N 288.285 -0.468 5 20 CBBD CCNC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748915592 ANIFQZINEAXHAN-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD Cc1cc(F)cc(C(=O)NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 834574685 SABHWENSDRVFDF-MRVPVSSYSA-N 285.231 -0.382 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1 923425424 MYYRACBLOVWVSI-ZYHUDNBSSA-N 283.332 -0.164 5 20 CBBD O=[N+]([O-])c1cnc(N2CCS(=O)(=O)CC2)nc1 1116576304 UYXVXUZDYHPLMT-UHFFFAOYSA-N 258.259 -0.380 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCc1nc[nH]n1 1319096858 ALHXWNDQDVOEOE-UHFFFAOYSA-N 292.255 -0.767 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCc3nn[nH]c3C2)c1 1324453717 WXAVRQDVUUNWCA-SECBINFHSA-N 293.287 -0.671 5 20 CBBD C[C@@H]1c2nncn2CCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1324513751 GWGXYVDFYIRIKN-MRVPVSSYSA-N 291.271 -0.014 5 20 CBBD COC(=O)[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)CCO1 1335423546 FZFYQJVBRIAOSM-QMMMGPOBSA-N 270.245 -0.294 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](CO)[C@@H]1CCOC1 1339740063 CNJMCQQBMWBTBW-ZJUUUORDSA-N 298.299 -0.448 5 20 CBBD O=C(N[C@H]1CCNC[C@@H]1F)c1cc([N+](=O)[O-])n[nH]1 1580615225 BUMUCKJDQQTIOD-WDSKDSINSA-N 257.225 -0.252 5 20 CBBD COCCN(CCC(=O)O)C(=O)c1n[nH]cc1[N+](=O)[O-] 1594010405 JNYHXFUJIUFKLV-UHFFFAOYSA-N 286.244 -0.119 5 20 CBBD CS(=O)(=O)NCCNc1ncc([N+](=O)[O-])cn1 40454646 KSPZRQHXTLNKMV-UHFFFAOYSA-N 261.263 -0.654 5 20 CBBD COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 157334623 XSAZRFOSTMCJMO-MRVPVSSYSA-N 268.229 -0.237 5 20 CBBD O=C(NCC(=O)N1CCOCC1)c1cc([N+](=O)[O-])c[nH]1 330689350 VQULSHTYGLXGSV-UHFFFAOYSA-N 282.256 -0.489 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)NCCF 337559053 YZPKDBWLTLFDEJ-ZCFIWIBFSA-N 299.262 -0.224 5 20 CBBD C[C@H]1C[C@H](O)CN1C(=O)NCCn1cc([N+](=O)[O-])cn1 349594852 BFVJEMJOYAOELT-WPRPVWTQSA-N 283.288 -0.044 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 351825062 GEPLPEUTNHKZGH-FBIMIBRVSA-N 270.289 -0.535 5 20 CBBD CC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])cn1 357569980 LYUOYBMRLKADJO-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD O=C1OC[C@@H]2CN(CCn3ccc([N+](=O)[O-])n3)CCN12 370570844 WUYLMGCIRGSMJZ-VIFPVBQESA-N 281.272 -0.072 5 20 CBBD C[C@H]1CC(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 371340391 DUSUATDIVDORCW-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD C[C@@H](CNc1ncc([N+](=O)[O-])cn1)S(C)(=O)=O 546177883 YXBPTXHOTIDVFW-LURJTMIESA-N 260.275 0.230 5 20 CBBD CN(CC(C)(CO)CO)c1ccc(N)c([N+](=O)[O-])n1 590581819 OORFSIVVRLHSPL-UHFFFAOYSA-N 270.289 -0.001 5 20 CBBD C[C@H](O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 594414017 FNMKMFYLVDOEEG-ZETCQYMHSA-N 269.261 -0.442 5 20 CBBD COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])cnc1O 600837196 UVBSUQMLSDIZPZ-UHFFFAOYSA-N 299.239 -0.385 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)[C@@H]1CCCO1 862656468 DNYYZXADZZJZBK-UWVGGRQHSA-N 296.283 -0.158 5 20 CBBD CCS(=O)(=O)N1CCC(NCC[N+](=O)[O-])CC1 905023514 ITLMVZNNEKKNHB-UHFFFAOYSA-N 265.335 -0.333 5 20 CBBD CC(C)(O)CC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1011063810 QEOAZJBRUZVGFX-NXEZZACHSA-N 299.327 -0.517 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)OC[C@H]2C1 1320684751 USCMABCFRSISNZ-SSDOTTSWSA-N 295.255 -0.395 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)c1n[nH]cc1[N+](=O)[O-] 1324294256 RGFRBFBLDUMPSQ-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1c([N+](=O)[O-])cnn1C 1326581497 BREJJUPUWMEKGI-UHFFFAOYSA-N 296.331 -0.695 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@@H](C(=O)O)C1 1594586699 WRISIPMRUZUOGG-OLQVQODUSA-N 268.229 -0.079 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC1(C(=O)O)CC1 1601384807 ULNGKZMREKFWIF-UHFFFAOYSA-N 281.224 -0.510 5 20 CBBD O=C1NC(=O)C([C@@H](C[N+](=O)[O-])c2ccc(O)cc2)C(=O)N1 1463322 BGKLNNAPAOTASE-QMMMGPOBSA-N 293.235 -0.265 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCO[C@@H](C(=O)O)C1 43751810 MQRMPXGVWVEDIX-ZCFIWIBFSA-N 256.218 -0.382 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCCCNC1=O 48702548 LTJRVRXVTLKIIC-QMMMGPOBSA-N 281.272 -0.424 5 20 CBBD O=C(NCC(=O)N1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1 153102356 UGGGZXHXNGNGKZ-NSHDSACASA-N 293.279 -0.082 5 20 CBBD COC[C@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 159455326 XBPHRXZNCIJWGX-MRVPVSSYSA-N 269.257 -0.086 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1COCCO1 230685619 YZGWVUGYWSHMCW-QMMMGPOBSA-N 282.256 -0.283 5 20 CBBD Cc1cc(N2CCN(CC(N)=O)CC2)ncc1[N+](=O)[O-] 266858869 VPMBMXJRAZIWDZ-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CN2C[C@H](O)[C@@H](O)C2)c1 278717493 KMLDZBBXBYPQCP-WXHSDQCUSA-N 298.295 -0.628 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)[C@@H]1CCOC1 351561694 XXDRRDBTFCFTCH-XCBNKYQSSA-N 296.283 -0.301 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 449693192 CRIIAITXKIFTBV-SNVBAGLBSA-N 294.311 -0.066 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H]1O 516936690 LAHAFLWDYFMARC-IUCAKERBSA-N 268.273 -0.330 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cccc([N+](=O)[O-])c2N)CCOC1 569940262 HQHNVNAYXJVJEI-GFCCVEGCSA-N 294.267 -0.449 5 20 CBBD O=C1NCCC[C@@H]1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 591735404 YYVMPAMLMHFOKS-KOLCDFICSA-N 297.315 -0.732 5 20 CBBD Cc1noc(CN2C[C@H](O)[C@@H](N(C)C)C2)c1[N+](=O)[O-] 595497761 PQAUKOFLLIKITH-IUCAKERBSA-N 270.289 -0.002 5 20 CBBD CN(CC(=O)N1CCCC1)C(=O)Cn1cnc([N+](=O)[O-])n1 604436470 XPFLHLJYZZDADE-UHFFFAOYSA-N 296.287 -0.733 5 20 CBBD CN1CC[C@@H](N(C)Cn2cc([N+](=O)[O-])cn2)C1=O 738264878 FHHRWIBLXZXQAZ-SECBINFHSA-N 253.262 -0.089 5 20 CBBD NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2N)CC1 769708751 DXFHFDJMCGTMCG-UHFFFAOYSA-N 264.241 -0.075 5 20 CBBD C[C@H](CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 827443077 YDRBSUDJFFMMPH-PSASIEDQSA-N 286.288 -0.195 5 20 CBBD COC(=O)CC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 847552515 VRKGCNQCKSVFLK-RKDXNWHRSA-N 286.284 -0.120 5 20 CBBD NC(=O)COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 915522265 UBEWZONZVABCLR-UHFFFAOYSA-N 278.224 -0.027 5 20 CBBD O=C(Cn1nccn1)NCCNc1ncccc1[N+](=O)[O-] 1093903506 UBOCBTQRLPIMMQ-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NN1CCCC1=O 1320788687 HCEJMZAMDHBWHU-UHFFFAOYSA-N 267.245 -0.247 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC/C=C\CO 1331406423 WMARDNHXWFPSLX-IHWYPQMZSA-N 254.246 -0.236 5 20 CBBD Cc1nn(C)c(N2C[C@@H](O)[C@H](CC(=O)O)C2)c1[N+](=O)[O-] 1777548284 AYNLISQDQLNRHV-HTQZYQBOSA-N 284.272 -0.091 5 20 CBBD CCNC(=O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 102221013 WOXGFVCQIPZMDT-UHFFFAOYSA-N 283.288 -0.221 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 340221253 OSCIOUPANUAXSI-VIFPVBQESA-N 253.262 -0.388 5 20 CBBD CC(C)[C@@](C)(NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 341947517 SGJFGVLLBFNMSH-SNVBAGLBSA-N 269.261 -0.052 5 20 CBBD Cn1cnc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)n1 351503319 TUQHUZPCOJZEAW-UHFFFAOYSA-N 277.244 -0.171 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 359799737 SWASRWLBLTVEPJ-LBPRGKRZSA-N 297.315 -0.386 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cc([N+](=O)[O-])c[nH]1 447633825 GYCQPCYTYDZLOC-UHFFFAOYSA-N 267.201 -0.428 5 20 CBBD N[C@@H]1C[C@H]2CN(c3ncc([N+](=O)[O-])cc3F)CCN2C1=O 569139741 SSYXZIPCOVKQMS-WCBMZHEXSA-N 295.274 -0.123 5 20 CBBD CCCc1nnnn1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 571478982 OXDCBXIRABCSKV-VIFPVBQESA-N 281.276 -0.209 5 20 CBBD CCN1C[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 593825280 GFMBJRNOEAUPRJ-SECBINFHSA-N 295.299 -0.224 5 20 CBBD NC[C@H](O)CCc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 594649834 OAEJRFYHEJJTKC-SNVBAGLBSA-N 278.272 -0.177 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NOC[C@@H]1CCOC1 788116457 AAASAWQUSXIAFZ-SECBINFHSA-N 297.267 -0.159 5 20 CBBD Cn1nncc1S(=O)(=O)Oc1cccnc1[N+](=O)[O-] 795054734 GGQRLVVLSFWADC-UHFFFAOYSA-N 285.241 -0.114 5 20 CBBD CNC(=O)NCCC(=O)OCCn1cc([N+](=O)[O-])cn1 795631590 UHPYRVVFEHLTNC-UHFFFAOYSA-N 285.260 -0.346 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2ncnn2C)C1 1042705826 YWKODSIMZUBITH-NXEZZACHSA-N 294.315 -0.877 5 20 CBBD COCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093486196 ICYZBSHBOFLDGL-UHFFFAOYSA-N 270.249 -0.859 5 20 CBBD C[C@]1(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 1323924318 ZRJCZKUSOXXSRR-ONGXEEELSA-N 284.272 -0.553 5 20 CBBD O=CN1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1329885392 VABXJDKBGWNYOD-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD NC(=O)CN1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 1333673517 FLPLDGYUOVBMKK-UHFFFAOYSA-N 281.272 -0.697 5 20 CBBD CNC[C@H](O)CN(C)C(=O)c1cccc([N+](=O)[O-])c1N 1578651947 BFNLCYFNAGYFOC-QMMMGPOBSA-N 282.300 -0.171 5 20 CBBD Cn1cc(CN2CCC[C@](N)(CO)C2)c([N+](=O)[O-])n1 1579961068 AGPWIKIRGIXYOR-LLVKDONJSA-N 269.305 -0.386 5 20 CBBD C[C@H](O)[C@@H](O)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603694204 QGQGWWXFAAZHEF-WKEGUHRASA-N 294.271 -0.072 5 20 CBBD CO[C@]1(C(=O)O)CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 1606700557 NUNUIMHBQFTMTQ-LLVKDONJSA-N 298.255 -0.058 5 20 CBBD CCN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1nc(C)no1 1753081814 UTFSEKJHFDODRA-NXEZZACHSA-N 297.315 -0.019 5 20 CBBD Cn1cc(N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cn1 74396232 PONZETXLLYSJKG-GHMZBOCLSA-N 279.300 -0.266 5 20 CBBD Cc1cc(C(=O)N(CC(N)=O)CC(N)=O)cc([N+](=O)[O-])c1 264890094 LWEOGZKAKQZTOU-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD O=C(NCCN1C(=O)CCC1=O)c1ccc([N+](=O)[O-])[nH]1 265015064 HVOLXZYHSJRRPI-UHFFFAOYSA-N 280.240 -0.198 5 20 CBBD CC1(C)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 279690727 GBSAQVXVZXYOPY-MNOVXSKESA-N 284.316 -0.145 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1COC[C@H]1O 286640330 BUZXQWJJYRYMCO-NXEZZACHSA-N 298.299 -0.292 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(F)(F)CO 344951382 QVRMZMZLAZSKDR-UHFFFAOYSA-N 264.188 -0.314 5 20 CBBD O=[N+]([O-])c1ccn(CCN2[C@H](CO)CC[C@@H]2CO)n1 347292530 BVFQCQLCIXKUOK-AOOOYVTPSA-N 270.289 -0.391 5 20 CBBD NC(=O)NC(=O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 357066446 BRUHKABFUFNQQY-UHFFFAOYSA-N 287.253 -0.437 5 20 CBBD CN(C[C@@H](O)CNCCn1cc([N+](=O)[O-])cn1)C1CC1 577503495 QXPQQTYGZHMOQT-LBPRGKRZSA-N 283.332 -0.164 5 20 CBBD COCC1(O)CN(c2ccnc(O)c2[N+](=O)[O-])C1 596250589 GYKKWGNGDKHCMU-UHFFFAOYSA-N 255.230 -0.107 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC12CCCN1CCC2 597586687 HJIMBHKMTFAFSH-UHFFFAOYSA-N 294.315 -0.069 5 20 CBBD COC(=O)c1ccnc(NCCNC(N)=O)c1[N+](=O)[O-] 598597442 FOPMSEDMNCZDAV-UHFFFAOYSA-N 283.244 -0.143 5 20 CBBD C[C@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600653051 ZANITNMNZXNJQS-BYPYZUCNSA-N 278.246 -0.920 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CN1C1CC1 610654050 FROMOJQYFFCYCV-IUCAKERBSA-N 294.315 -0.072 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 610892078 PXNKPDBWVMAZFU-ZCFIWIBFSA-N 284.228 -0.448 5 20 CBBD CC(C)(CC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 736312334 KQTHKXNUIOEIJT-UHFFFAOYSA-N 271.233 -0.444 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)[C@H]1C[C@H]1C(=O)O 833181572 PZLMAMXJCPFQPM-RITPCOANSA-N 270.201 -0.550 5 20 CBBD COC(=O)[C@@H]1C[C@H](F)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840440402 AOFDDCQREUCMLS-OSMVPFSASA-N 260.221 -0.236 5 20 CBBD CC(=O)N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21 976009411 HXDFCFLEGJYPBD-SPFKKGSWSA-N 253.258 -0.756 5 20 CBBD NC(=O)[C@H](CO)NC(=O)Cc1cccc([N+](=O)[O-])c1 1322672578 XZDGRSBNMNBXJX-VIFPVBQESA-N 267.241 -0.900 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CNCCO1 1326451081 LFYUXZZPTJHIKD-ZETCQYMHSA-N 269.261 -0.954 5 20 CBBD C[C@H](c1nnc(N2CCN3C(=O)CC[C@H]3C2)n1C)[N+](=O)[O-] 1338057268 OIRZCQZUZPPPKL-BDAKNGLRSA-N 294.315 -0.036 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN[C@@H]2C[C@@H]21 1579877704 ZQMSGKUFFAYNJE-BDAKNGLRSA-N 265.273 -0.328 5 20 CBBD CN1C(=O)CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CC1=O 1598552252 HFYDIAKSEZWTES-UHFFFAOYSA-N 294.223 -0.507 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 185940720 YIDWWUAYLZWQMB-ZJUUUORDSA-N 298.299 -0.210 5 20 CBBD COCCCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 351259093 IFQNTRFZWHXQRM-UHFFFAOYSA-N 299.287 -0.457 5 20 CBBD C[C@H]1COCCN1CCNc1ncc([N+](=O)[O-])cn1 354600239 JWPZECDBMYGIGI-VIFPVBQESA-N 267.289 0.517 5 20 CBBD O=C1C[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CN1 443037665 MBODOAQUZRXGKS-ZETCQYMHSA-N 285.281 -0.238 5 20 CBBD CNC[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 595984114 VFQVUBNWVIFWPO-SSDOTTSWSA-N 255.278 -0.176 5 20 CBBD COC[C@H](NC(=O)c1cc(OC)ccc1[N+](=O)[O-])C(N)=O 760043080 KKEWOBAKGZRYSP-VIFPVBQESA-N 297.267 -0.167 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)O[C@@H]1CCCNC1=O 767278474 FLEHCNFMBYMJHV-MRVPVSSYSA-N 268.229 -0.387 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CO)[C@@H](O)C1 798998929 JTMPCABVJQLKFA-PELKAZGASA-N 295.295 -0.008 5 20 CBBD CNC(=O)CN(C)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1115994070 ODZSJZOVDCSUSB-UHFFFAOYSA-N 255.234 -0.556 5 20 CBBD C[C@@]1(CO)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@]1(C)CO 1118948917 HYKRJMSOUHCWFI-TXEJJXNPSA-N 298.299 -0.229 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2C(=O)CCC2=O)c1[N+](=O)[O-] 1318536417 QQPSKAAAMHIGEH-UHFFFAOYSA-N 295.255 -0.495 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC2OCCO2)c1=O 1318661448 LEBVPHPDIXSYNH-UHFFFAOYSA-N 269.213 -0.772 5 20 CBBD O=CN1CCC(OC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1347153497 QXXYCPOSDKJJEX-UHFFFAOYSA-N 282.256 -0.045 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1nnc([C@H](C)[N+](=O)[O-])n1C 1355414479 CSAUIIUVBDNEEI-YUMQZZPRSA-N 282.304 -0.180 5 20 CBBD CC(C)(CCC(=O)NCC[C@H](O)C(=O)O)[N+](=O)[O-] 1603593145 MZUBPDWVOPXTTG-ZETCQYMHSA-N 262.262 -0.226 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 50858616 XAEYNTKXHGCVFS-SSDOTTSWSA-N 269.213 -0.486 5 20 CBBD CC(=O)N1CCN(CCNc2c([N+](=O)[O-])ncn2C)CC1 71953887 UHHWJPVVFATFGE-UHFFFAOYSA-N 296.331 -0.096 5 20 CBBD COC[C@@H](C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152835992 ZDLUOMKJLWBPMI-MRVPVSSYSA-N 292.317 -0.254 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 273828129 LCJKJAASJFSCGX-QMMMGPOBSA-N 298.251 -0.251 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 278255375 WIKJNIHDUOORMH-QMMMGPOBSA-N 294.267 -0.002 5 20 CBBD Cc1cn(CC(=O)N2CCOCC2)nc1[N+](=O)[O-] 282230145 KYKPMBHXEDBQDO-UHFFFAOYSA-N 254.246 -0.041 5 20 CBBD O=C(NCCn1ncnn1)c1cc([N+](=O)[O-])c[nH]1 359276207 CXPVMMXQDVUJOW-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD CN1C(=O)CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 425278014 DHHNRDGCCOAKMA-RXMQYKEDSA-N 280.244 -0.474 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H](O)CO)c1 561383140 WXPCMEXYDPEBBB-WDEREUQCSA-N 286.284 -0.723 5 20 CBBD CC[C@H]1CN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 563645578 FGGUXFZLCYBBMW-VIFPVBQESA-N 282.304 -0.261 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 583023874 RHAUAECAJHESPJ-QMMMGPOBSA-N 282.256 -0.505 5 20 CBBD NC[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCCO1 592983505 WCQDGCNPLBZSHH-NSHDSACASA-N 269.305 -0.159 5 20 CBBD Nc1nccc(C(=O)NC[C@H]2CCCNC2=O)c1[N+](=O)[O-] 594285708 ANTFDVGLZCIIMO-SSDOTTSWSA-N 293.283 -0.172 5 20 CBBD CON(C)C(=O)[C@H](CCSC)NCC[N+](=O)[O-] 905167430 VANRMFQRORKNLA-QMMMGPOBSA-N 265.335 -0.006 5 20 CBBD CN(CCNc1ncccc1[N+](=O)[O-])C(=O)C(N)=O 1101944997 VZGYQDBUQBEQQF-UHFFFAOYSA-N 267.245 -0.655 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1256261710 CFTHOWRNKQYGMH-WKEGUHRASA-N 270.245 -0.412 5 20 CBBD CN(C)C(=O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591000717 AOPJZJHAMXNWBP-UHFFFAOYSA-N 292.259 -0.330 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCOC1 179269484 OQRBMCQJMRONHY-MRVPVSSYSA-N 269.261 -0.121 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@H](C)O 274547079 WXUBQUVXAPFRGW-RCOVLWMOSA-N 298.251 -0.047 5 20 CBBD COCCN1CN(CCn2ccc([N+](=O)[O-])n2)CC1=O 282413380 GFZULCRLSQRFOY-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)C1 289796191 YBLJGMAUXZOYFI-YUMQZZPRSA-N 256.262 -0.339 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1csc([N+](=O)[O-])c1 344021492 OZHOQGPGAXMCEM-UHFFFAOYSA-N 286.269 -0.029 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 344212332 HCJYBMYWELOLTN-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD NS(=O)(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])cn2)C1 354515167 ZOXNTNYCEAJLKB-MRVPVSSYSA-N 287.301 -0.358 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@]1(CO)CCOC1 393893105 SXJANBCVGXJKMK-LLVKDONJSA-N 269.257 -0.186 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCNC1 428651107 KLXICASIIVJLRB-MRVPVSSYSA-N 253.262 -0.422 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCN1 446447354 VWKIWXDUOPALAB-SSDOTTSWSA-N 253.262 -0.238 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(=O)N(C)C(=O)C2)c1[N+](=O)[O-] 555555873 JGIMDRWIVGYZME-UHFFFAOYSA-N 295.255 -0.922 5 20 CBBD CNc1nccc(C(=O)N2CC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 574582193 DSHWIEQFZFRKEK-ZETCQYMHSA-N 293.283 -0.021 5 20 CBBD N[C@@H](CO)Cc1cn(-c2ccc(O)cc2[N+](=O)[O-])nn1 594652774 OGVHKYMQDPISMU-SSDOTTSWSA-N 279.256 -0.257 5 20 CBBD CCn1ncn(NC(=O)c2n[nH]cc2[N+](=O)[O-])c1=O 816735266 YRYJOZCRMAZBQD-UHFFFAOYSA-N 267.205 -0.920 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(N2CCOCC2)C1 911653500 NTCWMXKTRQQJJF-UHFFFAOYSA-N 295.299 -0.666 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCS(=O)CC1 1117136336 CMXDMNXYTIPIHR-UHFFFAOYSA-N 258.259 -0.478 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1(C(=O)O)CC1 1320896192 YIPXYBDXULRCAP-UHFFFAOYSA-N 254.202 -0.325 5 20 CBBD NC(=O)COC1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 1322385625 JIXKECVHMRQIOQ-UHFFFAOYSA-N 297.315 -0.242 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H](C(=O)O)C1 1327820223 WRISIPMRUZUOGG-IZLXSQMJSA-N 268.229 -0.079 5 20 CBBD C[S@@](=O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 1330033872 CRYNQVQYSUMJOK-GOSISDBHSA-N 272.286 -0.121 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCC1=NNC(=O)C1 1330831305 IEFSJLAIYQKTQI-UHFFFAOYSA-N 294.271 -0.286 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H]2CCC(=O)N2)c1 1332572536 MAVZUULFXBFDLH-QMMMGPOBSA-N 295.251 -0.178 5 20 CBBD CCOC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1596891855 WWTDEBRQWNPOGE-MRVPVSSYSA-N 286.240 -0.148 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N[C@H](CO)C(=O)O 1601329753 OOLHJTSLHMJFPD-MRVPVSSYSA-N 283.240 -0.432 5 20 CBBD O=C(O)[C@H](O)C1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1601684675 GNQXFEJHYIKYMY-MRVPVSSYSA-N 298.255 -0.384 5 20 CBBD O=C1C[C@@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CN1 1609587147 GHEQYDCOQIDVCC-RXMQYKEDSA-N 290.243 -0.530 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[C@@H]1C(=O)O 1777176953 IQPXFGHXGLIALX-XPUUQOCRSA-N 297.271 -0.107 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccccc1[N+](=O)[O-] 22213035 JGGWAPKUWXCPMJ-SSDOTTSWSA-N 254.198 -0.230 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCn1cc(C(=O)O)nn1 116363937 OSNPUNIYLIHKDM-UHFFFAOYSA-N 281.232 -0.270 5 20 CBBD NC(=O)C1(O)CCN(c2ncc([N+](=O)[O-])s2)CC1 310929411 SUTZVDAMFFIZRM-UHFFFAOYSA-N 272.286 -0.132 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 352582931 NFJSMMXXJQZMED-ZETCQYMHSA-N 284.228 -0.668 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(F)(F)F 360739238 RIAFKSBCNBEDED-YFKPBYRVSA-N 282.178 -0.019 5 20 CBBD CCC[C@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 412529945 WQJVVUCSYOXEFR-UWVGGRQHSA-N 299.283 -0.053 5 20 CBBD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCCN 428772657 NCZSJQCOYDFBIM-MRVPVSSYSA-N 284.320 -0.098 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C)NC1=O 450609800 FHYOIXDMYMDAIA-SECBINFHSA-N 294.267 -0.322 5 20 CBBD NC(=O)[C@@]1(NC(=O)Cc2cccc([N+](=O)[O-])c2)CCOC1 583154071 XBFVOYJOSIJNHT-CYBMUJFWSA-N 293.279 -0.102 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(CO)CC1 610768590 LNKQUMZYWFIGOE-UHFFFAOYSA-N 268.273 -0.012 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NO[C@H]1CCCCO1 749619227 UOFJPLUSTHXGOM-QMMMGPOBSA-N 271.233 -0.239 5 20 CBBD O=C1CC[C@H](n2cc([N+](=O)[O-])ccc2=O)C(=O)N1 765830088 ZCEOPERAGCHBDU-ZETCQYMHSA-N 251.198 -0.266 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC2(C1)OCCO2 796131275 BIKYNZNFOWXKLE-UHFFFAOYSA-N 268.229 -0.093 5 20 CBBD COc1ccc(C(=O)Nn2c(O)nnc2O)cc1[N+](=O)[O-] 816731489 SZZCQDXJNMBTJG-UHFFFAOYSA-N 295.211 -0.010 5 20 CBBD CN1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](CN)C1 834301547 LHLYVCHNKUCTFF-JTQLQIEISA-N 293.327 -0.108 5 20 CBBD Nc1nccc(C(=O)N2CCCNC(=O)C2)c1[N+](=O)[O-] 847427492 VXGVGVBYKMDDPC-UHFFFAOYSA-N 279.256 -0.466 5 20 CBBD CN(C)CCONC(=O)c1cc([N+](=O)[O-])cnc1N 854945917 WDRHHQKVRLSLAA-UHFFFAOYSA-N 269.261 -0.205 5 20 CBBD CN1CCN(C(=O)CNc2c([N+](=O)[O-])cnn2C)CC1 892085809 PPGBRZVNMOPMKZ-UHFFFAOYSA-N 282.304 -0.486 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H](N2CCCC2=O)C1 1121391536 GXFZGNVVSGNBOT-SECBINFHSA-N 294.315 -0.207 5 20 CBBD Cn1nccc1CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592607939 WFXGDVQKOVPDRM-UHFFFAOYSA-N 289.259 -0.052 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)O[C@H](C(=O)O)C1CC1 1601390113 POAUNLAEEMRKIA-ZETCQYMHSA-N 270.201 -0.407 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)C(=O)O 90276621 IXJIRXRDVGLFOZ-JTQLQIEISA-N 271.229 -0.501 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCOC[C@H]1CO 168824069 GBVZKIBLPNQWQF-SNVBAGLBSA-N 270.289 -0.207 5 20 CBBD COC[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CCO1 172618255 BBBKCFWNRPMTQR-SNVBAGLBSA-N 298.299 -0.026 5 20 CBBD C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 186071348 FGWOVXHJTXNQLR-LURJTMIESA-N 273.270 -0.253 5 20 CBBD O=C(NC(CO)CO)c1cccc([N+](=O)[O-])c1O 273284479 BABUGDOCEDIPDV-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD CN1CCN(CCCNC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285046044 PYWPEUMVYCKPEQ-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD NC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 342568424 NOBRGZHEXVGRAD-UHFFFAOYSA-N 288.285 -0.459 5 20 CBBD C[C@@H]1CNCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 432516993 YMLLPEBMEMYEEM-KOLCDFICSA-N 294.311 -0.129 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cccc([N+](=O)[O-])c1O 436536362 PXIQOOIYOCQXIS-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD COC(=O)N1CC(NC(=O)c2c([N+](=O)[O-])cnn2C)C1 492587316 MARZGHCDVPQBSC-UHFFFAOYSA-N 283.244 -0.491 5 20 CBBD CNc1nccc(C(=O)NCCC(=O)OC)c1[N+](=O)[O-] 553269868 PKUMUZSIBWYIBU-UHFFFAOYSA-N 282.256 0.324 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 592195155 JKKBIOBMKWRSQW-KOLCDFICSA-N 298.299 -0.353 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCOC2)nc1 593601602 KPJOPDFYCNNMCJ-UHFFFAOYSA-N 259.243 -0.032 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CCNC2=O)CC1 831767917 QGEYNEUUNGENIN-RKDXNWHRSA-N 267.285 -0.220 5 20 CBBD CN1CC[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 1118909649 WSIKSDTYIRJPBS-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1cc([N+](=O)[O-])cnc1N 1261754421 YTHZGHNJFCJKSJ-UHFFFAOYSA-N 291.271 -0.027 5 20 CBBD Cc1nc(Cn2cc(C(=O)O[C@H](C)C[N+](=O)[O-])nn2)no1 1514774447 JJDZVALVIABZDX-ZCFIWIBFSA-N 296.243 -0.160 5 20 CBBD Cn1nccc1CNC/C=C/CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1754118753 CZIGZCOLAMKIKA-JGLYPNHGSA-N 293.327 -0.153 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 36816393 AXGGKLOHKUQVIN-ZCFIWIBFSA-N 257.202 -0.813 5 20 CBBD COC(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 49422353 CRVZFJGJHHOTHX-UHFFFAOYSA-N 256.218 -0.611 5 20 CBBD CC[S@@](=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 132754531 MJODRRAHPYPXCL-DGIBIBHMSA-N 290.345 -0.490 5 20 CBBD NS(=O)(=O)CCn1cc([N+](=O)[O-])c(C2CC2)n1 195042566 HHCBHFWVYHSGOV-UHFFFAOYSA-N 260.275 -0.043 5 20 CBBD CNC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 230685438 XRGYQJOFXKGZNT-UHFFFAOYSA-N 267.245 -0.562 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(C(=O)O)CC1 263157969 OBYNQXJTGHFHGE-UHFFFAOYSA-N 268.229 -0.167 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 277836739 RRVUQZWLPCPYIM-LURJTMIESA-N 282.256 -0.050 5 20 CBBD COCC[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 282011673 XYZNGNMMDXAGEY-LURJTMIESA-N 257.250 -0.224 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 282431730 RBRANEDPDXHCRE-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285430806 KOPNRFQICHFARN-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286686249 FGNUCEOOUBJWTF-APPZFPTMSA-N 298.255 -0.544 5 20 CBBD CS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 299109192 PSRGTMIENKGXBF-UHFFFAOYSA-N 261.259 -0.303 5 20 CBBD CNC(=O)C[C@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 322770513 IEDBZPUPXZPFFM-WCBMZHEXSA-N 285.304 -0.734 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 344976047 MNGHCZUGJQLWKA-SSDOTTSWSA-N 296.287 -0.230 5 20 CBBD CCOC(=O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 352638970 YJJJILYRLVCESA-UHFFFAOYSA-N 297.271 -0.260 5 20 CBBD CSc1ccc(C(=O)N[C@@H](CO)C(N)=O)cc1[N+](=O)[O-] 352981440 ARXIJZPRMVXHIK-ZETCQYMHSA-N 299.308 -0.107 5 20 CBBD Cn1cnc(CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 353922855 MWXKMQWVWUQWEH-UHFFFAOYSA-N 265.233 -0.581 5 20 CBBD COC(=O)c1cnc(NCCn2ncnn2)c([N+](=O)[O-])c1 357691520 BGHIWGPQJJEBGH-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC(S(C)(=O)=O)C1 407976350 NJKBCMZOPKALKR-UHFFFAOYSA-N 260.275 -0.439 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@H](O)C1 598530452 QLFKZUMDQXADJQ-ZKCHVHJHSA-N 254.246 -0.261 5 20 CBBD CN1N=C(C(=O)OCCn2cc([N+](=O)[O-])cn2)CCC1=O 748108466 FZMLYWNWPLSSJD-UHFFFAOYSA-N 295.255 -0.057 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCn1cnnn1 807922058 IEEGLWMALXYPSN-UHFFFAOYSA-N 294.275 -0.707 5 20 CBBD C[C@H]1CCS(=O)(=O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 834447933 LDZWIWWRNABQNF-DJLDLDEBSA-N 276.314 -0.313 5 20 CBBD CN1CC[C@@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1 928569604 NJZNIEQRNOCUDE-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD Cc1nc(NCCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1094079601 QVRAWMDJKAFYPR-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 1319613024 ZYUJOXXMBDBSEQ-QMMMGPOBSA-N 282.304 -0.707 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1nc[nH]n1 1320128868 SXLKLLUCJGWGFA-UHFFFAOYSA-N 279.260 -0.076 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H](CC(F)F)C(=O)O 1601390230 XGYAGDCSINIOAV-SCSAIBSYSA-N 293.186 -0.589 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@]1(CC(=O)O)CCOC1 1608159076 KGVFANXBRJJDAH-NSHDSACASA-N 298.255 -0.308 5 20 CBBD O=C(O)[C@H]1CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cn1 1608639529 BJQBVXAEUZDQLU-SSDOTTSWSA-N 287.253 -0.163 5 20 CBBD Nc1c(C(=O)NC(CO)CO)cccc1[N+](=O)[O-] 132318474 SHMWIYDHDNAYTN-UHFFFAOYSA-N 255.230 -0.740 5 20 CBBD NC(=O)Cn1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)nn1 174173193 AHHSNSBZHIFZTG-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)NCCO 268706930 ZDNWCUUMTSSXTH-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD Cc1nncn1CCNC(=O)c1cc([N+](=O)[O-])cnc1N 353499711 WYOMXIXAZMVDOG-UHFFFAOYSA-N 291.271 -0.098 5 20 CBBD Cc1nn(C)c(NCc2nnn(C)n2)c1[N+](=O)[O-] 362838965 PJGJXJAIENYRAQ-UHFFFAOYSA-N 252.238 -0.228 5 20 CBBD O=C(O)c1cnc(N2CC[C@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 396795563 DUOGSHHRZGVFRU-SCZZXKLOSA-N 297.267 -0.133 5 20 CBBD CN1CCNC[C@H]1CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 415385820 OMBSANAGNPOMIF-VIFPVBQESA-N 294.315 -0.563 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 571415841 FWBYSKLSUYKGAT-YUMQZZPRSA-N 296.283 -0.401 5 20 CBBD N[C@H]1C[C@@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 578787361 MHXXJTGEGNADMQ-BDAKNGLRSA-N 277.284 -0.262 5 20 CBBD Nc1nc(NC2CCS(=O)(=O)CC2)ncc1[N+](=O)[O-] 749255568 FMXQAFCTZJJAGC-UHFFFAOYSA-N 287.301 -0.044 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CO)[C@H](O)C1 798998930 JTMPCABVJQLKFA-PRHODGIISA-N 295.295 -0.008 5 20 CBBD C[C@@H](CN1CCOCC1)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839747858 UVGXXFIPJWFNIE-HBNTYKKESA-N 271.317 -0.169 5 20 CBBD CC1(C)COC(=O)[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 846652397 OVWXLPLPFNMJEK-ZCFIWIBFSA-N 268.229 -0.001 5 20 CBBD Nc1ncc2c(n1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2 857969352 WTHOWULXDFWQAM-VXNVDRBHSA-N 263.257 -0.391 5 20 CBBD C[C@H](N)C[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118271017 SXNCMJCLCRUKMV-DTWKUNHWSA-N 282.300 -0.002 5 20 CBBD NC(=O)c1cc(N2CC[C@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-] 1118591678 FIIVDYNEWZBCHY-PELKAZGASA-N 295.295 -0.127 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1cc[nH]n1 1319648318 XKFQZTGJIRRUKE-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCCC(N)=O 1319766545 LCSYGWAXXOWHBC-UHFFFAOYSA-N 283.288 -0.128 5 20 CBBD CC(C)(C(=O)NCC1(CO)COC1)n1cc([N+](=O)[O-])cn1 1324247722 ZWOATJCVKCJIED-UHFFFAOYSA-N 298.299 -0.349 5 20 CBBD O=[N+]([O-])c1cc(NC[C@@H](O)CO)ccc1-c1nn[nH]n1 1609601293 VWYUXWLLYWAJGH-SSDOTTSWSA-N 280.244 -0.460 5 20 CBBD CN(CCC(=O)O)C(=O)Cn1ccc([N+](=O)[O-])n1 50162260 PKFKRZVPFHGMHJ-UHFFFAOYSA-N 256.218 -0.276 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC1[C@H]2CNC[C@H]12 102505605 LLBFREDKXCDSKD-YUMQZZPRSA-N 250.258 -0.119 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 135518941 SVZDCNZRSDMDIO-QMMMGPOBSA-N 298.255 -0.808 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)N1 153312705 GWEJDZGKDBTGEH-OCAPTIKFSA-N 268.277 -0.605 5 20 CBBD COC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 167362990 SDVANSIJTYQBBV-ZETCQYMHSA-N 272.217 -0.993 5 20 CBBD C[C@@H](O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173799703 NTJYTNGCEUJWMW-SCZZXKLOSA-N 258.278 -0.535 5 20 CBBD C[C@]1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 225188015 FZEWCLCLAHWMAL-JTQLQIEISA-N 254.246 -0.225 5 20 CBBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)C(N)=O)c1 227871934 QJTXJGDJVOJTGF-SECBINFHSA-N 299.308 -0.107 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 227872810 DAOWIPIKKRKZGB-SECBINFHSA-N 267.241 -0.900 5 20 CBBD O=C(c1ccc([N+](=O)[O-])s1)N1C[C@H](O)[C@@H](O)C1 236574151 PZVKYUROANXRFN-WDSKDSINSA-N 258.255 -0.166 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CN(C)CCO2)c1[N+](=O)[O-] 263716768 RGLHUMLQOOOOHO-MRVPVSSYSA-N 283.288 -0.313 5 20 CBBD CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCNC1=O 281979477 WEQVCIUSYFPMEZ-LLVKDONJSA-N 294.311 -0.033 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 555558434 OUQVSFRBJWHVQS-SSDOTTSWSA-N 266.213 -0.590 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NCCOCCO)n1 566294232 VVNBHMNBILXZCS-UHFFFAOYSA-N 285.256 0.417 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC1CC(NS(C)(=O)=O)C1 619746023 IFXUDKQOKKRMCB-UHFFFAOYSA-N 289.317 -0.180 5 20 CBBD C[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])S(C)(=O)=O 1116933024 XUBIJGCAOCNWNN-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD NC(=O)c1cc(N2C[C@H](O)[C@@H](CO)C2)ccc1[N+](=O)[O-] 1118597168 VCPVXHHPRFRXAV-HQJQHLMTSA-N 281.268 -0.517 5 20 CBBD COCC(=O)NCCCNCc1c([N+](=O)[O-])ncn1C 1153979485 CPQZPCPJEXHZEY-UHFFFAOYSA-N 285.304 -0.429 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 1321966746 JFJHYUVOKYYRSG-SECBINFHSA-N 298.251 -0.046 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2C=C[C@H](CO)C2)c1 1326201587 XGGWOCFDCKYBIR-UMNHJUIQSA-N 282.300 -0.321 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(=O)O 1598680386 FUQCIJFCQOXBCM-VIFPVBQESA-N 283.240 -0.188 5 20 CBBD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NCCO 35114771 DLQWDYYXJBPPHD-UHFFFAOYSA-N 295.251 -0.571 5 20 CBBD CCCN(CCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 174658261 CFACLRWXHQWGJY-LLVKDONJSA-N 272.305 -0.144 5 20 CBBD COC(=O)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 176229683 AUUOHABAFJMICG-VIFPVBQESA-N 284.272 -0.335 5 20 CBBD CC(CO)(CO)NC(=O)Cc1cccc([N+](=O)[O-])c1 183519103 IQLAMLCRYLFMJP-UHFFFAOYSA-N 268.269 -0.003 5 20 CBBD COc1c(C(=O)NC[C@@H](O)C(N)=O)cccc1[N+](=O)[O-] 228486656 TWWWFXNFBBZJNH-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD CCCN(CC(=O)NC)c1ncc([N+](=O)[O-])c(N)n1 265970353 BBWWMVZKFIVXHL-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD COC[C@@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)OC 285496213 AHTLKYYMSBGSLQ-ZCFIWIBFSA-N 258.234 -0.291 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CC1CC1)C(=O)O 347517669 MKVNOFYOQULBNQ-ZETCQYMHSA-N 283.244 -0.444 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[S@@]1=O 353229702 LUKQFGDJLRCFHE-QQOXFEPMSA-N 272.286 -0.089 5 20 CBBD CN(C[C@@H](O)CO)C(=O)COc1ccc([N+](=O)[O-])cc1 355614176 ILIKNIZORFEDCR-SNVBAGLBSA-N 284.268 -0.215 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCNc1cnccn1 356469178 SMXMZGSCTNETJJ-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD CCn1cc(S(=O)(=O)N2CC[C@H](O)C2)c([N+](=O)[O-])n1 407990937 QSAYMNCKESSMLC-ZETCQYMHSA-N 290.301 -0.434 5 20 CBBD Nc1nc(=NC[C@H]2CC[C@H](C(N)=O)CC2)[nH]cc1[N+](=O)[O-] 420612326 UGTCCCJPVORMLN-OCAPTIKFSA-N 294.315 0.093 5 20 CBBD NC(=O)Cn1ccc(NC(=O)c2ccc([N+](=O)[O-])cn2)n1 531627347 NMIFITGICPHYJG-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc([N+](=O)[O-])cn1C 546830039 NPNYVWHFVRUQSM-QMMMGPOBSA-N 257.246 -0.642 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCCc1nc[nH]n1 565147311 OPJTUOGHUJBKBL-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 593813487 GEBDRVMFLSOBJX-SYDPRGILSA-N 253.218 -0.688 5 20 CBBD COC(=O)c1ccnc(NCC(=O)NCCO)c1[N+](=O)[O-] 598604977 RBKOMRFQSMQFQO-UHFFFAOYSA-N 298.255 -0.703 5 20 CBBD Cn1c(C(=O)NCCN2CC[C@H](O)C2)ccc1[N+](=O)[O-] 600808220 MYXUJEDEOZNRBJ-VIFPVBQESA-N 282.300 -0.270 5 20 CBBD C[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820121853 FOUZHWHMAUHGAG-ZCFIWIBFSA-N 269.213 -0.654 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1S(C)(=O)=O 839720509 IAJMEBPIZRDOJG-DJLDLDEBSA-N 291.329 -0.856 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1COCO1 861969337 QBCZWNXDYAYMTD-MRVPVSSYSA-N 270.245 -0.411 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1cccc([N+](=O)[O-])c1 862739354 LWGQRILYCLXWIZ-UHFFFAOYSA-N 299.308 -0.030 5 20 CBBD CC(C)[C@H](O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411529 KCLHQOBKCHWWJA-LLVKDONJSA-N 283.284 -0.110 5 20 CBBD CCN(CC(=O)NC)C(=O)c1c[nH]nc1[N+](=O)[O-] 1321753961 QKXCBUAPPOWOHM-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD O=C(NC[C@H](F)C(=O)O)c1cc([N+](=O)[O-])cnc1O 1601522301 LLAPUTRSRDMBGC-LURJTMIESA-N 273.176 -0.152 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(=O)O 1610563247 DFQPTVNXENLFGK-QMMMGPOBSA-N 269.213 -0.526 5 20 CBBD C[C@@H](CCO)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 97440672 RXPMVWDLWYDFJD-ONGXEEELSA-N 272.305 -0.240 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@]1(C(=O)O)CCOC1 262214089 SIONPZULYUTFRM-LLVKDONJSA-N 298.255 -0.540 5 20 CBBD NC(=O)[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CCN1 269371632 MLBUEQPXBWSFIE-SSDOTTSWSA-N 285.691 -0.093 5 20 CBBD COC(=O)N1CC(NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 270709986 COVKBMXNTQCHLU-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD CC1(O)CN(c2ccc(S(N)(=O)=O)cc2[N+](=O)[O-])C1 276385473 ZDECRKNCLUCVLM-UHFFFAOYSA-N 287.297 -0.187 5 20 CBBD CN1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 330668795 CNHFGRZQLMWKEA-SNVBAGLBSA-N 294.311 -0.176 5 20 CBBD Nc1c([N+](=O)[O-])cnn1Cc1nnn(CC(F)(F)F)n1 351913004 OBDYFUFPUBYQCU-UHFFFAOYSA-N 292.181 -0.029 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354096757 LMTUGHKAPBIPAN-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CC(=O)NC1=O 355322206 QTAOUWOIIZKXMD-QMMMGPOBSA-N 280.240 -0.200 5 20 CBBD Nc1ncncc1CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359026109 MAEVDFMNHHFNEI-UHFFFAOYSA-N 289.255 0.106 5 20 CBBD Nc1c(C(=O)N2C[C@H](O)C[C@H]2CO)cccc1[N+](=O)[O-] 371526947 UIWMITFQENEBST-JGVFFNPUSA-N 281.268 -0.255 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(O)(C(F)F)C1 425027792 XDLQZGVPDMJFEZ-UHFFFAOYSA-N 290.226 -0.062 5 20 CBBD NC(=O)CCCC(=O)NCCn1cc([N+](=O)[O-])cn1 427041763 VOUADCXNIHSEJO-UHFFFAOYSA-N 269.261 -0.437 5 20 CBBD NS(=O)(=O)c1cc(NC[C@H](O)CO)cc([N+](=O)[O-])c1 436442954 FDTNQCMLXZXMQR-QMMMGPOBSA-N 291.285 -0.993 5 20 CBBD C[S@@](=O)C1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 442925063 QOACWSRLUYNYLH-LJQANCHMSA-N 286.313 -0.181 5 20 CBBD Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)cc([N+](=O)[O-])c1 450618726 WDWUYRBJMZROCY-JTQLQIEISA-N 278.268 -0.022 5 20 CBBD Cn1nncc1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 492420552 ZRDYJZFFDSKODJ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CNC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 558758900 YSPWRZCAXSYOFN-UHFFFAOYSA-N 282.260 -0.585 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@@H](O)CO)n1 565038716 VGUXOWRKOPGQND-ZCFIWIBFSA-N 271.229 -0.238 5 20 CBBD CNC[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 595981528 DUJWBPDINALHPF-QMMMGPOBSA-N 255.278 -0.095 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCOCCN1 597706431 VXBPJACNQWTSSA-UHFFFAOYSA-N 268.229 -0.328 5 20 CBBD CCc1[nH]nc(C(=O)N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 737244798 DTGARXNWWKCGTO-SSDOTTSWSA-N 298.255 -0.194 5 20 CBBD O=C1CN(NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)N1 772214760 MCMXQXVQXPSXBL-UHFFFAOYSA-N 280.196 -0.503 5 20 CBBD CCOCCONC(=O)Cn1ccc([N+](=O)[O-])n1 775238104 COYJCEZKOCEZDM-UHFFFAOYSA-N 258.234 -0.124 5 20 CBBD C[C@H](OC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 779103393 HUMIOXSRKSKSBE-BYPYZUCNSA-N 254.202 -0.397 5 20 CBBD COC(=O)C[C@@H](C)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839695644 JRIXRTACSSZLDT-GMTAPVOTSA-N 299.327 -0.253 5 20 CBBD COCCN(CC(=O)OC)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839714751 IDUNPCJZJAVANR-HTQZYQBOSA-N 260.246 -0.700 5 20 CBBD CC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)N1CCOCC1 840384132 FBLBMRRRLCQURO-KXUCPTDWSA-N 285.300 -0.595 5 20 CBBD Cc1ocnc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990396724 SAPHSZCOLMEOGF-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD COCC(=O)NC1(C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1073013114 QYWYTKRZKHYNHC-NXEZZACHSA-N 299.327 -0.205 5 20 CBBD CN1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 1324405712 VXSSQHQDEPTCHO-GFCCVEGCSA-N 293.279 -0.071 5 20 CBBD O=C(O)[C@@]1(O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 1601722248 FFFYMJKFANYKFO-SNVBAGLBSA-N 270.245 -0.687 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CO)C(=O)O)c1 1610348347 YKPITQZJSNPLCT-QMMMGPOBSA-N 284.224 -0.221 5 20 CBBD Cc1cc(NCCS(N)(=O)=O)ncc1[N+](=O)[O-] 73000272 HRHMIEJJSXONKM-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD CCNC(=O)C1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1 121601903 ZHAJLHGFMBCWGK-UHFFFAOYSA-N 295.299 -0.155 5 20 CBBD CC(CO)(CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1 126009139 JLXGTQSBUPAPRN-UHFFFAOYSA-N 268.269 -0.003 5 20 CBBD CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 163457193 GPSYNUDONDGPQK-SNVBAGLBSA-N 298.299 -0.210 5 20 CBBD O=[N+]([O-])c1c(N2C[C@H](O)[C@@H](O)C2)nc2sccn12 236556644 SFSGHMVVVYAVBY-WDSKDSINSA-N 270.270 -0.154 5 20 CBBD CCc1[nH]nc(C(=O)N2CCNC(=O)C2)c1[N+](=O)[O-] 264225564 ZCYONMHQEYUEGW-UHFFFAOYSA-N 267.245 -0.548 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NOCC(N)=O 272292692 VJPBHVDVEOEOIG-UHFFFAOYSA-N 282.256 -0.193 5 20 CBBD CN(c1ncc([N+](=O)[O-])c(N)n1)[C@@H]1CCNC1=O 340081083 NBJHSMFFIOQHPQ-RXMQYKEDSA-N 252.234 -0.708 5 20 CBBD CNC(=O)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 340614177 LXHVMFRHFFQRBJ-UHFFFAOYSA-N 266.257 -0.131 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 340973313 PKHWYFCBFFOZFG-IEBDPFPHSA-N 270.289 -0.393 5 20 CBBD CN1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C(=O)N1 349690191 FYWBLIUQPCNIOL-SSDOTTSWSA-N 297.246 -0.609 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCn1ncnn1 352870777 LQUQWYIXJUSJNT-UHFFFAOYSA-N 298.284 -0.440 5 20 CBBD C[C@](O)(CO)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 355292427 QVSWROMVOXHNAN-GFCCVEGCSA-N 294.267 -0.056 5 20 CBBD CO[C@@]1(CNC(=O)c2cc([N+](=O)[O-])nn2C)CCOC1 359479904 HIFZTQHILYCWBP-LLVKDONJSA-N 284.272 -0.136 5 20 CBBD COc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1[N+](=O)[O-] 444349777 CZEHJMAHXZCCLB-QMMMGPOBSA-N 294.267 -0.322 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(O)(C(F)F)C1 567716031 SZIZJGYWQULKBJ-UHFFFAOYSA-N 262.172 -0.230 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 570394389 BRTORPXMSSRCKU-PSASIEDQSA-N 282.256 -0.053 5 20 CBBD COC(=O)[C@@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 592556855 VKFNOQHVBQSYLD-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD CO[C@](C)(CO)CNc1ncc([N+](=O)[O-])cc1C(N)=O 594589687 PAWHMQAABCWBLQ-NSHDSACASA-N 284.272 -0.102 5 20 CBBD CN1C[C@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 772756929 JLCNGWDQAUESKL-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD CC(C)(C)NS(=O)(=O)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839521150 WGRALFDZNQYTDZ-HTQZYQBOSA-N 293.345 -0.514 5 20 CBBD O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNCC[N+](=O)[O-] 905158087 DEKFYVUMYVKFRN-UKKRHICBSA-N 279.296 -0.340 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCN(C(=O)C(N)=O)CC1 1055999315 HKCBFCZUQPIARA-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD Cc1[nH]nc(C(=O)NC2(CO)CCOCC2)c1[N+](=O)[O-] 1325039071 WISIUPRTQNWCJF-UHFFFAOYSA-N 284.272 -0.102 5 20 CBBD Cc1nn(C)c(C(=O)NC/C=C\CO)c1[N+](=O)[O-] 1328390688 GXRBPRCTXPCBQY-ARJAWSKDSA-N 254.246 -0.085 5 20 CBBD O=C(NC[C@@H]1[C@H]2CNC[C@H]21)c1cc([N+](=O)[O-])cnc1O 1580641884 LQNMOTYFIZXNJP-MYJAWHEDSA-N 278.268 -0.109 5 20 CBBD C[C@H](/C=C\C(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1592202101 SLIZGXHWDOAYPC-VROIDLATSA-N 269.217 -0.668 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(O)(C(=O)O)C2)c1[N+](=O)[O-] 1597399944 PVTUHNRIXFNEGW-UHFFFAOYSA-N 284.228 -0.848 5 20 CBBD CC(=O)N1CCN(c2c([N+](=O)[O-])ncn2C)CC1 7124579 DLMJSAYOSRCQJW-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC(O)CC1 35187621 HYFSPLWXCNTXNE-UHFFFAOYSA-N 267.241 -0.120 5 20 CBBD COC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 42238471 XJTVHWVTFXKEQU-LURJTMIESA-N 256.218 -0.531 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)N1CCOCC1 46268421 XMJFGXYDEXKHNY-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD CNC(=O)NC(=O)CCn1cc([N+](=O)[O-])ccc1=O 71858009 JCIRCESXYQDLJL-UHFFFAOYSA-N 268.229 -0.398 5 20 CBBD Cc1cc(N2CCO[C@H](C(N)=O)C2)ncc1[N+](=O)[O-] 80600151 QJJQEKMBIRVIAN-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD COC[C@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 231616466 LNQXJXGJVKSNIG-SECBINFHSA-N 272.261 -0.695 5 20 CBBD COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 231621753 SWVGPIWJDIXSAA-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD COC(=O)C(C)(C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 266558721 WZWIYPDSEXGKAI-VIFPVBQESA-N 286.288 -0.307 5 20 CBBD NC(=O)CN1CCC(Nc2ncc([N+](=O)[O-])c(N)n2)CC1 301126074 WGSDRSBQDLXGAT-UHFFFAOYSA-N 295.303 -0.671 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCS(=O)(=O)N(C)C 330574135 LCMHXEDSPBXLTB-UHFFFAOYSA-N 262.291 -0.009 5 20 CBBD Cc1cc(C(=O)N[C@H](CO)C(N)=O)ccc1[N+](=O)[O-] 352985612 HSTUBJDBDJSBNI-MRVPVSSYSA-N 267.241 -0.521 5 20 CBBD CN1CC[C@@](O)(CNc2c([N+](=O)[O-])ncn2C)C1 358325087 AJBNCTZGVASSFF-SNVBAGLBSA-N 255.278 -0.193 5 20 CBBD Cc1[nH]nc(C(=O)NC2[C@@H]3CNC[C@@H]23)c1[N+](=O)[O-] 495112988 VOTIJAKPEGGBNS-PHDIDXHHSA-N 251.246 -0.426 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H]2CNC[C@@H]21 567268542 FWFVRFLEIYNRPW-RQJHMYQMSA-N 251.246 -0.248 5 20 CBBD CCN1C[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 593826162 ULKSNQRSMSFAFO-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD COC(=O)c1ccnc(NC[C@H](O)CO)c1[N+](=O)[O-] 598606174 JQSMRSUIFSFWOL-LURJTMIESA-N 271.229 -0.459 5 20 CBBD CNC(=O)[C@@H](CO)Nc1nc2ccccn2c1[N+](=O)[O-] 763205803 FCWDOBFCVHVWMJ-SSDOTTSWSA-N 279.256 -0.239 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 846491292 POLWBEZMHFTUDG-UHFFFAOYSA-N 257.206 -0.885 5 20 CBBD CON1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 846977062 OOMXGAZSSGXNHM-NSHDSACASA-N 285.304 -0.669 5 20 CBBD O=C(NCCNc1ccnc(O)c1[N+](=O)[O-])c1nc[nH]n1 1093793366 PBZRHGVXFWWSQV-UHFFFAOYSA-N 293.243 -0.345 5 20 CBBD COC(=O)C1(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1116422346 SPDIPNYKAAYBSR-UHFFFAOYSA-N 295.251 -0.422 5 20 CBBD COC(=O)NC1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 1321850986 MHIXYGZBTZOTCR-UHFFFAOYSA-N 295.255 -0.016 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC/C=C\CO 1330922333 SZWCNQHVOLSBCK-UPHRSURJSA-N 254.246 -0.154 5 20 CBBD NCC1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1332413515 OEWHUZOZSYQZBW-UHFFFAOYSA-N 268.277 -0.616 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](C(=O)O)C1CC1 1339062460 UNMFSYLULSGMFU-ZETCQYMHSA-N 268.229 -0.079 5 20 CBBD O=C(CO)N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 89549332 SCYPWLJJXOAKKL-UHFFFAOYSA-N 293.279 -0.129 5 20 CBBD C[C@](O)(CNC(=O)COc1ccccc1[N+](=O)[O-])C(=O)O 90274662 LAXSGBFDUNZQLV-LBPRGKRZSA-N 298.251 -0.075 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C(=O)O 111252186 KCZQLFIXSWJPFH-VXNVDRBHSA-N 282.256 -0.030 5 20 CBBD O=C(NCC(F)(F)CO)c1n[nH]cc1[N+](=O)[O-] 186083453 RTNWCUAMOCADKW-UHFFFAOYSA-N 250.161 -0.325 5 20 CBBD Cc1cc(C(=O)NC[C@@H](O)C(N)=O)ccc1[N+](=O)[O-] 227868837 SRNHMWKSLCRVSM-SECBINFHSA-N 267.241 -0.521 5 20 CBBD CCN1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 273574252 YSPMKTLBMHNZQZ-NSHDSACASA-N 297.315 -0.684 5 20 CBBD CNC(=O)c1ccc(NCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1 301541892 CPSSFKYYRAUUCX-UHFFFAOYSA-N 292.255 -0.022 5 20 CBBD CN(C)[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330675916 STGDUNHMBBDHRL-VIFPVBQESA-N 282.304 -0.261 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCNC1=O 330713097 ZANIZLAGGILMGE-SECBINFHSA-N 281.272 -0.424 5 20 CBBD CN(CCC(N)=O)C(=O)CCn1cc([N+](=O)[O-])cn1 343500830 KYLFFYKSLUXMGH-UHFFFAOYSA-N 269.261 -0.485 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)[C@@H]1CCCO1 344854765 JZWXOZUZRSMUOG-UWVGGRQHSA-N 284.272 -0.553 5 20 CBBD O=C(NC1(c2nn[nH]n2)CC1)c1cc([N+](=O)[O-])n[nH]1 355054859 ZIXZNLAGMQYOLL-UHFFFAOYSA-N 264.205 -0.750 5 20 CBBD CNC[C@@H]1C[C@H](F)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 375072292 VAKQJTVQYFZORH-IUCAKERBSA-N 285.279 -0.050 5 20 CBBD C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C(N)=O 541876466 CMENMTVIAAIUQS-YFKPBYRVSA-N 281.224 -0.073 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@H]([C@@H](C)N)C2)c1[N+](=O)[O-] 592308916 PBTBEQLXPPPXTA-HTRCEHHLSA-N 283.288 -0.185 5 20 CBBD COCCONC(=O)c1ccnc(N)c1[N+](=O)[O-] 847548656 WMDWANWICAKJCM-UHFFFAOYSA-N 256.218 -0.120 5 20 CBBD Cc1nocc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 998738134 GBJIQDBZFSEDHO-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD COCCc1noc(Cn2cnc([N+](=O)[O-])n2)n1 1115987281 WTLYJWNGPLIUOR-UHFFFAOYSA-N 254.206 -0.194 5 20 CBBD CCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1261558920 UZGSKBIJHBUIAF-SECBINFHSA-N 298.299 -0.832 5 20 CBBD CC(C)(CO)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319471195 MVJPPXOFQFYFGZ-UHFFFAOYSA-N 283.284 -0.109 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC(=O)[C@@H]1CNCCO1 1579985255 URBAKZGWLNFERN-LURJTMIESA-N 255.234 -0.745 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)O 1601221155 LCUJUDKQTACFPQ-BRPSZJMVSA-N 292.251 -0.025 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN(C)C 68467434 YYDBVINQDFTPQQ-UHFFFAOYSA-N 255.278 -0.222 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN(CCO)CCO 90525923 DYUFEDDGVXPIAD-UHFFFAOYSA-N 271.273 -0.957 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCN1CCOCC1 180500774 FXBGULKSKYYBPB-UHFFFAOYSA-N 295.299 -0.366 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H](C(N)=O)C1 188597661 CGCCVEJYYIBQCW-WCBMZHEXSA-N 295.299 -0.096 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 229973964 UCVKKLGYOHXBNX-YVGDHZEHSA-N 279.252 -0.430 5 20 CBBD CCN[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 262474601 PUINILXIZWCANU-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cccc([N+](=O)[O-])c1O 273946486 XSSJFYHANVLCHD-ZETCQYMHSA-N 270.241 -0.274 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1 296486725 NKBJDCJUNCXCDQ-SNVBAGLBSA-N 250.258 -0.142 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CC(=O)NC1=O 299537299 PRBDBBLHONXZKT-QMMMGPOBSA-N 295.255 -0.945 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H](CO)[C@H]1CCCO1 344845267 HVCUHRBXBLLZSX-WDEREUQCSA-N 298.299 -0.163 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NC[C@@H](O)[C@H]3CCOC3)nn12 347861303 MNASWGARGWMDOF-DTWKUNHWSA-N 293.283 0.447 5 20 CBBD C[C@H](O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 360109201 FBFRUHNYJQDRSR-LURJTMIESA-N 254.246 -0.094 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H](O)C[C@@H]1CO 371642413 NLCRDCSDGQETKQ-BDAKNGLRSA-N 282.252 -0.132 5 20 CBBD O=C(C[C@@H]1CNCCO1)NCCn1cc([N+](=O)[O-])cn1 572400802 AYENEJGIHAMQCF-SNVBAGLBSA-N 283.288 -0.714 5 20 CBBD CN(CC(C)(C)O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345220 KHBWVXDWKQAULF-UHFFFAOYSA-N 283.284 -0.014 5 20 CBBD C[C@@H](CO)Nc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591726695 LBGUAZWXIGWEAX-YFKPBYRVSA-N 265.233 -0.037 5 20 CBBD COC(=O)CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 17440726 XIJZQHDMSAXYDH-UHFFFAOYSA-N 295.251 -0.386 5 20 CBBD CCOC(=O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 41684376 MYRKBVBISLFTFE-UHFFFAOYSA-N 283.240 -0.034 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCNC(=O)C1CC1 65769529 SGGLCCANHPDGGM-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD CNC(=O)CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] 79313008 AQDFNGLNXKFQEC-UHFFFAOYSA-N 280.284 -0.107 5 20 CBBD CC[C@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 135043627 ZBYFAAPDNBZTCR-QWRGUYRKSA-N 272.305 -0.097 5 20 CBBD COCCN(CCO)CCn1ccc([N+](=O)[O-])n1 176250744 WYPLFVXGPVJLRU-UHFFFAOYSA-N 258.278 -0.268 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@@H](O)C2)c2nonc12 236554621 GTUUKRYPQMPYQI-YUMQZZPRSA-N 266.213 -0.327 5 20 CBBD CNC[C@@H](C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 237299017 KAEWILUCKGKMQJ-MRVPVSSYSA-N 255.278 -0.237 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCO1 262339758 HSTOREMPEISMNE-VIFPVBQESA-N 280.284 -0.023 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)NC(CO)CO 266755870 ONEKRZDEIABLFP-UHFFFAOYSA-N 299.283 -0.244 5 20 CBBD COC(=O)c1cnc(NC[C@H](O)C(N)=O)c([N+](=O)[O-])c1 281059451 YKWAGOFQLKIYOZ-ZETCQYMHSA-N 284.228 -0.966 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1c([N+](=O)[O-])cnc1C 343801921 GOBKVGKCODMRIH-ZETCQYMHSA-N 299.287 -0.040 5 20 CBBD C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCS1(=O)=O 351991430 UTZGIAZZHZNGDS-PHDIDXHHSA-N 288.285 -0.377 5 20 CBBD C[C@H]1COCCN1CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 352641809 YIFROSWEPFHUAG-QMMMGPOBSA-N 282.304 -0.479 5 20 CBBD CCOC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360644478 AJTBKGFHSGLPEM-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD CCC[C@H](O)[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 412514775 FBDVKAJTBHLXDO-SCZZXKLOSA-N 299.283 -0.053 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](CN)C1 571678082 BHPFOXUPIGFQTA-ZETCQYMHSA-N 268.277 -0.967 5 20 CBBD CC[C@@H](O)CNS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 594786007 XGBZBLGXBPIOJF-SSDOTTSWSA-N 292.317 -0.140 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1cnc(O)c([N+](=O)[O-])c1 600536357 SGQAGRXKYQSDHT-SECBINFHSA-N 296.283 -0.508 5 20 CBBD Cn1nnnc1COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 733474917 NYFHBXZFVIDACH-UHFFFAOYSA-N 294.227 -0.977 5 20 CBBD C[C@H](N)CN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 861613217 DUSLFKQJTVTAOH-QMMMGPOBSA-N 270.293 -0.220 5 20 CBBD COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])cnc1N 862953329 LZNXIQQGMCHAIB-UHFFFAOYSA-N 298.255 -0.509 5 20 CBBD CC(=O)N1CCN(CCNc2c([N+](=O)[O-])cnn2C)CC1 891821559 KFHYGWDCUJHMBE-UHFFFAOYSA-N 296.331 -0.096 5 20 CBBD CC(=O)N1CCOC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 965245938 ICQQJPRJJMINOQ-NXEZZACHSA-N 283.284 -0.889 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1nccs1 998303529 YPYAELYUAYIVRC-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cc(F)c1=O)N1CCNCC1 1118199367 KPPUCVDZXIQYPE-UHFFFAOYSA-N 284.247 -0.673 5 20 CBBD COCCOCCNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767718 SCKDCEIGYNWNMO-GHMZBOCLSA-N 289.332 -0.590 5 20 CBBD C[C@@H](CS(C)(=O)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 1318448091 FDRXCBIWYGLRKD-ZETCQYMHSA-N 290.301 -0.659 5 20 CBBD C[C@H](CCO)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1346306921 PHEILLYOHZUWED-SECBINFHSA-N 283.284 -0.014 5 20 CBBD Cn1cc(CN2CCC[C@H](O)[C@@H]2C(=O)O)c([N+](=O)[O-])n1 1600952129 UGCMIJBLGGNHNE-DTWKUNHWSA-N 284.272 -0.262 5 20 CBBD O=C(N[C@H]1C[C@@H](C(=O)O)C1)c1n[nH]cc1[N+](=O)[O-] 1601572426 UZICINYZWQIUPK-SYDPRGILSA-N 254.202 -0.089 5 20 CBBD Cc1ccc(C(=O)NCC(=O)NCC(=O)O)cc1[N+](=O)[O-] 35097453 XHKXFAKUORHSEP-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@@H](CO)C1 51885012 DVXIAFOTHNMIQQ-SSDOTTSWSA-N 267.241 -0.263 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CN(C)CCO1 160621838 ZLZBDONREFTLQX-CBAPKCEASA-N 283.288 -0.233 5 20 CBBD CCc1[nH]nc(C(=O)N2CCN(C)C(=O)C2)c1[N+](=O)[O-] 172624186 OPMYINAUHYYYLX-UHFFFAOYSA-N 281.272 -0.206 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@](C)(O)CN(C)C 337457348 NQSWPRKNMOUYBC-GFCCVEGCSA-N 299.331 -0.471 5 20 CBBD COC(=O)[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 338450042 BGRGEIXCRRLXFF-MRVPVSSYSA-N 297.267 -0.318 5 20 CBBD O=C(O)Cn1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 345895322 CBHXJZOSBJTXFL-UHFFFAOYSA-N 294.227 -0.289 5 20 CBBD COC(=O)[C@H](C)CNC(=O)c1c([N+](=O)[O-])cnn1C 347163519 VVIVXCXPKQYKDW-ZCFIWIBFSA-N 270.245 -0.133 5 20 CBBD C[C@]1(C(=O)O)CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 347517657 MJYBXJJOVNUTQF-JTQLQIEISA-N 283.244 -0.491 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354056207 FLGMBFJYABJPJH-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD CCOC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 433357793 YZYSGZXVFONLQD-SNVBAGLBSA-N 299.283 -0.730 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN([C@H]2CCOC2)CC1 586796863 WEJJWWXRYQQTFI-VIFPVBQESA-N 295.299 -0.135 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)COc1cccc([N+](=O)[O-])c1 763704226 YVFHFBNFNATNNC-SNVBAGLBSA-N 297.267 -0.803 5 20 CBBD COC(=O)COC(=O)c1cc([N+](=O)[O-])cnc1N 779103493 CTAUDWMPSIPNIC-UHFFFAOYSA-N 255.186 -0.098 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 788179799 ZVHKUDRRZXKUCS-VIFPVBQESA-N 296.283 -0.678 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H]1CCC(=O)NC1=O 798606443 VXKPKJMHHCRZGU-ZETCQYMHSA-N 296.239 -0.552 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)c1cnn[nH]1 805606871 CDXLNEJHXLCACS-UHFFFAOYSA-N 252.190 -0.234 5 20 CBBD C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C(=O)O1 848073014 HXTKYOUAXIDHLV-UJURSFKZSA-N 254.202 -0.248 5 20 CBBD COC(=O)[C@@H]1CC[C@@H](C(=O)OC)CN1CC[N+](=O)[O-] 931176456 LDUFTEUWSGPIFX-BDAKNGLRSA-N 274.273 -0.310 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2cnns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022064081 VBSFHCZTAZWXAO-BKFJMODKSA-N 297.340 -0.060 5 20 CBBD NC(=O)c1ccnc(N2CC[C@H](O)C2)c1[N+](=O)[O-] 1261208265 MSZHJMOVRXXJJT-LURJTMIESA-N 252.230 -0.340 5 20 CBBD C[C@H](CCS(C)(=O)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1321426915 OEDGXDQYQPTVQM-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD CN(CC(N)=O)c1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1579021476 LNFLLGNILXJJIU-UHFFFAOYSA-N 278.232 -0.909 5 20 CBBD O=C(O)C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1601960201 XNZZRCFDJLCBRC-LURJTMIESA-N 284.228 -0.366 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])cn(CCN2CCOC2=O)c1=O 1602300194 AXBHLYINJIAGED-UHFFFAOYSA-N 297.223 -0.093 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC(F)(F)F 48771657 ZFNBSMSNKVTOPR-UHFFFAOYSA-N 253.140 -0.135 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCN1 188415105 AIEGGXKRUFRSLY-SECBINFHSA-N 280.284 -0.423 5 20 CBBD CC(C)C[C@@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 236639629 JRQNKMVYDSZLNI-QMMMGPOBSA-N 270.293 -0.324 5 20 CBBD CC(C)(C)[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 285284245 FWHNTRJTCBSXOG-SSDOTTSWSA-N 269.261 -0.052 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@@H](C)CO)c([N+](=O)[O-])n1 339040515 FAPPDNKDIQLRFS-SSDOTTSWSA-N 292.317 -0.282 5 20 CBBD Cc1ncc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)c(O)n1 345100267 DHUBLLGKMPZZJX-UHFFFAOYSA-N 292.255 -0.088 5 20 CBBD CC(CO)(CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 346460406 PRHOQIAWYIPLFB-UHFFFAOYSA-N 272.261 -0.959 5 20 CBBD CCCc1[nH]nc(C(=O)NCC(N)=O)c1[N+](=O)[O-] 346529111 SNSZCUDEDZUDMP-UHFFFAOYSA-N 255.234 -0.515 5 20 CBBD CCOC[C@@H](O)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 355759494 RNSOWWNIQXVLOW-LURJTMIESA-N 257.250 -0.802 5 20 CBBD COC[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 581539936 CZMDGGPOAPFWJH-QMMMGPOBSA-N 296.283 0.059 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(n2cncn2)C1 732760472 ZRZXTQSQSOBAKQ-UHFFFAOYSA-N 277.244 -0.534 5 20 CBBD C[C@@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)S(C)(=O)=O 748116126 LXMCRZHMAWULRR-ZETCQYMHSA-N 291.285 -0.232 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OCCN1CCNC1=O 808533519 PAPFPRHBDOLRCU-UHFFFAOYSA-N 295.255 -0.246 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1116892926 KWAHCPNDDDYRAT-LBPRGKRZSA-N 295.299 -0.074 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1N 1118270178 XCUCLIKIDWDLFC-IUCAKERBSA-N 282.304 -0.228 5 20 CBBD Cn1cnc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])n1 1325611349 SYNSHJJJFOCCCZ-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD NC(=O)c1ccnc(N2C[C@@H]3C[C@@]3(CO)C2)c1[N+](=O)[O-] 1327601139 LLYPHKBZSKGMQL-MADCSZMMSA-N 278.268 -0.093 5 20 CBBD O=C(CNc1ccnc(O)c1[N+](=O)[O-])NCCO 1327658126 FWGGGDSTFJFWOS-UHFFFAOYSA-N 256.218 -0.784 5 20 CBBD C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1nncn1C 1338859700 BIPSIQLCXNMALP-LURJTMIESA-N 279.260 -0.020 5 20 CBBD CN1CC[C@@H]1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1340178219 FBJYXFQQJJKMAU-SECBINFHSA-N 280.284 -0.423 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](N)C2)c1[N+](=O)[O-] 1345831579 XDKUPXDJSJZOGB-ZETCQYMHSA-N 253.262 -0.190 5 20 CBBD CNC(=O)[C@H](O)CNc1cc(C(=O)O)ccc1[N+](=O)[O-] 1598632905 USRZPRIVMQNSMS-SECBINFHSA-N 283.240 -0.188 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cc(O)ccc1[N+](=O)[O-] 1601523291 BVIOBTDMXWCJEJ-QMMMGPOBSA-N 270.197 -0.524 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCN(CCO)CC1 35186851 IQSQEHZJMYCQNS-UHFFFAOYSA-N 296.283 -0.967 5 20 CBBD Cc1c(CC(=O)NOCC(N)=O)cccc1[N+](=O)[O-] 89464614 OVVCNEFMDVSZNZ-UHFFFAOYSA-N 267.241 -0.021 5 20 CBBD COCCN(CC(F)F)C(=O)Cn1cnc([N+](=O)[O-])n1 158302801 GQKKKEZGPUEJKC-UHFFFAOYSA-N 293.230 -0.074 5 20 CBBD C[C@H](C[S@](C)=O)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 168871901 XHOUQTVUWXGGTF-KVHAEHDBSA-N 290.345 -0.491 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 189608536 NPZIZLIFECWEGZ-MNOVXSKESA-N 298.299 -0.210 5 20 CBBD Cn1ccc(CCNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 227227833 POVWJVFOKXVPBO-LBPRGKRZSA-N 294.315 -0.282 5 20 CBBD Nc1nc(NC[C@H]2CC[C@@H](CO)O2)ncc1[N+](=O)[O-] 292298640 AAJUAVIETFNOPX-RQJHMYQMSA-N 269.261 -0.081 5 20 CBBD CN1CCC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 331095632 LMALLLFPCGRUJB-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@](C)(O)CN(C)C)c1[N+](=O)[O-] 337447397 JBCGOUQWAGSEMD-LLVKDONJSA-N 285.304 -0.331 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCc1cnc[nH]1 360733968 DKHXPXACOGVORM-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CN(CC(N)=O)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 518782436 XLYHZFMRANYVCD-UHFFFAOYSA-N 281.224 -0.119 5 20 CBBD Nc1nccc(C(=O)N[C@H]2CCCNC2=O)c1[N+](=O)[O-] 568898326 DXBYITALFQABJG-ZETCQYMHSA-N 279.256 -0.420 5 20 CBBD O=C(O)c1cnc(N2CC[C@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 592972988 NPXIVZZVZGLDHC-XCBNKYQSSA-N 297.267 -0.133 5 20 CBBD CCCN1CC[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 598343050 RYZMGYWAGITRNU-SECBINFHSA-N 282.304 -0.213 5 20 CBBD CC[C@@H](O)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599329486 LYIKXTNGOJXQDQ-ZCFIWIBFSA-N 278.290 -0.623 5 20 CBBD COc1cc([N+](=O)[O-])cn(CC(=O)N2CCC2)c1=O 603360978 CMFYRKZZKGMAAT-UHFFFAOYSA-N 267.241 -0.003 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC(=O)N(CC2CC2)C1 619152424 BKKLBMARDYISTF-UHFFFAOYSA-N 294.271 -0.775 5 20 CBBD CC(=O)NCC(=O)OCCn1cc([N+](=O)[O-])cn1 764487468 PWDJKXIEQXPCMA-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NOCC(N)=O 785383186 CEHFYGYATNTXPQ-UHFFFAOYSA-N 296.239 -0.625 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@]1(F)CCNC1 831411784 IUDUOPGNEHLVPI-SNVBAGLBSA-N 271.252 -0.391 5 20 CBBD CS(=O)(=O)NCCC(=O)OCCC[N+](=O)[O-] 860917698 QYGLKASRFRTBJD-UHFFFAOYSA-N 254.264 -0.864 5 20 CBBD CC(C)(CCC(=O)NN1CCS(=O)(=O)CC1)[N+](=O)[O-] 862730929 ATXAEXGQZYOERK-UHFFFAOYSA-N 293.345 -0.417 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H](C)CN1 923362401 SMOJBSPALHTUBF-CKYFFXLPSA-N 283.332 -0.166 5 20 CBBD O=C(NC[C@H]1C[C@H](NCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1086363648 DXHSMKWTFNQGIO-ZYUZMQFOSA-N 257.290 -0.872 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1C[C@H](O)C[C@H]1CO 1116673494 VNMUQZYKUPLNHC-WCBMZHEXSA-N 284.272 -0.865 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1cccnn1 1116797697 JRNHCEOEOIXZCB-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD O=CN1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1327082087 XYIDAMNMFSZVLK-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD Nc1ccc(C(=O)N2C[C@@H](CO)[C@H](CO)C2)cc1[N+](=O)[O-] 1335328322 BMDWBIMFTMOSMT-UWVGGRQHSA-N 295.295 -0.150 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@]1(C)CNCCO1 1579877503 PYRRDJOKSRNVHB-LBPRGKRZSA-N 297.315 -0.406 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCNC[C@@H]1O 1580562410 RRZXPXRIIDIEGL-NEPJUHHUSA-N 295.295 -0.187 5 20 CBBD O=C1C[C@@H](Nc2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])CN1 1593383595 AFBUULFQSWFMMP-ZCFIWIBFSA-N 290.243 -0.530 5 20 CBBD O=[N+]([O-])c1cn(C[C@@H]2COCCO2)nc1-c1nn[nH]n1 1593486612 CJJUNCUCPRUWJY-ZCFIWIBFSA-N 281.232 -0.613 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@]1(C(=O)O)CCOC1 1608376859 IFBDZSAGMPLNRS-LLVKDONJSA-N 298.255 -0.601 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1C[C@H](O)CN1 238090626 BKHUZGBWWUCNBF-GXSJLCMTSA-N 294.311 -0.154 5 20 CBBD COCCNC(=O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 269278924 KKOPMWCWGPZNJH-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD O=C(N[C@@]1(CCO)CCOC1)c1cnc(O)c([N+](=O)[O-])c1 277981808 CAYDWONSENXHAT-LBPRGKRZSA-N 297.267 -0.033 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 336850307 WUOHDBGSMQSRRV-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD CCC[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(N)=O 343466648 YTQBIKZJAPQXDU-YFKPBYRVSA-N 255.234 -0.298 5 20 CBBD O=C1CC[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C(=O)N1 444969584 XCTJOQMECMHJGC-LURJTMIESA-N 294.223 -0.770 5 20 CBBD COC[C@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 570153384 SUACOFITWNZGRM-LLVKDONJSA-N 285.256 -0.177 5 20 CBBD CNC(=O)[C@@H](O)CNc1nc2sccn2c1[N+](=O)[O-] 757693952 WRLUGRJSXYYNON-YFKPBYRVSA-N 285.285 -0.177 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O 779675664 ZRUZNRMNDARKOH-MRVPVSSYSA-N 283.240 -0.470 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1ncc([N+](=O)[O-])c(N)n1 782400164 SYARVEVBTDUKQK-ZCFIWIBFSA-N 266.261 -0.366 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](N2CCOCC2)C1 854727734 BMGSVOONVGHNKA-IJLUTSLNSA-N 283.328 -0.025 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCOC1 1116793749 OIJRIGPJXVIPMM-QMMMGPOBSA-N 269.261 -0.271 5 20 CBBD Nc1nccc(C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1[N+](=O)[O-] 1118317051 IMRXWIYAKDIGGY-BRPSZJMVSA-N 278.268 -0.118 5 20 CBBD CN(C)C(=O)OCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1255165981 WQNMLCURASDQDK-UHFFFAOYSA-N 298.255 -0.446 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@H](CO)C1 1317917860 ULMMGINCPIQCOR-MRVPVSSYSA-N 269.261 -0.583 5 20 CBBD C[C@H](N)C1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1328479033 UYEXJWZDIRHTHM-QMMMGPOBSA-N 282.304 -0.228 5 20 CBBD O=C(N[C@H](CO)c1cnn[nH]1)c1cnc(O)c([N+](=O)[O-])c1 1577972999 PUORMADGSXFIDP-SSDOTTSWSA-N 294.227 -0.723 5 20 CBBD O=C(O)CNC(=O)CNC(=O)c1c(F)cccc1[N+](=O)[O-] 1608753247 SXQWQCADGFKDNX-UHFFFAOYSA-N 299.214 -0.336 5 20 CBBD CO[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[C@H]1C(=O)O 1777176944 IQPXFGHXGLIALX-HTRCEHHLSA-N 297.271 -0.107 5 20 CBBD NC(=O)c1ccc(N2CCO[C@H](C(=O)O)C2)c([N+](=O)[O-])c1 43703173 CWFXPDMNBCISAE-JTQLQIEISA-N 295.251 -0.017 5 20 CBBD C[C@H](CC(=O)O)NC(=O)Cn1ccc([N+](=O)[O-])n1 50469669 LZSBYARSSHVMLO-ZCFIWIBFSA-N 256.218 -0.229 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CN(CCO)CCO)c1 62351212 FQEMGCHNAGYCOB-LBPRGKRZSA-N 270.285 -0.085 5 20 CBBD CCNC(=O)C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 176103319 TVRHHRMCVSPAOR-UHFFFAOYSA-N 281.272 -0.614 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])o1 227043489 IJEALNLJRUINFL-YFKPBYRVSA-N 258.186 -0.549 5 20 CBBD CNC(=O)C1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 277980703 GADJNJLCBTXOCY-UHFFFAOYSA-N 280.240 -0.487 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 298291516 FSDVUZWFXFIIDC-SSDOTTSWSA-N 285.260 -0.348 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](CO)O1 302785463 VFHUDOMCKMINLT-NKWVEPMBSA-N 269.261 -0.447 5 20 CBBD CN(C)CC[C@@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 352119218 CTUHLPMZTBNEKS-LLVKDONJSA-N 285.304 -0.250 5 20 CBBD O=C(N[C@H](CO)[C@H]1CCCO1)c1cc([N+](=O)[O-])n[nH]1 355459079 SVWSYQDZKAEXCY-HTQZYQBOSA-N 270.245 -0.412 5 20 CBBD CN1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1 357101234 GXQUUAXJDVEZER-UHFFFAOYSA-N 265.273 -0.160 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@@H]3CNC[C@@H]3C2)c1 359276038 LRPYBUMXQAPDBD-AOOOYVTPSA-N 251.290 -0.058 5 20 CBBD CN(C[C@@H]1COCCO1)c1nccc(C(N)=O)c1[N+](=O)[O-] 596457314 MBWNQBYRZIDVON-MRVPVSSYSA-N 296.283 -0.060 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCC1=O 598294277 QJHGBKFVNCVGTP-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD Nc1c([N+](=O)[O-])ccc(N2C[C@H](O)[C@@H](O)C2)c1F 599129085 YCKRVXLSVGGHIM-YUMQZZPRSA-N 257.221 -0.142 5 20 CBBD CCn1nncc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 600157455 VYYFWGOWCIZGOJ-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCc1cnn[nH]1 735143304 YXHUHAUNGVXROM-UHFFFAOYSA-N 266.217 -0.305 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CCC1=O 855916317 QGEYYZKZXSRACZ-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD O=C(NC1CN(C(=O)c2cccnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991293408 MZJOCLJEAYPCNO-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD C[C@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1 1332333462 BOMYZADHLUSODA-ONGXEEELSA-N 269.305 -0.554 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1(CO)CCOCC1 1337414780 SNYMBPIGWYYJEC-UHFFFAOYSA-N 298.299 -0.161 5 20 CBBD CC(C)NC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 28441324 IFRDQCPSQWBCAS-UHFFFAOYSA-N 269.261 -0.568 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC2CCOCC2)c1 37893159 OXPCCHFVRGRKMR-NSHDSACASA-N 270.289 -0.079 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCn2ccnc2)c1 49076860 SSIYMKOQVORSCR-LLVKDONJSA-N 280.288 -0.362 5 20 CBBD CC(C)NC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 51716046 FRUWTVUAQJOSCG-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD C[C@H](CCO)CNC(=O)Cn1cc([N+](=O)[O-])cn1 97443008 JDLYLFUJZZNHDN-MRVPVSSYSA-N 256.262 -0.074 5 20 CBBD CCN1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174646091 SGSIOASESQLBHR-GFCCVEGCSA-N 283.332 -0.210 5 20 CBBD Cc1c(C(=O)NCC(=O)NCCO)cccc1[N+](=O)[O-] 343107989 XBWCWRLOSINXCG-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 358373557 CWNBXYXJJCCZGB-LLVKDONJSA-N 285.256 -0.033 5 20 CBBD O=C1CN(CCCN=c2cc[nH]cc2[N+](=O)[O-])CCN1 361059227 RHWVALZZZPNRHA-UHFFFAOYSA-N 279.300 -0.355 5 20 CBBD C[C@]1(C(N)=O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361558174 VAXNRHASEZXPSG-PWSUYJOCSA-N 297.315 -0.651 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)COc1ccccc1[N+](=O)[O-] 387407546 BZASCLGFDRHIJE-RKDXNWHRSA-N 284.268 -0.169 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 425094099 UCDBZSZAOAFWPC-ZETCQYMHSA-N 280.240 -0.200 5 20 CBBD CCOC[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 433357792 YZYSGZXVFONLQD-JTQLQIEISA-N 299.283 -0.730 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@@H](C)O 442924868 ZHKKIBCOKZIVJO-MUWHJKNJSA-N 285.256 -0.415 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC(CO)CO 490170155 PQGIYPMLGLKUTQ-UHFFFAOYSA-N 297.267 -0.689 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](CO)OC[C@H]2C)c1[N+](=O)[O-] 494681768 MILJGHMVXWVYGB-SVRRBLITSA-N 284.272 -0.152 5 20 CBBD O=C(NCCN1CCCOCC1)c1c[nH]nc1[N+](=O)[O-] 559032465 MWHCOACTIOGWMG-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CC(=O)NC1=O 563742468 VDSUVSNARSGNAJ-QMMMGPOBSA-N 294.267 -0.190 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 588864453 JIFMVTNOHPERMR-VIFPVBQESA-N 283.284 -0.047 5 20 CBBD NC(=O)COC(=O)c1cc([N+](=O)[O-])c(F)cc1N 758080428 WEVNBDNJJNSAQX-UHFFFAOYSA-N 257.177 -0.042 5 20 CBBD O=C(Cn1cnnn1)NCCNc1ncccc1[N+](=O)[O-] 1093505692 VAPITVMCPGVVHI-UHFFFAOYSA-N 292.259 -0.795 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCN1CCNCC1 1261459756 AVZDLFMSUMPIQG-UHFFFAOYSA-N 296.331 -0.647 5 20 CBBD CN1CCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1322846439 RTLMIQWGBWWEDS-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)c1cncnc1 1516765356 ASWWHAXHCLYGIK-UHFFFAOYSA-N 264.201 -0.167 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@H](CN)C1 1579868290 CVTRJJQCWJLEIL-KYZUINATSA-N 267.289 -0.047 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCNC[C@@H]1CO 1580876722 QRSYITFTZBHWFH-LLVKDONJSA-N 282.300 -0.977 5 20 CBBD CO[C@@H](C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1593908219 FRPCKHBQZXGWMI-SSDOTTSWSA-N 272.217 -0.993 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CCO1 1601846857 XIMDXJXGIXLEAB-MRVPVSSYSA-N 297.223 -0.379 5 20 CBBD CCOCCNC(=O)Cn1cccc([N+](=O)[O-])c1=O 84646969 DEWSTWGVVVSOHY-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD CC(=O)NC[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 172170403 QFIGFTMFPYBUTA-NSHDSACASA-N 283.288 -0.414 5 20 CBBD Cn1nnnc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 348276052 NAYXMCYIFWFRSZ-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CN1CC[C@H](Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)C1 352910511 DQGNKGVCJVSUSQ-QMMMGPOBSA-N 280.284 -0.193 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1cc([N+](=O)[O-])c[nH]1 353766135 JFYZTASLLOCQQG-UHFFFAOYSA-N 252.190 -0.323 5 20 CBBD C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])C(N)=O 354347431 DZQKJIHGUCCVGM-YFKPBYRVSA-N 252.230 -0.219 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 359492578 NWLAUCHKVMJNCZ-LURJTMIESA-N 267.245 -0.711 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](O)[C@H](CO)C2)n1 396812936 QSYXDWXGYLHESU-OIBJUYFYSA-N 297.267 -0.133 5 20 CBBD CC(=O)N1CC(Nc2ncc([N+](=O)[O-])c(N)n2)C1 566483278 TVGMFOJCQVDGRL-UHFFFAOYSA-N 252.234 -0.390 5 20 CBBD NC(=O)[C@H](CO)Nc1ncnc2ccc([N+](=O)[O-])cc12 588068365 KDLPDMVVKRHYHY-VIFPVBQESA-N 277.240 -0.204 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 588863773 KQXACLGOBMCGOR-MRVPVSSYSA-N 282.300 -0.171 5 20 CBBD C[C@@H](N)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 592985013 ZXYQPJFOASHJDQ-KOLCDFICSA-N 269.305 -0.161 5 20 CBBD Nc1ccc(N2C[C@@H](O)C[C@H]2CO)nc1[N+](=O)[O-] 596178830 LRSZSKVDNXIPNJ-BQBZGAKWSA-N 254.246 -0.496 5 20 CBBD C[C@H](O)[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 598237054 SVBGUOHFRVQMIP-JGVFFNPUSA-N 269.261 -0.442 5 20 CBBD C[C@@H](O)[C@@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 843062552 PSICPGRAZMAHIK-GGZOMVNGSA-N 270.285 -0.041 5 20 CBBD CO[C@@](C)(C(=O)O)C(=O)OCCn1ccc([N+](=O)[O-])n1 1593932994 CKTAAJRTWLIZQH-JTQLQIEISA-N 287.228 -0.176 5 20 CBBD O=C(O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 1608730615 GOMYGHHYQQUCTM-UHFFFAOYSA-N 255.186 -0.100 5 20 CBBD NC(=O)[C@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CCO1 1610637128 XDHWRHMLKPDETK-MRVPVSSYSA-N 296.239 -0.622 5 20 CBBD COc1ccc(S(=O)(=O)NCCN)cc1[N+](=O)[O-] 19231435 NKIWWDHGLVGYNM-UHFFFAOYSA-N 275.286 -0.160 5 20 CBBD CNC(=O)Cn1cc([N+](=O)[O-])cc(C(=O)OC)c1=O 25592807 FCYNMJBGFYEYAV-UHFFFAOYSA-N 269.213 -0.711 5 20 CBBD C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 50418262 JTDRYWUTPHKJOV-SCZZXKLOSA-N 295.303 -0.369 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCS(=O)CC2)c1 174847243 COKUOVDGUCXGPX-UHFFFAOYSA-N 258.303 -0.144 5 20 CBBD COC(=O)[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C1CC1 270856309 YSOYZSNTAKGBNI-SSDOTTSWSA-N 268.229 -0.001 5 20 CBBD CC(C)[C@@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 292531804 RGKVJIUYUFWUCH-SECBINFHSA-N 255.278 -0.109 5 20 CBBD NC(=O)N1CCC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 301412726 ACUYDAOZUPKMNL-ZCFIWIBFSA-N 281.276 -0.078 5 20 CBBD O=[N+]([O-])c1cnn(CCNC2(CO)CCOCC2)c1 330970347 CGGJSPOTHYVSTN-UHFFFAOYSA-N 270.289 -0.078 5 20 CBBD C[C@@H]1CN(C)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 331256445 WKMZPVSXSYSIOG-PWSUYJOCSA-N 283.332 -0.212 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(=O)N(C)C2)c1[N+](=O)[O-] 332600824 ASNDPIOVNBEJPT-UHFFFAOYSA-N 267.245 -0.248 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 352752109 ITDBSQYXUZRHBI-LURJTMIESA-N 269.261 -0.167 5 20 CBBD CSc1n[nH]c(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 354757339 ANLUADCKBZWUOO-UHFFFAOYSA-N 284.261 -0.335 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354821292 MSSYIXFEMMILSY-LURJTMIESA-N 267.245 -0.379 5 20 CBBD O=C(NC[C@@H]1COCCO1)c1cnc(O)c([N+](=O)[O-])c1 445172118 JOWDYPOQGUYKDK-MRVPVSSYSA-N 283.240 -0.159 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](O)C(F)F)c1[N+](=O)[O-] 568778045 LQDRYMHHRUHVGM-ZCFIWIBFSA-N 290.226 0.387 5 20 CBBD C[C@@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600653052 ZANITNMNZXNJQS-SCSAIBSYSA-N 278.246 -0.920 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCNC[C@@H]1O 710425551 ZXGXVILSABKBCA-SCZZXKLOSA-N 268.273 -0.614 5 20 CBBD Cn1nncc1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 798794503 BWQWOAPUCJPMGL-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD C[C@H](CC(N)=O)Nc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 820232127 DRGTZXNETOTEHE-RXMQYKEDSA-N 292.259 -0.154 5 20 CBBD C[C@]1(C2CC2)NC(=O)N(CC(=O)OCCC[N+](=O)[O-])C1=O 860913568 FPWRETVJZNXQTK-GFCCVEGCSA-N 299.283 -0.083 5 20 CBBD CC(=O)N1[C@H]2CC[C@H]1CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 967691883 RGXZZGMZZFVJNS-UKKRHICBSA-N 267.285 -0.127 5 20 CBBD CC(C)C(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001795253 DEUKMHGYZDIZCU-NXEZZACHSA-N 269.301 -0.118 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CN(CCCO)C[C@@H]2C1 1048812300 FRJALZRAJMKKRY-WRWGMCAJSA-N 283.328 -0.576 5 20 CBBD CCn1nncc1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 1118898143 UMLNJPIRISKXFT-NSHDSACASA-N 295.303 -0.447 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1319063305 XLQUDYYTFVNMLK-SSDOTTSWSA-N 282.256 -0.993 5 20 CBBD O=C1NCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 1350934586 DAUFCDGIAQXVPO-MRVPVSSYSA-N 267.245 -0.956 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CN2CCC1CC2 1514747974 KXBVOQCTYIRAOC-VIFPVBQESA-N 280.288 -0.603 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC[C@](C)(O)C(=O)O)n1 1597899570 MBJYHWKXQAEFDG-JTQLQIEISA-N 286.244 -0.623 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-] 1601910267 HKELKLNQJLCPRU-SSDOTTSWSA-N 284.224 -0.134 5 20 CBBD COC[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1606808794 COVFULUBKDGOBN-QMMMGPOBSA-N 286.244 -0.603 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCC(=O)N1CCCC1 65772627 YRCNZAULVVRCKS-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD COCCCNC(=O)CN(C)CCn1cc([N+](=O)[O-])cn1 157820895 LJUHMBVTZAOKKS-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD CCN(CC)C(=O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 228808336 BHIXNIRFIZSGQZ-NSHDSACASA-N 299.331 -0.390 5 20 CBBD C[C@@H](O)CN(CCn1ccc([N+](=O)[O-])n1)[C@H](C)CO 248957758 QMSURNZKPXZMGW-NXEZZACHSA-N 272.305 -0.145 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 279058553 BIWPTQPWIURNIN-CABZTGNLSA-N 298.299 -0.163 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H]2CNC[C@@H]2C1 290073556 IJYSUAOJNZQNQO-VHSXEESVSA-N 279.300 -0.141 5 20 CBBD O=C(N[C@]1(CO)CCOC1)c1cc([N+](=O)[O-])c[nH]1 330849972 LFDSPQDMGRXMHI-JTQLQIEISA-N 255.230 -0.196 5 20 CBBD NC(=O)[C@@H](CO)Nc1ncc(Cl)cc1[N+](=O)[O-] 343264094 JOWNQDWHBMAOTA-RXMQYKEDSA-N 260.637 -0.099 5 20 CBBD C[C@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])cnc1N 350095748 JNZWTVUYCVYWOY-SSDOTTSWSA-N 291.271 -0.018 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 350462777 QPURYVZORDGYSV-ZCFIWIBFSA-N 279.256 -0.468 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1ccc([N+](=O)[O-])c(O)c1 354157469 GLOCLYOICYFFSH-MRVPVSSYSA-N 270.241 -0.274 5 20 CBBD Cn1nnc(CNC(=O)c2ccc([N+](=O)[O-])n2C)n1 362953353 YVPMEJKHURAKIA-UHFFFAOYSA-N 265.233 -0.613 5 20 CBBD Cn1ccnc(NC(=O)c2ccc([N+](=O)[O-])o2)c1=O 444098019 OXHXDOHLIBZMOI-UHFFFAOYSA-N 264.197 0.534 5 20 CBBD CCO[C@H]1C[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 515033904 AYHFWXBPTYZFRE-RQJHMYQMSA-N 255.234 -0.520 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCO)c1 551974667 WFAKGVHMBPIDSU-JTQLQIEISA-N 256.258 -0.084 5 20 CBBD CN1C(=O)CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1=O 568606572 NGXXOHCQGZUHJA-UHFFFAOYSA-N 292.251 -0.382 5 20 CBBD O=[N+]([O-])c1cnn(CCNC[C@H](O)CN2CCCC2)c1 600727785 MLRPACCGCJCHKP-LBPRGKRZSA-N 283.332 -0.162 5 20 CBBD NC(=O)[C@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 611153069 JGBOFOMFTHMHOZ-ZETCQYMHSA-N 276.256 -0.051 5 20 CBBD CS(=O)(=O)CCCOC(=O)Cn1cc([N+](=O)[O-])cn1 728619335 GXXKDKOAOZPNIW-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 779540452 GUEUEMNNQHTWPP-UHFFFAOYSA-N 267.201 -0.538 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NOCC(C)(C)O 791262797 GIDVYUVHOKYCGS-UHFFFAOYSA-N 258.234 -0.239 5 20 CBBD C[C@@H]1NCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1C 923344758 IIYNARTXNAMHSO-JBLDHEPKSA-N 283.332 -0.166 5 20 CBBD O=C(NCC1(O)CN(C(=O)C2CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1042976606 LDLGAKNJRCSIGL-NXEZZACHSA-N 297.311 -0.859 5 20 CBBD COCC(=O)N[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 1096982611 OYIXKROIMISACD-LJGSYFOKSA-N 296.287 -0.328 5 20 CBBD CC(=O)N1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1 1117647259 LAOKJEWWKVKSQU-UHFFFAOYSA-N 293.283 -0.243 5 20 CBBD CS(=O)(=O)N1CC[C@@H](CNCC[N+](=O)[O-])C1 1336304114 TXEGTZVXTPLAPD-QMMMGPOBSA-N 251.308 -0.866 5 20 CBBD Cc1nn(C)c(C(=O)N(C)C2[C@H]3CNC[C@H]23)c1[N+](=O)[O-] 1342027012 KHCZOYVIDXIFDX-YUMQZZPRSA-N 279.300 -0.073 5 20 CBBD NC(=O)c1ccnc(N2CCOC[C@@H]2CCO)c1[N+](=O)[O-] 1343058862 VLZMJPWBRVXLFA-QMMMGPOBSA-N 296.283 -0.324 5 20 CBBD O=C(NC[C@@H](C(=O)O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 1601457334 SQHZRUYJARHESI-RNFRBKRXSA-N 298.255 -0.215 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCS(=O)(=O)CC2)c1 174844021 OWOPNGNAEXYJRT-UHFFFAOYSA-N 274.302 -0.478 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCN 237621418 RBVZTOFYBWRQKK-QMMMGPOBSA-N 280.284 -0.212 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCCC[C@H]2CO)c1 247450799 HLLCNTBHELPHFV-JQWIXIFHSA-N 284.316 -0.001 5 20 CBBD CN(CCC(=O)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262535904 QHAYHKMWWBFWES-UHFFFAOYSA-N 283.240 -0.310 5 20 CBBD CN1C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC1=O 290467343 ACCYDVFLIXYDRU-ZCFIWIBFSA-N 279.256 -0.269 5 20 CBBD CNC(=O)c1c(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n[nH]c1C 357655467 PVMFVDSKIOXFAT-UHFFFAOYSA-N 293.243 -0.039 5 20 CBBD CN1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 438796718 XHAHHXKNSSGKJJ-LBPRGKRZSA-N 283.332 -0.210 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])s2)C1 443511393 QGCYAYHKKZNGNL-YFKPBYRVSA-N 278.315 -0.082 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 524695833 BACUEXDKVWCKQW-UHFFFAOYSA-N 284.272 -0.574 5 20 CBBD C[C@]1(CO)CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 546103498 CQLVOSLTFGABDJ-NWDGAFQWSA-N 284.316 -0.001 5 20 CBBD CNC(=O)CCCN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 563526676 AUMWXXJWZIXRKC-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)CCOC1 571775854 KDFFMIVAMPNZNO-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD C[C@H](N)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 592475520 LWIYOCAHBALZFA-UWVGGRQHSA-N 269.305 -0.161 5 20 CBBD CN(C)CCN(CC(=O)N(C)C)c1ncc([N+](=O)[O-])cn1 596462698 NWCMQJPVAPMYAY-UHFFFAOYSA-N 296.331 -0.159 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)OCCC(N)=O 759560369 UCEOVAWLXFBVGZ-UHFFFAOYSA-N 270.245 -0.092 5 20 CBBD NC(=O)CONC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 833761625 MYYMHSGMIZZDKV-UHFFFAOYSA-N 283.196 -0.560 5 20 CBBD CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1OC 839724766 CSHPZMLPAYNRSM-IGORNWKESA-N 258.274 -0.040 5 20 CBBD CNC(=O)[C@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 843112166 WUDZHCMTUYLVLN-GHMZBOCLSA-N 283.284 -0.675 5 20 CBBD C[C@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCOC1=O 1117664055 ZFOWSWIYXMPZHO-VIFPVBQESA-N 269.217 -0.992 5 20 CBBD Cn1nncc1C(=O)OCCn1cnc([N+](=O)[O-])n1 1263382254 RANOBEOFHRBCFD-UHFFFAOYSA-N 267.205 -0.828 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCSC1=O 1318840381 OBHSSHSAFMFGKX-YFKPBYRVSA-N 271.258 -0.665 5 20 CBBD NC(=O)CN1CCCN(c2ccnc(O)c2[N+](=O)[O-])CC1 1330619966 AQHXZEZWJFKBOI-UHFFFAOYSA-N 295.299 -0.307 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCO[C@H]([C@H]2CCCO2)C1 1339667952 VEPBBBBGDJUWGM-ZJUUUORDSA-N 297.315 -0.024 5 20 CBBD O=C(NC[C@H](O)CN1CCCC1=O)c1ccc([N+](=O)[O-])[nH]1 1340752298 WGTVIWVXSXUUIO-QMMMGPOBSA-N 296.283 -0.364 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN(C)C(=O)[C@H]1C 1340867072 QPOIDUPQOFCCQX-MRVPVSSYSA-N 282.304 -0.258 5 20 CBBD CC(=O)NC[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 1341370969 RZWKQDVZZTVFKJ-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD O=C(Nc1n[nH]cc1-c1nn[nH]n1)[C@@H]1C[C@H]1[N+](=O)[O-] 1593197026 DCUREMJVSNNRIZ-NQXXGFSBSA-N 264.205 -0.807 5 20 CBBD NC(=O)c1cc(N2CC[C@](O)(C(=O)O)C2)ccc1[N+](=O)[O-] 1601161817 NHYSEFIGIPJNSB-GFCCVEGCSA-N 295.251 -0.281 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 217714763 XEQXQSHYZXWLCZ-SECBINFHSA-N 298.251 -0.133 5 20 CBBD CC(C)(C(=O)N[C@@H]1CNC(=O)C1)n1cc([N+](=O)[O-])cn1 330895269 RTGQKCDPVKRIRB-ZETCQYMHSA-N 281.272 -0.469 5 20 CBBD C[C@H](NC(=O)COc1cccnc1[N+](=O)[O-])C(=O)N(C)C 339353367 VIEXYEITFIWTSN-QMMMGPOBSA-N 296.283 -0.039 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)OC 347856546 APYPBSRAVUWDNN-MRVPVSSYSA-N 298.255 -0.510 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@@H](O)C[C@@H]1CO 370329023 YJGKOJNTYXWYNO-MNOVXSKESA-N 296.279 -0.072 5 20 CBBD CC1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CNC1 423895175 FQVFEUWPYMYOPJ-UHFFFAOYSA-N 253.262 -0.483 5 20 CBBD C[C@H](CN)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 598914412 CNJSNLFABHRCHB-SSDOTTSWSA-N 266.257 -0.003 5 20 CBBD O=C(NC(CO)CO)c1n[nH]c2ccc([N+](=O)[O-])cc12 611288089 LJZSLAUTBGZKRZ-UHFFFAOYSA-N 280.240 -0.446 5 20 CBBD CC[C@H](OC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 727002758 UAFGNYYFAUDJJF-ZETCQYMHSA-N 270.245 -0.093 5 20 CBBD COCCS(=O)(=O)NNc1ncccc1[N+](=O)[O-] 759170111 ZTCXDQZHVHOGKA-UHFFFAOYSA-N 276.274 -0.118 5 20 CBBD NC(=O)c1cccnc1N1CCN(CC[N+](=O)[O-])CC1 798197717 UBRVONWPAKVNNN-UHFFFAOYSA-N 279.300 -0.421 5 20 CBBD COC(=O)c1ccnc(NCCn2cnnn2)c1[N+](=O)[O-] 856768690 ZOTUFLZUTAPTNG-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CN(C)CCN1C 896536100 VGPCPSHTCSGTNA-LNFKQOIKSA-N 270.333 -0.598 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ncc(C)cc1[N+](=O)[O-] 1100706271 XFEOZJJAGKYORU-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD CN(CC1CC1)C(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932148 JJOREVFFUHZHQB-GHMZBOCLSA-N 298.343 -0.774 5 20 CBBD O=C(CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NC1CCCC1 1126936981 ZSAAOLVZTPWGHA-GHMZBOCLSA-N 298.343 -0.584 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1326360185 YVFLUFNDORDNRZ-HTRCEHHLSA-N 270.245 -0.528 5 20 CBBD Cn1c(C(=O)N2CCC[C@@H](O)[C@H]2C(=O)O)ccc1[N+](=O)[O-] 1600899003 COTQLZXMOUMDGS-SCZZXKLOSA-N 297.267 -0.017 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@@H](C(=O)O)C1 1608455912 IWHVLIPAAHFZLZ-OCAPTIKFSA-N 297.271 -0.046 5 20 CBBD O=C(O)[C@@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1610801489 ZRZNMDGRBFIYOK-ZJUUUORDSA-N 270.241 -0.337 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])c1)NC(=O)NC1CC1 29211614 FOGZNZPZUCQIAB-UHFFFAOYSA-N 253.218 -0.221 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 50703072 PNOTYIFSGOLPNQ-RXMQYKEDSA-N 252.230 -0.219 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)CC1 68467433 KRGPCCJTCMWCJG-UHFFFAOYSA-N 267.289 -0.126 5 20 CBBD CNCCN(C)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 70304494 KWDQUWJWGBTPOR-UHFFFAOYSA-N 288.329 -0.102 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 110517571 PCNHUPPPTLBZSD-LURJTMIESA-N 252.230 -0.117 5 20 CBBD O=C(NCCO)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 153905636 WOSUJQBRASOSRJ-UHFFFAOYSA-N 277.240 -0.102 5 20 CBBD Cn1c(C(=O)N2CCO[C@@H](CN)C2)ccc1[N+](=O)[O-] 165595984 JRNHUILCBARUEV-QMMMGPOBSA-N 268.273 -0.267 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@H]1CC[C@@H](C(N)=O)O1 268317385 LVAVMOUEFZSSIL-RQJHMYQMSA-N 269.261 -0.227 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@]1(O)CCOC1 269932368 DBCMYOZZWMOINJ-LLVKDONJSA-N 282.256 -0.348 5 20 CBBD CNC(=O)NCCC(=O)NCCn1cc([N+](=O)[O-])cn1 343169170 RNHIBLXWGYLJKQ-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C(N)=O 356475047 GUABXWGIKIGETR-ZETCQYMHSA-N 281.272 -0.192 5 20 CBBD CNc1nccc(C(=O)NCCCCO)c1[N+](=O)[O-] 553239788 WXANWXNEQDYOQT-UHFFFAOYSA-N 268.273 0.534 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CNCCCO1 568629597 JJPFJMYSSGSFTN-NSHDSACASA-N 297.315 -0.324 5 20 CBBD Cc1c(CNC(=O)C(=O)NC2CNC2)cccc1[N+](=O)[O-] 570551368 VDAFVTZZYWMYQR-UHFFFAOYSA-N 292.295 -0.393 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1O 579709873 MCTUMOLXQQDTKM-VIFPVBQESA-N 295.299 -0.671 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 588865170 XMSSTLLEFCDXLJ-MRVPVSSYSA-N 283.284 -0.047 5 20 CBBD COC(=O)[C@H]1CNCCCN1CCn1ccc([N+](=O)[O-])n1 592489374 RPFFIGVKTHMCBP-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1N 595229105 RHZLMRJZBZLJHN-SCZZXKLOSA-N 267.289 -0.013 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCOC1 597721045 JZWVICKIIODWSV-UHFFFAOYSA-N 253.214 -0.427 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@H](O)[C@@H](O)C2)c1 599531627 GYSZQRJPRHLYAU-RYUDHWBXSA-N 296.279 -0.081 5 20 CBBD CCS(=O)(=O)CCN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 801637786 JAUFLRALXGTWRT-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD C[C@H](O)CN(C)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820479699 BCHQILZZYNKJQX-LURJTMIESA-N 279.260 -0.013 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 839796806 IGZHIZSXIVIGFI-LHLIQPBNSA-N 299.239 -0.026 5 20 CBBD O=C(NS(=O)(=O)CC(F)F)[C@@H]1C[C@H]1[N+](=O)[O-] 851363515 CRNYNNUFMWCZSW-QWWZWVQMSA-N 258.202 -0.637 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(C)=O)C1 967950180 ONAQVCRAJHZLQQ-NXEZZACHSA-N 255.274 -0.269 5 20 CBBD O=C(NC1CN(C(=O)CN2CCCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991289457 FOKAKZHIMKTZEO-GHMZBOCLSA-N 296.327 -0.926 5 20 CBBD Cc1nnc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1157767446 NCABEIOJRXPTHY-RKDXNWHRSA-N 283.288 -0.361 5 20 CBBD CC(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 1329555427 SKXBHUUADSYZRM-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN[C@H]2C[C@H]21 1579877705 ZQMSGKUFFAYNJE-DTWKUNHWSA-N 265.273 -0.328 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN[C@H]3C[C@H]32)nc1 1580876074 ZSVLWUOPANIHGD-DTWKUNHWSA-N 284.297 -0.275 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 1601909412 FCXFQSOAGLBKKJ-QMMMGPOBSA-N 286.244 -0.867 5 20 CBBD COC(=O)[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 112671321 YYNSKIKNMXPDIE-SSDOTTSWSA-N 270.245 -0.294 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1ccc(F)cc1[N+](=O)[O-] 136284100 OVBLRYOCDCIIDM-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD O=C(NCCn1cccn1)NCCn1cc([N+](=O)[O-])cn1 151282492 RKABYQACRBTTKD-UHFFFAOYSA-N 293.287 -0.013 5 20 CBBD CNC(=O)CN(C)c1ncc(C(=O)O)cc1[N+](=O)[O-] 162357599 HTWCFNUFOISZFO-UHFFFAOYSA-N 268.229 -0.130 5 20 CBBD NC(=O)CCNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 173033151 YAUCKHDLUIUEHW-UHFFFAOYSA-N 287.297 -0.110 5 20 CBBD CCN(C)C(=O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 184953353 ZIQUPNWJMXFZMH-UHFFFAOYSA-N 298.303 -0.431 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@H](O)C2)c1 304289840 BYJJXERTCMSEHA-VHSXEESVSA-N 256.262 -0.781 5 20 CBBD NC(=O)C1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCCC1 336969475 NSEYIDSRZCVHSN-UHFFFAOYSA-N 296.287 -0.509 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C(N)=O)C(C)C 337141873 WFAKMIHNKVGGGR-SNVBAGLBSA-N 283.288 -0.274 5 20 CBBD Nc1nc(N2CC[C@@](F)(CO)C2)ncc1[N+](=O)[O-] 338415584 BHHFDXGBLQITJF-VIFPVBQESA-N 257.225 -0.122 5 20 CBBD NC(=O)CCn1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 344415669 HHFSUQOHBXQJAM-UHFFFAOYSA-N 292.255 0.247 5 20 CBBD COC(=O)[C@H](O)CNC(=O)CNc1ccccc1[N+](=O)[O-] 352535458 QUEYSNADAWGIAO-SNVBAGLBSA-N 297.267 -0.343 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CNC(=O)C1 541709710 KMOXGGPKWGCBQN-ZCFIWIBFSA-N 252.230 -0.448 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@H](CO)[C@@H](O)C1 545282201 OZBAJGLZFCTLRJ-APPZFPTMSA-N 269.257 -0.262 5 20 CBBD Nc1nc(N2CCO[C@H](C(=O)O)C2)ncc1[N+](=O)[O-] 572845133 DSJPDFHEMWJKMI-LURJTMIESA-N 269.217 -0.743 5 20 CBBD O=C1CCC[C@H](CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)N1 591763891 PVKQYONFNAFERJ-MWLCHTKSSA-N 297.315 -0.590 5 20 CBBD COC(=O)C1(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 848765815 HXAQOOGYVVQLGP-RNFRBKRXSA-N 271.225 -0.283 5 20 CBBD Cn1cc(C(=O)OCC(C)(C)[N+](=O)[O-])c(=O)n(C)c1=O 851126563 PEFHLWOVELACOB-UHFFFAOYSA-N 285.256 -0.704 5 20 CBBD CON1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1 854859074 YHESROBXGQBOSK-UHFFFAOYSA-N 281.272 -0.109 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)Cn1cc([N+](=O)[O-])cn1)C2 861871987 DTOCDHWPJJCXHH-JGVFFNPUSA-N 266.213 -0.682 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NN1CCOC1=O 862700094 PIISGKCWNKCFQL-UHFFFAOYSA-N 269.217 -0.417 5 20 CBBD O=C(NC1CN(C(=O)C(F)F)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991293520 BHFASSSGOSOOPS-PHDIDXHHSA-N 263.200 -0.756 5 20 CBBD COC[C@H](CCO)NC(=O)c1c([N+](=O)[O-])cnn1C 1319886815 CXIFMTMOZTYDKJ-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC[C@@H]1C1OCCO1 1350597754 HMGAUMRRTMZLLQ-MRVPVSSYSA-N 283.288 -0.067 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCNC1 1351550549 GNHNPLOYTVFMGZ-SNVBAGLBSA-N 292.295 -0.311 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CNC[C@H]2O)n1 1579642690 QQTCRZSTVIOGHF-NXEZZACHSA-N 266.257 -0.639 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@]1(C)CNCCO1 1579869194 UPRPDLRVGAOASB-GFCCVEGCSA-N 297.315 -0.406 5 20 CBBD Nc1ccn([C@H]2CCN(CC(=O)O)C2=O)c(=O)c1[N+](=O)[O-] 1594666287 HQENYFMHQWPYQB-ZETCQYMHSA-N 296.239 -0.803 5 20 CBBD O=C(O)[C@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1608646281 JYKLXBNVSPCJAE-SSDOTTSWSA-N 283.244 -0.793 5 20 CBBD O=C(NCCn1ccnc1)NCCn1cc([N+](=O)[O-])cn1 128404256 YDWZPBBCLWZIJP-UHFFFAOYSA-N 293.287 -0.013 5 20 CBBD CN1CCO[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 129970192 AHNHKCDERZMTKT-SNVBAGLBSA-N 283.288 -0.762 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CNCCO1 134252807 CSIBFVWZGBGGMT-VIFPVBQESA-N 268.273 -0.349 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(O)CCC1 135490994 VQZFIRSPBPXCSE-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD O=C(CO)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 137135889 UYOADLKIYPGFMW-QMMMGPOBSA-N 266.257 -0.005 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 227051965 PTVSKZIREABWRR-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD CN(Cn1cc([N+](=O)[O-])ccc1=O)S(C)(=O)=O 270625047 FCJRMDUVHBTQSC-UHFFFAOYSA-N 261.259 -0.395 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1COC[C@H]1O 285888003 JVAKOYWVQAIGFC-GHMZBOCLSA-N 283.284 -0.552 5 20 CBBD Cn1nncc1CNc1ncc([N+](=O)[O-])cc1C(N)=O 340976226 MRGWRCZOKPZVTA-UHFFFAOYSA-N 277.244 -0.171 5 20 CBBD C[C@H]1CS(=O)(=O)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 356613713 YMORPXNEEAOWEF-FSPLSTOPSA-N 288.285 -0.519 5 20 CBBD CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])nn1C 357378987 NNFCBRPSUVALQU-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H]1OC 362767608 ZJTKVSODMDHICL-DTORHVGOSA-N 284.272 -0.186 5 20 CBBD NC(=O)[C@@H]1CC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 580568795 PQRVMRUKYJWNPK-BDAKNGLRSA-N 281.272 -0.581 5 20 CBBD O=C(NCc1nnnn1CC1CC1)c1c[nH]nc1[N+](=O)[O-] 584304138 IFMFYWKJPCTJGN-UHFFFAOYSA-N 292.259 -0.356 5 20 CBBD COC(=O)[C@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 592556852 VKFNOQHVBQSYLD-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD C[C@H](O)CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 594064168 KZRRLDACWPUBBA-CABZTGNLSA-N 284.316 -0.003 5 20 CBBD C[C@H](N)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 598914565 HJWDXSVKUMJHCB-ZETCQYMHSA-N 266.257 -0.003 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCOC[C@@]12CCOC2 619676403 RPORJSXDSIBWIU-NSHDSACASA-N 282.256 -0.051 5 20 CBBD Cc1nn(C)c(C(=O)Nn2cnnc2O)c1[N+](=O)[O-] 782125046 UEOJPNLTXNAKDE-UHFFFAOYSA-N 267.205 -0.682 5 20 CBBD CCNC(=O)CCOC(=O)Cn1ccc([N+](=O)[O-])n1 816118404 NGMOBYOBCPNFSQ-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD COC[C@@H](C(N)=O)N(C)C(=O)c1cc([N+](=O)[O-])ccc1N 817930547 GKFZUEBTKPROIY-JTQLQIEISA-N 296.283 -0.251 5 20 CBBD C[C@H]1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C[C@H]1O 825000314 OLGHSYYWSQEUNN-POYBYMJQSA-N 291.271 -0.013 5 20 CBBD COC(=O)[C@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])cn1 831067237 NETCFBZRVMAQHI-QMMMGPOBSA-N 297.223 -0.264 5 20 CBBD Nc1ccc(C(=O)NC[C@@H]2CNCCO2)cc1[N+](=O)[O-] 842509816 HUDLMYKOBXPHBI-VIFPVBQESA-N 280.284 -0.105 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)C1(n2cnnn2)CC1 849997269 KLCWWJSXTIYTBU-UHFFFAOYSA-N 293.243 -0.490 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CCC(N)=O)c1[N+](=O)[O-] 1117511400 XCZIZTGHHRBZPX-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CO)CCF 1326893590 NUTJWOGWYWZSPY-QMMMGPOBSA-N 274.252 -0.064 5 20 CBBD CC(C)COC[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1346402332 FBKLIEUMJNZYNI-QMMMGPOBSA-N 286.288 -0.076 5 20 CBBD O=C(O)[C@@]1(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)CCCO1 1574633108 KAUJRRSOXCIYRM-VIFPVBQESA-N 270.201 -0.110 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)NCCN2CCNCC2)n1 1579642718 SGCCCLRLNGQIEB-UHFFFAOYSA-N 293.327 -0.067 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CCO1 50858431 PKXUONZQEAZSMJ-JTQLQIEISA-N 294.267 -0.497 5 20 CBBD NC(=O)[C@@H]1CCCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247247014 DTQWTBJGORLVGS-MNOVXSKESA-N 297.315 -0.508 5 20 CBBD NC(=O)[C@@H]1CCCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 247248680 DTQWTBJGORLVGS-QWRGUYRKSA-N 297.315 -0.508 5 20 CBBD O=C(O)CCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 262690859 AJBYZVBZRIDTNW-UHFFFAOYSA-N 283.240 -0.263 5 20 CBBD Nc1nc(N2CCN3C(=O)NC[C@H]3C2)ncc1[N+](=O)[O-] 267717094 UMCBZXUYYPIPHX-LURJTMIESA-N 279.260 -0.819 5 20 CBBD CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 285465491 NHUYBCKNDKHGGD-SSDOTTSWSA-N 255.234 -0.442 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 344676766 MAFODXNEDIHYRT-SNVBAGLBSA-N 271.277 -0.640 5 20 CBBD Cc1nn(CCC(=O)NC2(C(N)=O)CC2)c(C)c1[N+](=O)[O-] 346946661 YFEWKHQCHKEESF-UHFFFAOYSA-N 295.299 -0.068 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 362417825 KSSDFPOMPLOBGR-LLVKDONJSA-N 285.256 -0.413 5 20 CBBD C[C@@H]1[C@H](CO)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 488810946 WUCCSYUSPSLFCE-SCVCMEIPSA-N 284.316 -0.145 5 20 CBBD NC(=O)CC1(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 572714248 ADGXGMGZVKTDAN-JTQLQIEISA-N 297.315 -0.603 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CC(=O)N(C2CC2)C1 611236844 XMIUKBAZAAXJQT-ZETCQYMHSA-N 293.283 -0.179 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCNC1=O 619867893 LNGATKKLHCAMBU-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2C[C@@H](O)C2)c1 720925613 OREJWRKZKGSYCN-DVVUODLYSA-N 270.289 -0.487 5 20 CBBD CNC(=O)NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])n1C 761055379 PGTGNTFBUHOHDE-ZCFIWIBFSA-N 298.255 -0.066 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 808174868 VZFGMIONOLOTNQ-QMMMGPOBSA-N 282.300 -0.171 5 20 CBBD O=C(N[C@@H]1C=C[C@H](CO)C1)c1c[nH]nc1[N+](=O)[O-] 1116837429 GPHZINWWOJBNPC-NKWVEPMBSA-N 252.230 -0.015 5 20 CBBD O=C(OCc1nnc2n1CCOCC2)[C@@H]1C[C@H]1[N+](=O)[O-] 1263521537 LYXDHEXGEAQHMR-HTQZYQBOSA-N 282.256 -0.441 5 20 CBBD CCc1[nH]nc(C(=O)NCC[S@@](C)=O)c1[N+](=O)[O-] 1324654675 VHXAFOUMWODQAD-GOSISDBHSA-N 274.302 -0.011 5 20 CBBD CC(C)(CO)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589298867 FIANBDOAPOLGEJ-UHFFFAOYSA-N 267.249 -0.010 5 20 CBBD CN(CCNC(=O)c1n[nH]cc1[N+](=O)[O-])CC(=O)O 1598496144 XKDPYUUSDBZUHS-UHFFFAOYSA-N 271.233 -0.936 5 20 CBBD O=C(O)[C@@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1608540656 UQLHQJCZMRNHDQ-ZJUUUORDSA-N 270.241 -0.337 5 20 CBBD CC(C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 50162242 UHTZWPIYZMIXLE-UHFFFAOYSA-N 256.218 -0.229 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CCOCC1 65834771 YBSBBFVCFQACFM-UHFFFAOYSA-N 297.315 -0.452 5 20 CBBD O=C(O)c1cn(CCNc2ncc([N+](=O)[O-])cn2)nn1 89696710 DJYPYDMREXMCEM-UHFFFAOYSA-N 279.216 -0.213 5 20 CBBD CC(C)[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 157646502 BLBHQOFUHVMYCE-SECBINFHSA-N 256.262 -0.076 5 20 CBBD CCN1C[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 164417373 JNMLQXFRSLZHGY-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD COCCCS(=O)(=O)NCCn1cnc([N+](=O)[O-])c1 177233401 KUZDKVLSBMPJQC-UHFFFAOYSA-N 292.317 -0.253 5 20 CBBD CNC(=O)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 184063115 FUONVQOOUGCMQM-SECBINFHSA-N 283.288 -0.762 5 20 CBBD CN(C)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 194336763 ZWLBRAYCPBHSSN-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD O=C1CN(C(=O)Cn2cc([N+](=O)[O-])c(C3CC3)n2)CCN1 195048727 BPFOPAHENBEZRZ-UHFFFAOYSA-N 293.283 -0.373 5 20 CBBD COC[C@@H](CO)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 234885687 XOAYBKQPPZRAQL-MRVPVSSYSA-N 290.297 -0.120 5 20 CBBD NC(=O)[C@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CCO1 246234552 GUCCIYNYWNEUKK-NWDGAFQWSA-N 295.295 -0.186 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCC(N)=O 275451981 SQGOQNGIJAOXRY-UHFFFAOYSA-N 294.267 -0.167 5 20 CBBD COCC[C@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 281791469 VQKTVCJZCVVKHN-SECBINFHSA-N 286.288 -0.305 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285127962 PYZKUUFGOGZXKK-ZCFIWIBFSA-N 268.229 -0.047 5 20 CBBD COCC(=O)N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 298705233 IQZRRZPJFTUBGT-UHFFFAOYSA-N 296.287 -0.738 5 20 CBBD CS(=O)(=O)NCCCNc1ccc(N)c([N+](=O)[O-])n1 311487961 BJUFVZSUBRSVGR-UHFFFAOYSA-N 289.317 -0.077 5 20 CBBD CC(C)(O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 311953777 ZRBKDLCSFDXIDP-SNVBAGLBSA-N 272.305 -0.097 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](CO)[C@H]2CCCO2)c1[N+](=O)[O-] 344922540 PGKBTSYTKMGWKK-HTQZYQBOSA-N 284.272 -0.104 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H](O)[C@@H]1CCOC1 346418472 KQDLCWJWTLHCRS-GMSGAONNSA-N 296.283 -0.102 5 20 CBBD Cc1ccn(Cc2nnnn2C)c(=O)c1[N+](=O)[O-] 349146044 WGYUNCYEUZNAJI-UHFFFAOYSA-N 250.218 -0.363 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])nn1C 356522546 RXDURFMSLBZDQE-UHFFFAOYSA-N 283.288 -0.170 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[C@@H]1N 429186845 VNAYICGDEIVECD-IUCAKERBSA-N 267.289 -0.013 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)OC[C@@H]2C1 494130609 CGGFFEHOVUPARL-LURJTMIESA-N 281.228 -0.406 5 20 CBBD CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](CN)C1 519774746 RZDLGZUMXYMSMR-ZETCQYMHSA-N 268.277 -0.967 5 20 CBBD CCc1nncn1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 530584490 HKEQRVOTINHZKX-UHFFFAOYSA-N 293.287 -0.238 5 20 CBBD CNCCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 576989946 LRMTVZQRWPJQCL-UHFFFAOYSA-N 260.275 -0.513 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@H]2C[C@H]2N1 592565380 ZUFZESYAZBYVPV-QNSHHTMESA-N 265.273 -0.342 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 594283617 LQKSMYKJXIQQIY-UHFFFAOYSA-N 295.299 0.122 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 598517329 RUXOFHWJBBUPOT-IZLXSQMJSA-N 268.229 -0.001 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCOCCF 598563012 XBLFJNWYCHJLTO-UHFFFAOYSA-N 260.225 -0.106 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2ccccc2[N+](=O)[O-])C1 600337345 DRQLIHYVKYZFFU-UHFFFAOYSA-N 299.308 -0.032 5 20 CBBD CNS(=O)(=O)CCCNC(=O)c1ccc([N+](=O)[O-])o1 600665352 KSLZXGFRPXYSIS-UHFFFAOYSA-N 291.285 -0.143 5 20 CBBD CNc1ccc(C(=O)N[C@H](CO)C(=O)O)cc1[N+](=O)[O-] 737560740 APDXCYKDSWKFNH-MRVPVSSYSA-N 283.240 -0.188 5 20 CBBD Nc1nonc1C(=O)OCCn1ccc([N+](=O)[O-])n1 748124361 ZXOFATHQVDHURJ-UHFFFAOYSA-N 268.189 -0.387 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840427603 GWISJGMSRKCERT-LURQLKTLSA-N 272.257 -0.824 5 20 CBBD C[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])S(C)(=O)=O 1116933023 XUBIJGCAOCNWNN-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD O=C(NC[C@@H](CO)[C@H]1CCOC1)c1c[nH]nc1[N+](=O)[O-] 1256721300 WFAARAFVLAMFLZ-YUMQZZPRSA-N 284.272 -0.307 5 20 CBBD Cc1nc2n(n1)CCN(C(=O)c1c([N+](=O)[O-])cnn1C)C2 1319886744 AKYHCHQYEYUGPC-UHFFFAOYSA-N 291.271 -0.116 5 20 CBBD Cc1cncc([N+](=O)[O-])c1N1CCO[C@@H](C(N)=O)C1 1320712010 MXHVELNSRDGWDP-SECBINFHSA-N 266.257 -0.011 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](O)[C@@H](O)C2)n1 1602404055 DDZNUAJPOSCIIP-BDAKNGLRSA-N 283.240 -0.380 5 20 CBBD CN1C[C@@H](O)[C@H](N(C)c2nc(C(=O)O)ccc2[N+](=O)[O-])C1 1777093344 VBPVDUNELHTUAR-NXEZZACHSA-N 296.283 -0.201 5 20 CBBD Cc1nn(Cc2nc(N)nc(N)n2)c(C)c1[N+](=O)[O-] 17657190 SDQVSXIEIKNLAZ-UHFFFAOYSA-N 264.249 -0.194 5 20 CBBD CCN(CC(=O)NC(C)C)C(=O)Cn1cnc([N+](=O)[O-])n1 48222394 CWOWVWLRYVTYPD-UHFFFAOYSA-N 298.303 -0.441 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 228748249 IMBYTORLGRARQF-LBPRGKRZSA-N 284.316 -0.024 5 20 CBBD CN(CCOCCO)CCn1cc([N+](=O)[O-])cn1 282492569 NBRSLDQOOAZUJC-UHFFFAOYSA-N 258.278 -0.268 5 20 CBBD C[C@H](NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(N)=O 311530847 FMRHKJAZAGFYFN-YFKPBYRVSA-N 291.260 -0.114 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)CN)c([N+](=O)[O-])n1 347612282 QFYNNOHBNNCPGS-LURJTMIESA-N 277.306 -0.563 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cc(O)cc([N+](=O)[O-])c1 447637703 WGTAOYQIBVPINO-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CN(C)NC2=O)c1 450613163 SSGNXEHRDLSCHK-VIFPVBQESA-N 278.268 -0.022 5 20 CBBD CCN1C[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 593825281 GFMBJRNOEAUPRJ-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD CON(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 776567206 GRVWLTVDUOXXHZ-UHFFFAOYSA-N 257.250 -0.599 5 20 CBBD CC(C)(CCC(=O)N[C@@]1(C(N)=O)CCOC1)[N+](=O)[O-] 848318407 HLVCFDVVIOGTFW-NSHDSACASA-N 273.289 -0.418 5 20 CBBD COC(=O)N(C)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 855942388 DCAFPFGIEFAXGL-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1cn[nH]c1 1124067989 STKUYCQYNSWFCE-UHFFFAOYSA-N 293.287 -0.429 5 20 CBBD C[S@@](=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1318368209 ICVKWEWUHIBHGE-LJQANCHMSA-N 287.297 -0.749 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1320689699 KWYNKSDMLWFYSY-SSDOTTSWSA-N 283.288 -0.075 5 20 CBBD CN1CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 1321456620 DKYJZILXXJIIDX-LURJTMIESA-N 253.218 -0.722 5 20 CBBD Cc1[nH]nc(C(=O)NCCn2cncn2)c1[N+](=O)[O-] 1322510639 ROSJIQPREOXSNL-UHFFFAOYSA-N 265.233 -0.352 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1338302715 SSFIHNCOOWSDLD-JGVFFNPUSA-N 284.272 -0.796 5 20 CBBD COC[C@H](NC(=O)c1cccc(OC)c1[N+](=O)[O-])C(N)=O 1339177354 YNJHKUCLEOVNOK-QMMMGPOBSA-N 297.267 -0.167 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCCCO 1344018033 INWCTWDRMJWGOX-UHFFFAOYSA-N 269.257 -0.355 5 20 CBBD C[C@@]1(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC(=O)N1 1345619365 RESADNWSJQIVBO-PWSUYJOCSA-N 297.315 -0.590 5 20 CBBD O=C(N[C@@H]1CNOC1)[C@@H](O)c1cccc([N+](=O)[O-])c1 1580749430 VOBXSXSVUBVXIJ-SCZZXKLOSA-N 267.241 -0.352 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1601763435 IBECQUXTADMSRJ-NTSWFWBYSA-N 284.228 -0.775 5 20 CBBD COCCN(CCn1ccc([N+](=O)[O-])n1)[C@H](C)C(N)=O 176235052 ZVQNJJAJYDSKMM-SECBINFHSA-N 285.304 -0.387 5 20 CBBD Nc1nc(NCCCN2CCNC(=O)C2)ncc1[N+](=O)[O-] 269931899 DHGBHOHHCHIGOS-UHFFFAOYSA-N 295.303 -0.799 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@H](O)CO 271248301 GRYVKYXGYPIMQD-VIFPVBQESA-N 286.288 -0.699 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)C1 276304961 UEJWTQSHJSBJNA-RXMQYKEDSA-N 282.212 -0.452 5 20 CBBD CN(CC(N)=O)c1cccc(S(C)(=O)=O)c1[N+](=O)[O-] 301901787 VVHCRBYGAUCBSN-UHFFFAOYSA-N 287.297 -0.080 5 20 CBBD CCNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 344641073 ZLPNVIUNNYCXKE-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1ccc([N+](=O)[O-])n1C 354163584 ZEOMZRZXCNYOGA-SSDOTTSWSA-N 257.246 -0.642 5 20 CBBD CCOC(=O)c1ccnc(N(C)C[C@H](O)CO)c1[N+](=O)[O-] 355743009 NLCRVXLGIUFWMK-QMMMGPOBSA-N 299.283 -0.044 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C(=O)N1 436956787 PCMHTCWYZZGIET-QMMMGPOBSA-N 280.240 -0.625 5 20 CBBD C[C@@H](O)CN(Cc1c([N+](=O)[O-])ncn1C)[C@H](C)CO 443343117 GAFQRMPZXFSYJR-RKDXNWHRSA-N 272.305 -0.108 5 20 CBBD CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](CN)C1 519774504 RZDLGZUMXYMSMR-SSDOTTSWSA-N 268.277 -0.967 5 20 CBBD CNS(=O)(=O)[C@H]1CCN(c2c([N+](=O)[O-])ncn2C)C1 532756640 PXIYGWWHAPBGNS-ZETCQYMHSA-N 289.317 -0.544 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CNCCO)c1 551974668 WFAKGVHMBPIDSU-SNVBAGLBSA-N 256.258 -0.084 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CNCCN1C 578858762 PLWFCWHCEYBGCU-NSHDSACASA-N 293.327 -0.068 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 592006811 WVJWJZYSZQHBJZ-RNFRBKRXSA-N 297.271 -0.673 5 20 CBBD O=C(NCc1nn[nH]n1)c1cc2c(cc1[N+](=O)[O-])OCO2 609533142 YHXDZSCAUGBJGQ-UHFFFAOYSA-N 292.211 -0.233 5 20 CBBD CCN(CC(=O)NC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 743842618 IVNSUGSOYNVSDN-SNVBAGLBSA-N 285.304 -0.780 5 20 CBBD CC[C@H]1COCCN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 874710565 KFRRAFYVOUCSAW-HBNTYKKESA-N 271.317 -0.121 5 20 CBBD Cc1nccnc1CCNC(=O)Cn1cnc([N+](=O)[O-])n1 1261250098 GMEKLZWRINKJMD-UHFFFAOYSA-N 291.271 -0.356 5 20 CBBD NS(=O)(=O)C1CCN(c2ncc([N+](=O)[O-])cn2)CC1 1325403494 DAOWASCUZIEYSX-UHFFFAOYSA-N 287.301 -0.358 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CNCCO2)c1[N+](=O)[O-] 1326936241 GDBHWVPAUTWETD-ZETCQYMHSA-N 269.261 -0.655 5 20 CBBD CC(C)NC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 48268415 HJKTVEFULJZKJE-UHFFFAOYSA-N 269.261 -0.568 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCOCC(=O)O 93228299 IQGWTEYBKUENOJ-UHFFFAOYSA-N 271.229 -0.236 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@@H]2CCC[C@H](C1)N2 159745094 NFLFAGVQPIHWDZ-DTORHVGOSA-N 280.288 -0.461 5 20 CBBD C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)O 262254550 DYXDYBMQYZKSON-NSHDSACASA-N 283.240 -0.258 5 20 CBBD CN[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 269144530 XUUFSDNKWQEYID-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1O)OC 295238225 DHFIQKLIYHZEEK-QMMMGPOBSA-N 299.239 -0.387 5 20 CBBD COC(=O)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 299439015 IZYZTIOKTXCYMJ-UHFFFAOYSA-N 256.218 -0.081 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 356609688 NWMJVPXJYJNPHC-LURJTMIESA-N 269.261 -0.086 5 20 CBBD O=[N+]([O-])c1cnc(NCCCn2cc(CO)nn2)nc1 357594687 LUDKCRNYOBHLJP-UHFFFAOYSA-N 279.260 -0.029 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(CC(N)=O)C1 358122623 INNVDZCIOVXCES-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD Cn1nncc1CNC(=O)c1ccc([N+](=O)[O-])n1C 360660246 NDBYRRHYRRPMBG-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1C[C@H](F)CN1 368385790 QUGKDOASKGWHGW-IUCAKERBSA-N 285.279 -0.002 5 20 CBBD O=[N+]([O-])c1ccccc1OCCNC(CO)CO 574925394 ZESNWSYWUMTZQX-UHFFFAOYSA-N 256.258 -0.084 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 588864650 LLGVIMGWAWKJRB-MRVPVSSYSA-N 282.300 -0.171 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@]3(CCNC3)C2)c1 923331667 MQHMXNHAXGKDQY-QWHCGFSZSA-N 295.343 -0.162 5 20 CBBD NC(=O)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 1094079454 IRQBGRHBWJOTPS-UHFFFAOYSA-N 252.230 -0.392 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCn1cncn1 1251654185 WCBXRPDPLJTVDL-UHFFFAOYSA-N 293.287 -0.102 5 20 CBBD CN1CC[C@@H](COC(=O)Cn2cnc([N+](=O)[O-])n2)C1=O 1263519310 HMBNMKLULRJFCX-ZETCQYMHSA-N 283.244 -0.792 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1cccnc1[N+](=O)[O-] 1318813517 BGHQNCDMHPMOJJ-UHFFFAOYSA-N 274.258 -0.904 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN2CCOC[C@@H]2C1 1340990598 AKZBDSLQSLJANE-JTQLQIEISA-N 296.331 -0.405 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1599845682 UJLJXLXQDLGFOY-ANLVUFKYSA-N 284.224 -0.136 5 20 CBBD O=C(O)CCC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 1601969377 RODWJPVPFBOGRY-UHFFFAOYSA-N 285.212 -0.232 5 20 CBBD CNC(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 133119384 WNHPJXSNAOAPGW-UHFFFAOYSA-N 259.243 -0.398 5 20 CBBD COC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 167316922 LFTVYLHAMWLGBU-LURJTMIESA-N 272.217 -0.993 5 20 CBBD C[C@H](NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C(N)=O 180741728 LTCLKTOQBSMWIU-YFKPBYRVSA-N 291.260 -0.114 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 195468433 QPYTZQNYIVWKDI-UHFFFAOYSA-N 283.288 -0.239 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1 226385434 ACSWJDCQDQXKPS-UHFFFAOYSA-N 289.269 -0.681 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228754480 QQKUZKDFJNLSKF-NSHDSACASA-N 285.304 -0.780 5 20 CBBD COCCN(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 263798148 SEPIFQJJBBOEOD-UHFFFAOYSA-N 285.304 -0.514 5 20 CBBD COC[C@@](C)(N)CNc1ncc([N+](=O)[O-])c(N)n1 265078984 ZOZQRGCWYFWXRH-VIFPVBQESA-N 256.266 -0.257 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 283029170 OUSNHPOCJVCNPF-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD CCOC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299522173 PHHRGKOYLWBTSY-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])n1C 338110511 BBBSVOZWMCCCBF-UHFFFAOYSA-N 284.272 -0.574 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1COC[C@H]1O 342456603 NTFISLIVDXPFPQ-DTWKUNHWSA-N 269.257 -0.235 5 20 CBBD O=C(O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 347502495 RQWUMZGCBJRWDJ-UHFFFAOYSA-N 269.217 -0.738 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](O)CO 436436646 TYWAOLFCTPJNMD-SSDOTTSWSA-N 291.285 -0.993 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CCO1 543845220 IUDBZIPJLDPCPA-JTQLQIEISA-N 296.283 -0.480 5 20 CBBD CC[C@@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 583085300 ZNZGBBPQCZMQNG-MRVPVSSYSA-N 268.273 -0.390 5 20 CBBD CNC(=O)C1CN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1 598616818 YQNMEKPDYKXFHE-UHFFFAOYSA-N 294.267 -0.041 5 20 CBBD NS(=O)(=O)CCOc1ccc(C(=O)O)cc1[N+](=O)[O-] 739192680 NSLZCFLXPJNTMM-UHFFFAOYSA-N 290.253 -0.040 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(N)=O 760062429 IUJMFOFTIRKVHQ-ZETCQYMHSA-N 270.245 -0.837 5 20 CBBD COc1cccc(C(=O)NN2CC(=O)NC2=O)c1[N+](=O)[O-] 767631324 PXOLKQMJIVTDOL-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCn1cnnn1 807918306 LYNGQYCVKNAMEB-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1CC(C)(C)O 839730669 HZLWVGOCVVATNI-HBNTYKKESA-N 285.344 -0.045 5 20 CBBD CC[C@H](C)[C@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1594908511 HATQTFWWOOQIHN-RCOVLWMOSA-N 285.260 -0.198 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1cc2c(cc1[N+](=O)[O-])OCO2 1610683761 ZTLIWICYHCCXBF-ZCFIWIBFSA-N 298.207 -0.501 5 20 CBBD COC(=O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 48284561 YJWGYQPSSUPKSK-UHFFFAOYSA-N 256.218 -0.577 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCNC(=O)C(C)C 65718928 IIPYUWDQJRJFSJ-UHFFFAOYSA-N 297.315 -0.012 5 20 CBBD CC[S@](=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 132754719 MJODRRAHPYPXCL-GIGQVBGESA-N 290.345 -0.490 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnc[nH]1 225070012 BYTQPFKHVYXAER-LURJTMIESA-N 265.233 -0.213 5 20 CBBD CCn1cc(S(=O)(=O)NCC(=O)O)c([N+](=O)[O-])n1 340450227 PVUFZDQAOIZFAV-UHFFFAOYSA-N 278.246 -0.826 5 20 CBBD N[C@@H]1CCC[C@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@@H]12 342763779 YVOSJJLIJYIDJQ-IVZWLZJFSA-N 294.315 -0.228 5 20 CBBD CC[C@@H](C)NC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 343497688 RLZXYMOIODVJKK-MRVPVSSYSA-N 298.303 -0.393 5 20 CBBD Cc1[nH]nc(C(=O)N2CCc3nn[nH]c3C2)c1[N+](=O)[O-] 346110445 RJKFVOZOMOXCGT-UHFFFAOYSA-N 277.244 -0.057 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354821295 MSSYIXFEMMILSY-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H](O)C[C@@H]1CO 357643483 LPXCRIKXPNONPM-KOLCDFICSA-N 282.252 -0.132 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CCC[C@H]2O)c1 519647981 FUMLBYGDZAIJFK-HBNTYKKESA-N 270.289 -0.345 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H]1O 565194899 IPDYHCHHYMVEQD-YUMQZZPRSA-N 269.261 -0.935 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@@H](N3CCNCC3)C2)c1 573447190 AZJBEAWLRPQNEX-GFCCVEGCSA-N 294.359 -0.229 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCn1ccnn1 611797321 XGYAYOFEOTVVRE-UHFFFAOYSA-N 293.287 -0.102 5 20 CBBD Cn1nc(C(=O)OCCn2cc([N+](=O)[O-])cn2)ccc1=O 748118745 OYGUYFFOOCCRDY-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD O=C(O)[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 819281564 WHAGJLWIFHXFLF-WCBMZHEXSA-N 284.272 -0.441 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(c2ncc[nH]2)CC1 847946183 CYNONCQDBWTVRM-RKDXNWHRSA-N 265.273 -0.277 5 20 CBBD Cn1ccnc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031661694 FDSOXYZAKRCULV-GHMZBOCLSA-N 293.327 -0.367 5 20 CBBD O=C(NCCN(CCO)C(=O)C1CCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1056761288 IFZUHWUXAWJSFZ-GHMZBOCLSA-N 299.327 -0.611 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NC/C=C/CNC(=O)C(N)=O 1107480712 RMWKCWQPXSJTNC-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD O=C(N[C@]1(CO)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1116585140 RPPXDQRKWVQFIM-VIFPVBQESA-N 256.218 -0.801 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H]2C[C@@]2(CO)C1 1320699233 NGCXXHULDVXFDA-SKDRFNHKSA-N 280.284 -0.059 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1C[C@@H](O)C1 1328296315 BXWUZPUCUNPTDM-OCAPTIKFSA-N 267.241 -0.604 5 20 CBBD O=C(O)c1nc(=NCCn2cc([N+](=O)[O-])cn2)cc[nH]1 1602572868 BWPMAPAFLLJJQN-UHFFFAOYSA-N 278.228 -0.187 5 20 CBBD COC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)O 1606813066 JOZCDMPIELVZIY-RXMQYKEDSA-N 258.190 -0.853 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](O)C1CC1 71303941 WYVIBZPMFLGFLR-QMMMGPOBSA-N 254.246 -0.322 5 20 CBBD CN(CCS(C)(=O)=O)c1ncc([N+](=O)[O-])c(N)n1 76270359 DRVAPBNXLZVPHT-UHFFFAOYSA-N 275.290 -0.552 5 20 CBBD CCOC(=O)[C@H]1CNCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 88659994 JQDYJULHLLOKGB-SECBINFHSA-N 296.283 -0.100 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCN(CCO)CC1 97682008 FBMNFFMJTFMQEG-UHFFFAOYSA-N 297.315 -0.682 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 227048998 LKPNUHAVUMWSGN-ZETCQYMHSA-N 257.202 -0.813 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCN[C@@H](C(N)=O)C2)n1 269065766 YUBCCFPPUIGIDE-MRVPVSSYSA-N 265.273 -0.438 5 20 CBBD C[C@@H](O)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 270875367 NQGLAMGMHQFMRF-MRVPVSSYSA-N 297.267 -0.147 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 270885580 BNMGTMYSZLSPPY-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCNC1=O 330561949 IRVSVWMJCSAZLR-MRVPVSSYSA-N 267.245 -0.814 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@@H](COC)C(N)=O)c1[N+](=O)[O-] 354558871 YXXWOTYNRPCVQF-ZETCQYMHSA-N 299.287 -0.547 5 20 CBBD Cn1c(C(=O)N=c2nc[nH]n2C)ccc1[N+](=O)[O-] 355253468 AJFHERKJNIJIEF-UHFFFAOYSA-N 250.218 -0.264 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 355612649 GLNHYCDMLMUZQS-MRVPVSSYSA-N 294.267 -0.104 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H](O)C[C@@H]1CO 373471975 CBJJWKVBTXHBGQ-RKDXNWHRSA-N 282.252 -0.132 5 20 CBBD CC[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)O 386757091 HRTVMCKIUMLTGI-LSJOCFKGSA-N 272.305 -0.099 5 20 CBBD CO[C@@H]1CN[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 576940896 KKBTWDIBAMIPFF-VHSXEESVSA-N 283.288 -0.716 5 20 CBBD O=[N+]([O-])c1cnc(NCCN2CC[C@@H](O)C2)nc1 599176022 OLQCTVFZPCFVIR-SECBINFHSA-N 253.262 -0.137 5 20 CBBD CN(C)C[C@@H](O)CNc1ncc([N+](=O)[O-])c(N)n1 728051197 REWQGZOSEMTBII-LURJTMIESA-N 256.266 -0.699 5 20 CBBD Nc1nc(NCCn2cnnn2)ncc1[N+](=O)[O-] 845573968 IDICZLLBSAZOOB-UHFFFAOYSA-N 251.210 -0.934 5 20 CBBD CNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 1116574987 YYCKUKMUVTWQMT-UHFFFAOYSA-N 267.245 -0.610 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](C(N)=O)C(C)(C)C 1319757106 VQSRNWGIBHITOS-MRVPVSSYSA-N 283.288 -0.042 5 20 CBBD O=C(NC[C@@H]1CCCNC1=O)c1n[nH]cc1[N+](=O)[O-] 1321344259 OWCJQQMJMYQBBF-LURJTMIESA-N 267.245 -0.426 5 20 CBBD CC(C)(O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1321531756 ZGVJBDXCBQJQLO-UHFFFAOYSA-N 255.230 -0.374 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CCOCO2)c1=O 1321839479 AQYHDVOBXHOQDE-QMMMGPOBSA-N 283.240 -0.382 5 20 CBBD CON(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H](C)C(=O)O 1594038823 YRMMDMFWUFKGHF-SCSAIBSYSA-N 258.190 -0.205 5 20 CBBD O=C(O)C[C@]1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CCOC1 1601930664 KNOZDSKMHLGJEL-SNVBAGLBSA-N 284.228 -0.319 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1ccc([N+](=O)[O-])o1 40507910 ZJGFVZITTWNPBE-UHFFFAOYSA-N 282.256 -0.651 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CN(CCO)CCO)cc1 62350980 AEUKUVROASZEFX-GFCCVEGCSA-N 270.285 -0.085 5 20 CBBD Cn1c(C(=O)NC[C@H]2CNCCO2)ccc1[N+](=O)[O-] 134255634 XTAFYVFQGYBXSR-MRVPVSSYSA-N 268.273 -0.349 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCO[C@H](CO)C1 168332630 YWUSKOIZCKTXFZ-QMMMGPOBSA-N 270.245 -0.989 5 20 CBBD CC(=O)NC[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 174867590 LKZHGHOUYITZSB-GFCCVEGCSA-N 297.315 -0.372 5 20 CBBD Nc1c(C(=O)N2C[C@H](O)[C@@H](O)C2)cccc1[N+](=O)[O-] 236358470 FDMBTGVUMSPYDQ-IUCAKERBSA-N 267.241 -0.645 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 264089299 FUHAZCZSNFIUKM-ZCFIWIBFSA-N 281.272 -0.159 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H](C)O 276029706 UDCMFDHCGGBSSU-WKEGUHRASA-N 298.251 -0.047 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(=O)N(CC2CC2)C1 279591691 WKHUOBPGEVEZAS-UHFFFAOYSA-N 293.283 -0.170 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@H](O)C1 299494086 JDSWNFGTAKRHHU-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 331533874 NOJUUZNZKKJVTB-UHFFFAOYSA-N 252.230 -0.259 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 341748476 QYVOIZOKXWHFBO-QMMMGPOBSA-N 293.239 -0.953 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1 355070693 OXAYIFSDDQMARN-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 425094098 UCDBZSZAOAFWPC-SSDOTTSWSA-N 280.240 -0.200 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 549349075 NSPNAQXALOMOBR-ZCFIWIBFSA-N 269.261 -0.086 5 20 CBBD C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](CO)O1 559034943 WYDDHVALNSFPAI-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD O=C(NCCCn1cccnc1=O)c1cc([N+](=O)[O-])n[nH]1 573012388 DTCMCFAYQLRUIN-UHFFFAOYSA-N 292.255 -0.305 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCCn2nnnc21 590552229 GDTHDAUPNAXBGW-UHFFFAOYSA-N 278.232 -0.785 5 20 CBBD C[C@H](CN)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 592369369 UIWLJWHJIITMRP-SSDOTTSWSA-N 274.302 -0.043 5 20 CBBD CC1(C)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](CO)O1 817628359 RYKDPDQMKJGGQG-IWSPIJDZSA-N 258.274 -0.350 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H](O)COCC1CC1 1319651811 NGCDXWFYUZTGQW-VIFPVBQESA-N 298.299 -0.154 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)[C@@H](CO)C1 1333040298 XCAHIHXAFXXVQH-SNVBAGLBSA-N 269.305 -0.600 5 20 CBBD O=C(N[C@@H]1CCNC[C@@H]1F)c1n[nH]cc1[N+](=O)[O-] 1580617227 OHGZVTOVVAMYOM-NTSWFWBYSA-N 257.225 -0.252 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 81440756 WBUXGOURFZIMTE-MRVPVSSYSA-N 297.315 -0.060 5 20 CBBD NC(=O)NCCNC(=O)c1cccc([N+](=O)[O-])c1N 122823008 WXQSEJIJXMTDKN-UHFFFAOYSA-N 267.245 -0.425 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1 227047457 FQDKCKCDCNQSNW-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCn2cncn2)c1 339627940 NOYVRBGHYSKQCF-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD Cc1c(C(=O)N[C@@H](CO)C(N)=O)cccc1[N+](=O)[O-] 352994658 WEHYUGDVBPZSDD-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD Nc1nc(N2CCn3c(O)nnc3C2)ncc1[N+](=O)[O-] 358857656 DTZCBIOXTKWAKD-UHFFFAOYSA-N 278.232 -0.716 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC(=O)N(C2CC2)C1 359475553 AIPKXUCKSKVGRH-SSDOTTSWSA-N 293.283 -0.179 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1CC(=O)N(C2CC2)C1 359475554 AIPKXUCKSKVGRH-ZETCQYMHSA-N 293.283 -0.179 5 20 CBBD C[C@H]1NCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1C 434672739 ZLVFBTOWZHVGEA-HTQZYQBOSA-N 268.277 -0.605 5 20 CBBD Nc1noc(CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 443103398 AYNVXEDUBDPKMK-UHFFFAOYSA-N 266.217 -0.139 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1cnc(O)c([N+](=O)[O-])c1 445004664 IIKLJAKLQXRMKV-UHFFFAOYSA-N 280.200 -0.551 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1=O 559275668 JNCUBBLIFNPYBT-ZETCQYMHSA-N 292.251 -0.336 5 20 CBBD CNc1nccc(C(=O)N2CC(=O)N[C@H](C)C2)c1[N+](=O)[O-] 567061489 YIWDRSQQGNUZCS-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD O=[N+]([O-])c1cc2c(cc1CN1C[C@H](O)[C@@H](O)C1)OCCO2 600189246 DIOSLGJMUFVLIB-QWRGUYRKSA-N 296.279 -0.097 5 20 CBBD COC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748916107 FKBOPCUEWIDRFS-UHFFFAOYSA-N 270.197 -0.527 5 20 CBBD COC[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])C(N)=O 760043461 HMGHRALSGFXMGH-QMMMGPOBSA-N 285.231 -0.036 5 20 CBBD O=C1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCCN1 764092400 AVATYJBKAGSKIE-UHFFFAOYSA-N 253.218 -0.720 5 20 CBBD COC[C@@H](O)C(=O)OCCn1ccc([N+](=O)[O-])n1 766142229 XBYDBYXKLWFAHH-SSDOTTSWSA-N 259.218 -0.658 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCN1 1326305639 JCMXRJLWYGXNMA-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD CN(C)CC1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1329320907 JCPBEEPPGHZQOK-UHFFFAOYSA-N 267.289 -0.189 5 20 CBBD CO[C@@H](C(=O)O)C(=O)Nc1c([N+](=O)[O-])cnn1C 1574104506 HSANUEXLUDCCKU-RXMQYKEDSA-N 258.190 -0.634 5 20 CBBD Nc1ccc(C(=O)N2CC(O)(C(=O)O)C2)cc1[N+](=O)[O-] 1601214052 DEHJIFBYXJQXID-UHFFFAOYSA-N 281.224 -0.552 5 20 CBBD O=C(O)C[C@@H]1CC[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 1602110065 OMDYRXZFZKBRBI-SFYZADRCSA-N 297.271 -0.054 5 20 CBBD C[C@@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)C(=O)O 1604405138 UBRPMJSVNUTUID-ZCFIWIBFSA-N 298.207 -0.658 5 20 CBBD Cc1nc(N2C[C@@H](C(=O)O)C[C@@H](O)C2)ncc1[N+](=O)[O-] 1610557046 PIHQDKAFJOPEDN-JGVFFNPUSA-N 282.256 -0.035 5 20 CBBD NCC(=O)NCC(=O)NCCc1ccc([N+](=O)[O-])cc1 40676229 LJVYLLXHPGKBGP-UHFFFAOYSA-N 280.284 -0.672 5 20 CBBD NC(=O)CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 54546356 WQABKQAUQASKLO-UHFFFAOYSA-N 292.295 -0.162 5 20 CBBD Cc1ccn(CCC(=O)NC(N)=O)c(=O)c1[N+](=O)[O-] 129783978 LNSVGMPLHUZNHS-UHFFFAOYSA-N 268.229 -0.350 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NCCn1ccc([N+](=O)[O-])n1 193582993 CLNPGVMBYWRBEK-WPRPVWTQSA-N 267.289 -0.095 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H](CO)O1 230419604 LBQPBDDDQGQHNG-APPZFPTMSA-N 296.283 -0.206 5 20 CBBD C[S@@](=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 230696016 SKWIWVYHOGFBAN-GOSISDBHSA-N 272.286 -0.320 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 264556187 XFFLTCMGQKDEPJ-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD CC(C)[C@@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 289472249 ZCLQSGFDRKNHDB-CMPLNLGQSA-N 299.331 -0.358 5 20 CBBD CN1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C(=O)N1 357460149 QVKFKOCLVKPDGL-SECBINFHSA-N 280.240 -0.625 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCOC[C@@]12CCOC2 367010904 OHKTZPWWIGWEKH-KKZNHRDASA-N 256.258 -0.331 5 20 CBBD CCn1[nH]c(C)nc1=NC(=O)c1ccnc(N)c1[N+](=O)[O-] 573576254 JOFFLKDCGADTFF-UHFFFAOYSA-N 291.271 0.166 5 20 CBBD CC1(C)CNCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 591678529 WQOWLOALZDGWGT-UHFFFAOYSA-N 268.277 -0.603 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1 593562331 FSUGJBAOTKDQIS-UHFFFAOYSA-N 286.269 -0.714 5 20 CBBD C[C@H](CO)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 611023636 IOSQKJQBKMWCBE-ZCFIWIBFSA-N 261.259 -0.351 5 20 CBBD CN1C(=O)CC[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 786175404 YETHRHISFZMDCJ-SECBINFHSA-N 282.256 -0.045 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)Cn1nnc2ccccc2c1=O 814044788 UNDASCPZZNJLDZ-MRVPVSSYSA-N 292.251 0.000 5 20 CBBD CNc1nccc(C(=O)NOCCO)c1[N+](=O)[O-] 847756263 GDERQQNPYSQSMO-UHFFFAOYSA-N 256.218 -0.315 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCCNCC2)c1 923277379 GJOOYGYUZJYXRK-NSHDSACASA-N 269.305 -0.553 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NC1(CNC(=O)C(N)=O)CC1 1110324464 PNCRKPPOXUXCGE-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD CN(Cn1ccc(=O)c([N+](=O)[O-])c1)S(C)(=O)=O 1319584423 WRCVVRZBFKVVAO-UHFFFAOYSA-N 261.259 -0.395 5 20 CBBD CNC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1328386130 KNPYWLZCXHKHAO-UHFFFAOYSA-N 282.256 -0.991 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)c1c([N+](=O)[O-])cnn1C 1328649131 UWZXXZSVJCRALC-QMMMGPOBSA-N 284.272 -0.184 5 20 CBBD Cn1cc(C[S@@](=O)CCn2cc([N+](=O)[O-])cn2)nn1 1336067988 TVABSZYAXLHOKL-IBGZPJMESA-N 284.301 -0.131 5 20 CBBD O=C(O)CN(CC1CC1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1339749753 YHIVOXSIEMIRLT-LLVKDONJSA-N 298.299 -0.051 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1339894222 NJGBSXDXZHWCEA-POYBYMJQSA-N 281.272 -0.417 5 20 CBBD O=C(O)COCC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 1602076783 RULCWUGQCPYUFF-UHFFFAOYSA-N 295.251 -0.024 5 20 CBBD NC(=O)CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 75476431 NNFXEMUALJRSNC-UHFFFAOYSA-N 292.295 -0.162 5 20 CBBD C[C@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)N1CCOCC1 134479282 XEZDMGWFAFHEHE-QMMMGPOBSA-N 283.288 -0.013 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 167607210 XEUKUJDIKUMIPV-PSASIEDQSA-N 284.272 -0.601 5 20 CBBD O=C(NC[C@@H](CO)[C@@H]1CCOC1)c1cc([N+](=O)[O-])[nH]n1 285878789 IKWKZSPNDDBYJV-SFYZADRCSA-N 284.272 -0.307 5 20 CBBD COc1ccc(CNS(N)(=O)=O)cc1[N+](=O)[O-] 298864708 IKHBFSDFTLRKFG-UHFFFAOYSA-N 261.259 -0.104 5 20 CBBD CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H]1OC 332645115 JYVIYLFHWKUPTE-YUMQZZPRSA-N 270.245 -0.196 5 20 CBBD COC(=O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 341808303 JOTOTZAYQXDFOS-UHFFFAOYSA-N 296.287 -0.738 5 20 CBBD C[C@@]1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCCNC1 342762060 UUKYQEYAPHGPPM-LLVKDONJSA-N 282.304 -0.308 5 20 CBBD C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N1CCOCC1 342820689 KHUGOIDOBHGIIU-ZETCQYMHSA-N 296.287 -0.374 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 345411926 JMAGAMIPAPJYNN-JTQLQIEISA-N 286.244 -0.638 5 20 CBBD CCCN(CC(N)=O)C(=O)c1c([N+](=O)[O-])cnn1C 346903965 LBLVZTNEMKSTPF-UHFFFAOYSA-N 269.261 -0.334 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])cnc2O)C1 359311235 TVKNRLKMMLJOMH-UHFFFAOYSA-N 280.240 -0.344 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 565195032 LSGMXKVFVVUHII-NSHDSACASA-N 298.255 -0.774 5 20 CBBD CN(C)[C@H]1CN(Cc2cn(C)nc2[N+](=O)[O-])C[C@@H]1O 602836763 IINFCMLYTBHMDX-UWVGGRQHSA-N 269.305 -0.565 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@@H]2COCC[C@@H]21 888771620 XRMAUUOZMDCBEK-WDEREUQCSA-N 296.283 -0.192 5 20 CBBD Cc1cc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)on1 991278561 IKOLSHMKPAVVOH-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD O=C(NC1CN(C(=O)c2ccnnc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991291347 VKOYNAXXPBILSF-NXEZZACHSA-N 291.267 -0.918 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC1CSC1 1119905680 GEXTXKNYYRUUTG-UHFFFAOYSA-N 269.282 -0.012 5 20 CBBD COC(=O)C(C)(C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319473591 KAPOAHHAHTZOPW-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD NC(=O)C[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1323419341 PELVHHJSYUFTEA-KOLCDFICSA-N 297.315 -0.651 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C(=O)O1 1326800271 QBOGKYSGDLRLND-INEUFUBQSA-N 254.202 -0.248 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCc1cnc(O)[nH]1 1327918590 YLOVDPJCTGSFOX-UHFFFAOYSA-N 280.244 -0.074 5 20 CBBD NCCc1noc(CCn2cc([N+](=O)[O-])cn2)n1 1329432261 DHWLWTOGVCKSRD-UHFFFAOYSA-N 252.234 -0.082 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1N 1329483113 JIDJDDCNDJNLRG-HTQZYQBOSA-N 268.277 -0.618 5 20 CBBD O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@H](O)CO 1593473815 BKMBKFVCLXUDOC-ZETCQYMHSA-N 280.244 -0.460 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 185940702 YIDWWUAYLZWQMB-UWVGGRQHSA-N 298.299 -0.210 5 20 CBBD O=C1CN(CCNC(=O)c2ccccc2[N+](=O)[O-])CCN1 272659217 HONLJYCDFQKLLZ-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD CN1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1=O 330864932 RIGJWMKUZFJAPF-SECBINFHSA-N 294.267 -0.897 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](C(N)=O)C(C)(C)C 359507945 YIZLRFBKXCKXLY-QMMMGPOBSA-N 283.288 -0.042 5 20 CBBD Cc1nn(C)c(NC[C@@H]2CNCCN2C)c1[N+](=O)[O-] 394759849 DIKYGYBWCGYWBV-VIFPVBQESA-N 268.321 -0.048 5 20 CBBD COC(=O)C1(C)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 425130203 FUVGDRRMYMERQX-UHFFFAOYSA-N 282.256 -0.187 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592308398 LIUIEOGZDDNTNE-HTRCEHHLSA-N 269.261 -0.494 5 20 CBBD C[C@@H](CC(N)=O)NS(=O)(=O)c1ncccc1[N+](=O)[O-] 594756582 BHOSAMUCDKPYET-LURJTMIESA-N 288.285 -0.468 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1c1c([N+](=O)[O-])ncn1C 610076587 XBVVSDKRUQZITF-SSDOTTSWSA-N 274.302 -0.048 5 20 CBBD C[C@@H]1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C[C@@H]1O 825000315 OLGHSYYWSQEUNN-SVRRBLITSA-N 291.271 -0.013 5 20 CBBD O=[N+]([O-])CCNC1CCN(S(=O)(=O)C2CC2)CC1 905162870 YGEMLNNYXHUICQ-UHFFFAOYSA-N 277.346 -0.191 5 20 CBBD COCCC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062989064 MSUMNQPMQCGAAN-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD CNC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1116068485 OHCCQZMMXBLJKB-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD Cc1[nH]nc(C(=O)NCc2ncn(C)n2)c1[N+](=O)[O-] 1253990613 WSIFKCIDKOTTGE-UHFFFAOYSA-N 265.233 -0.315 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321243881 PWELOCJORGASHI-UHFFFAOYSA-N 285.260 -0.848 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1N 1329483116 JIDJDDCNDJNLRG-YUMQZZPRSA-N 268.277 -0.618 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@]2(C)CNCCO2)n1 1579970344 VABCRCIRULARDE-LLVKDONJSA-N 283.288 -0.563 5 20 CBBD O=C(NCC[C@H](O)C(=O)O)c1cc([N+](=O)[O-])ccc1O 1608450311 QKDQJIHKQHCIHQ-VIFPVBQESA-N 284.224 -0.134 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1cnc([N+](=O)[O-])c1 26980561 AZWMGXCMCGITNK-SSDOTTSWSA-N 285.260 -0.348 5 20 CBBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)NC(N)=O 28856259 PXMKFUUGQWQQBK-YFKPBYRVSA-N 296.239 -0.083 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC(=O)NC1 230688675 JFDBDSVUVQSDTP-LURJTMIESA-N 279.256 -0.420 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1COCCN1 236080621 JNWCYMVTVVJKPC-QMMMGPOBSA-N 268.273 -0.349 5 20 CBBD CNC(=O)C(=O)NCCc1ccccc1[N+](=O)[O-] 285334905 UTMZIOMLUHTYOV-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 343722661 MDHUJSVSBKDOBH-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 344895251 PWGIABPHICPZMX-MRVPVSSYSA-N 297.267 -0.079 5 20 CBBD NC(=O)N[C@H](CO)C(=O)NCCc1ccc([N+](=O)[O-])cc1 345237031 DATPYNBNDYBJGD-SNVBAGLBSA-N 296.283 -0.717 5 20 CBBD O=C(NCC1(O)CCOCC1)c1cc([N+](=O)[O-])n[nH]1 353404277 OHQAAXWDYXAOSJ-UHFFFAOYSA-N 270.245 -0.411 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@H](O)C[C@@H]1CO 360187874 CUCAMNRGWWHKRO-HTQZYQBOSA-N 282.256 -0.629 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)Cn2nccc2[N+](=O)[O-])C1 361443678 URYAJSXEJRFDPN-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD Cn1ccc(NCCNC(=O)c2c[nH]nc2[N+](=O)[O-])n1 514675463 SJHFYAUIGBNDSO-UHFFFAOYSA-N 279.260 -0.107 5 20 CBBD Cn1nnnc1Cn1cc([N+](=O)[O-])cc(F)c1=O 573966205 RWVMCQLEAVWOPB-UHFFFAOYSA-N 254.181 -0.533 5 20 CBBD Nc1nc(=NCCCCC(=O)O)[nH]cc1[N+](=O)[O-] 591326873 DEBQJOGUAFMIFA-UHFFFAOYSA-N 255.234 0.056 5 20 CBBD CCN1CC[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 591765802 IUHGJWGZRPYNKR-GHMZBOCLSA-N 297.315 -0.637 5 20 CBBD CNC[C@H](C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 595268619 IKUKQBZDLVBVOG-QMMMGPOBSA-N 270.293 -0.302 5 20 CBBD O=C(Nn1cnnc1O)c1ccc([N+](=O)[O-])c(O)c1 782128867 KPNJHSVHSUHRSX-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD CN(C)CCCNC(=O)Cn1ccnc1[N+](=O)[O-] 918368228 FRDAKHYDSIZRFA-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 973764051 CDQIBQKLEGWVEQ-XZBKPIIZSA-N 277.227 -0.320 5 20 CBBD Cc1cc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)on1 990221517 MJFWBZLEGLMCOY-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD COCC(=O)NCCCNc1ncc([N+](=O)[O-])c(N)n1 1094280312 WHZWACMFWIRQAJ-UHFFFAOYSA-N 284.276 -0.468 5 20 CBBD Cn1cc([C@@H](O)CNC(=O)c2n[nH]cc2[N+](=O)[O-])cn1 1320365576 KCHFGQRMUKXAIH-QMMMGPOBSA-N 280.244 -0.485 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C(=O)O)O1 1330169231 WBTYPPJKZOBZAE-BDAKNGLRSA-N 284.272 -0.035 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)O[C@H]1CCS(=O)(=O)C1 1341869329 SXWHCAGROCULLM-ZETCQYMHSA-N 289.269 -0.478 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCn2cccn2)c1 49076338 CHGCKZXXBNRQNL-LLVKDONJSA-N 280.288 -0.362 5 20 CBBD CC(C)NC(=O)CN(C)c1ncc([N+](=O)[O-])c(N)n1 76267382 WABAQHXHQYKMNG-UHFFFAOYSA-N 268.277 -0.072 5 20 CBBD CC(=O)NCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 102486796 MLRCPQXSRKTDOF-UHFFFAOYSA-N 283.288 -0.221 5 20 CBBD Cc1cc(C(=O)NCC(N)=O)c(N)c([N+](=O)[O-])c1 118493357 NEHZTWUFADEFSW-UHFFFAOYSA-N 252.230 -0.299 5 20 CBBD O=C(Nc1ccncc1[N+](=O)[O-])NC(CO)CO 272766646 WNWWGUCOVWGYFV-UHFFFAOYSA-N 256.218 -0.536 5 20 CBBD CCC[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 343456331 QSOOSGUFUWKGSG-LURJTMIESA-N 269.261 -0.288 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC(=O)NC1CC1 354215698 AIKWDKWERJYDJU-UHFFFAOYSA-N 294.267 -0.849 5 20 CBBD CN1CC[C@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 425271304 XWJUOFHJVIEAJF-ZETCQYMHSA-N 280.288 -0.331 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H]2CNC(=O)O2)c1 495778081 SHBAXJMHXRVNFR-ZETCQYMHSA-N 297.223 -0.349 5 20 CBBD CC[C@@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 750587454 XANJGCYVIXATHJ-SNVBAGLBSA-N 269.261 -0.439 5 20 CBBD O=C(O)CCCNC(=O)Cn1cnc([N+](=O)[O-])n1 819429963 JNCYWQCMKIXWFH-UHFFFAOYSA-N 257.206 -0.833 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@H]2CCC[C@H]2O)CC1 839666826 UHYLEGFYOBBUKV-WRWGMCAJSA-N 283.328 -0.291 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCSC[C@@H]1CCO 840402777 NHXPIPQNKIUKHU-DJLDLDEBSA-N 260.315 -0.022 5 20 CBBD CNC(=O)[C@@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 843109839 HFVUUXZECYCNJO-QWRGUYRKSA-N 283.284 -0.675 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2COC[C@H]2O)c1 843117608 QQTMOTRANDWEHR-GRYCIOLGSA-N 268.269 -0.023 5 20 CBBD CC(=O)N(C)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 1105311896 MWRWAPPCWOPXDA-UHFFFAOYSA-N 268.277 -0.119 5 20 CBBD NC(=O)C1(NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1 1116259242 BPADGMSMAWMVDJ-UHFFFAOYSA-N 267.245 -0.685 5 20 CBBD C[C@@H](CS(C)(=O)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1319718851 YFIANTYIJFAYNR-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCN1C(=O)CNC1=O 1320432750 XDWPGRXFTGCRTQ-UHFFFAOYSA-N 297.227 -0.963 5 20 CBBD O=C(O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 1606201611 VLWRGLLAIVPEKC-QMMMGPOBSA-N 258.234 -0.784 5 20 CBBD NC1=CCN(c2ncc(C(=O)O)cc2[N+](=O)[O-])N1 1608252098 ZVNSSJHDGBSTEP-UHFFFAOYSA-N 251.202 -0.187 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC(=O)NC2CC2)c1=O 29065497 OWSRPSHDWWRBGT-UHFFFAOYSA-N 295.251 -0.178 5 20 CBBD O=C(O)CCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 37434390 OLBGWAHWFHXRFK-UHFFFAOYSA-N 269.213 -0.122 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 134873627 LPFNIIUPLCPMHT-YFKPBYRVSA-N 252.230 -0.219 5 20 CBBD CN(Cc1nnc[nH]1)c1ncc([N+](=O)[O-])c(N)n1 265792697 OIYYNQNLQVHXMV-UHFFFAOYSA-N 250.222 -0.279 5 20 CBBD O=C(NCC(=O)N1CCOCC1)c1ccc([N+](=O)[O-])[nH]1 272030830 PCLNPSNUVYKFPY-UHFFFAOYSA-N 282.256 -0.489 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@@H](C)O 274547077 WXUBQUVXAPFRGW-MUWHJKNJSA-N 298.251 -0.047 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 286284036 CLPHUHGPZPBMKD-UHFFFAOYSA-N 253.218 -0.768 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 344939008 FGRYPDNHWFEJCR-ZCFIWIBFSA-N 282.260 -0.539 5 20 CBBD CO[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1OC 357687599 HHUDFXXPNMNNFR-DTORHVGOSA-N 296.283 -0.061 5 20 CBBD NC(=O)c1ccc(CN=c2nc(N)c([N+](=O)[O-])c[nH]2)cn1 441811407 FCGJDORDKQQWLS-UHFFFAOYSA-N 289.255 -0.505 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](O)[C@@H](N(C)C)C2)c1[N+](=O)[O-] 579528883 MGOGTQVIRQEJMG-IUCAKERBSA-N 297.315 -0.616 5 20 CBBD CNc1nccc(C(=O)N2CC[C@@](F)(CO)C2)c1[N+](=O)[O-] 594356899 HLRCPWLDPHRDJG-LBPRGKRZSA-N 298.274 0.578 5 20 CBBD C[C@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(=O)NCCF 596228234 ZDTMJRJDSNDEFT-LURJTMIESA-N 271.252 0.458 5 20 CBBD CNS(=O)(=O)CCn1cc([N+](=O)[O-])ccc1=O 598709756 YQSAHQHEWWYCAO-UHFFFAOYSA-N 261.259 -0.694 5 20 CBBD C[C@@]1(C(N)=O)CCN(Cn2nccc2[N+](=O)[O-])C1 794708478 BRCDISTUFIIWQC-SNVBAGLBSA-N 253.262 -0.054 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](O)C(=O)NC 795174195 UNSLVUMXILOWSU-SSDOTTSWSA-N 271.277 -0.362 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@H](O)CO 823630045 QIVRMXGPOIAKOK-ZETCQYMHSA-N 280.244 -0.460 5 20 CBBD O=C(O)[C@H](O)C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 833771270 ZGZUTGAWQNLRAC-LLVKDONJSA-N 298.299 -0.051 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](N2CCOC2=O)C1 855505688 NOKFWASJKSJSCY-ZETCQYMHSA-N 295.255 -0.015 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@H]3NCC[C@@H]3C2)c1 923360128 WIEXXRIYPPFYGV-RAIGVLPGSA-N 295.343 -0.164 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cn[nH]c2)C1 954234797 KPLMJSDPEDZIAK-NXEZZACHSA-N 293.283 -0.642 5 20 CBBD O=C(NCCNCc1nnc(C2CC2)o1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126943055 IQYSFSCUOOACIL-RKDXNWHRSA-N 295.299 -0.182 5 20 CBBD C[C@H](O)CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H](C)CO 1320923818 VRZRMYJCWXTFIM-YUMQZZPRSA-N 286.288 -0.468 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1610732869 JHJAYJMSOYYLAR-POYBYMJQSA-N 284.228 -0.632 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccccc1[N+](=O)[O-] 35160309 GWTQVCGMPVRDCU-QMMMGPOBSA-N 268.225 -0.142 5 20 CBBD NC(=O)CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 72904296 OMKVHKCCVPBLEJ-UHFFFAOYSA-N 289.251 -0.004 5 20 CBBD CC[C@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 133428631 SYSNYXRTHUZPPT-ONGXEEELSA-N 285.304 -0.604 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CCNC1 179050135 HRNXMLCODUYZBA-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 193146203 VXDCPRLXELKPAK-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 230696026 IFJWMDJBTUIEHJ-SECBINFHSA-N 293.283 -0.077 5 20 CBBD O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1C[C@H](O)CN1 236538102 PVAVVTBRCFRTKW-IONNQARKSA-N 267.241 -0.038 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 263804761 PBSOWCSVJJBDTH-ZCFIWIBFSA-N 267.245 -0.413 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H]1COC[C@H]1O 290626313 SKUIOHZIIKDOEU-RKDXNWHRSA-N 283.240 -0.473 5 20 CBBD CCCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])n[nH]1 346945559 PMXUXPUZGUIQFN-UHFFFAOYSA-N 255.234 -0.345 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1COCCO1 356450285 BKGUNFCCAXGUJS-SSDOTTSWSA-N 270.245 -0.527 5 20 CBBD COCCN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1 356475977 JFORMEQYMUKCJY-UHFFFAOYSA-N 297.315 -0.268 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 385022059 LTDNASVJXZFUBK-HTQZYQBOSA-N 254.246 -0.227 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 435988396 WNXSCXPXTBQZPH-NSHDSACASA-N 281.272 -0.084 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1COC[C@H]1O 515180475 CLUDOQLVCPKOBQ-RNFRBKRXSA-N 256.218 -0.850 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@H](O)C[C@@H]2CO)n1 592978989 ZGSHZTUOMSWAOD-HTQZYQBOSA-N 297.267 -0.072 5 20 CBBD CCNC(=O)CN(C)C(=O)c1ccnc(NC)c1[N+](=O)[O-] 594241926 JXBDAQNVOWDMHY-UHFFFAOYSA-N 295.299 0.240 5 20 CBBD CN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCC1=O 598294202 BDHVTDIJDQXLLG-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD CC[C@H](O)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599311776 LYIKXTNGOJXQDQ-LURJTMIESA-N 278.290 -0.623 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2CC[C@H](C1)N2 602590411 HILMUUHJHURXBO-OCAPTIKFSA-N 265.273 -0.095 5 20 CBBD CN(C)CCNC(=S)NCCn1cc([N+](=O)[O-])cn1 768480374 QGERDPUHFLYQLT-UHFFFAOYSA-N 286.361 -0.183 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC[C@@H](O)CO 823630043 QIVRMXGPOIAKOK-SSDOTTSWSA-N 280.244 -0.460 5 20 CBBD C[C@@H]1CN(CC[N+](=O)[O-])CCN1c1nccn2cnnc12 930044555 DUSFULRUQACKGU-SNVBAGLBSA-N 291.315 -0.089 5 20 CBBD Cn1ccc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1 990813475 DVHFUYVHNPFUKD-GHMZBOCLSA-N 292.295 -0.369 5 20 CBBD C/C=C(\C)C(=O)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543782 XQTIVIQJVJEZRU-VIXUHMKYSA-N 299.327 -0.445 5 20 CBBD Cn1cc([C@@H](CO)NC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 1116931916 IYLDHSVPDLWKNT-MRVPVSSYSA-N 280.244 -0.485 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NC1CCCC1 1117551546 AKGHQLLHKLKJCX-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD COCc1nc2n(n1)C[C@@H](NCC[N+](=O)[O-])CC2 1120274042 XLSLFJQRXCOFRV-QMMMGPOBSA-N 255.278 -0.394 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1ccncn1 1261132084 XTXHQURAZNABMJ-UHFFFAOYSA-N 289.251 -0.137 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN3CCOC[C@]3(CO)C2)cn1 1516033256 WDFSWQHMOBOVRV-CYBMUJFWSA-N 294.311 -0.127 5 20 CBBD O=C(O)CCNC(=O)CCN=c1cc[nH]cc1[N+](=O)[O-] 1602019081 FAVFNQDFNGFJDN-UHFFFAOYSA-N 282.256 -0.195 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC(CO)C1 1609599446 CMPYAXCSIVMKEP-UHFFFAOYSA-N 277.244 -0.402 5 20 CBBD C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])C(N)=O 10518412 JGLICGWVWBQYCQ-LURJTMIESA-N 273.270 -0.253 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1COCCO1 48809562 OFGHNVVVGCWMPY-QMMMGPOBSA-N 270.245 -0.677 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1C(=O)O 111248043 VSRGCRCMCSRHSK-SFYZADRCSA-N 282.256 -0.030 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1OC 234569725 QTAPVHLYDUQRDI-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD C[C@H]1C(=O)NCCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249071286 RBPBYAPPYNFTEC-GXSJLCMTSA-N 297.315 -0.637 5 20 CBBD CC[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 271011003 ZTRCZUQHSIEYRD-YUSALJHKSA-N 284.316 -0.145 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CNC(=O)C1 330729688 HTNIYRGVDKWQLH-SSDOTTSWSA-N 267.245 -0.896 5 20 CBBD CO[C@]1(CNC(=O)c2cc([N+](=O)[O-])nn2C)CCOC1 359479915 HIFZTQHILYCWBP-NSHDSACASA-N 284.272 -0.136 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC[S@@]1=O 581833795 XCFFYEBKTDJXCT-JLPJYYFKSA-N 298.324 0.165 5 20 CBBD CN(C)C(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 586106872 BYLMLGOWNPWGMP-UHFFFAOYSA-N 296.287 -0.243 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](N2CC[C@@H](O)C2)C1 599940246 NDZACYUSOMZZIC-RKDXNWHRSA-N 295.299 -0.401 5 20 CBBD CC(=O)NC[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 609802870 WESLEDOWJRMEIM-VIFPVBQESA-N 283.288 -0.330 5 20 CBBD CCOC(=O)/C=C/Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 755625246 CXBWKRPMCIGOAQ-ONEGZZNKSA-N 295.251 -0.025 5 20 CBBD CNC(=O)[C@H](O)CNc1nc(C(=O)OC)ccc1[N+](=O)[O-] 804649836 OOSHVQNMYUOVQY-MRVPVSSYSA-N 298.255 -0.705 5 20 CBBD C[C@@H]1[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 806071949 CLZUEGCPGJTRDX-VXNVDRBHSA-N 282.256 -0.046 5 20 CBBD C[C@H](C(=O)O)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 817772431 ZEFAGJXHXAYJSU-VXNVDRBHSA-N 272.261 -0.443 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNOC[C@H]2CCOC2)c1 819255683 CWSOKBDHWHPNSU-GXSJLCMTSA-N 286.288 -0.290 5 20 CBBD O=C(N[C@@H]1C[C@H]2CCCCN2C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839793587 UYYZHSQFUZUIRL-ZYUZMQFOSA-N 267.285 -0.079 5 20 CBBD CC1(C)COC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 846652785 UOQBKFVBWIFJNK-SSDOTTSWSA-N 268.229 -0.001 5 20 CBBD CCCNC(=O)CN1CCC(NCC[N+](=O)[O-])CC1 905035710 OSGTZVNZAPGXIU-UHFFFAOYSA-N 272.349 -0.157 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]c1 993690876 SXTLLXRTYIPBDZ-NXEZZACHSA-N 278.268 -0.380 5 20 CBBD Cc1conc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030293729 QLEBZKJFCONQLY-MWLCHTKSSA-N 280.284 -0.051 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCN([C@H]3CCNC3)CC2)c1 1326692153 DWLZYTKUKGZRGB-LBPRGKRZSA-N 294.359 -0.229 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2COC[C@]2(C(=O)O)C1 1595279089 JJYNLEWXDGXNIK-KCGFPETGSA-N 270.241 -0.789 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 135534260 AQHSEXVFMKCGGK-MRVPVSSYSA-N 283.240 -0.063 5 20 CBBD CN1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 171768758 NDEYDMZAXDBXPW-SECBINFHSA-N 267.289 -0.141 5 20 CBBD NC(=O)NC[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 263955805 LUOYNUMBIMQFTC-ZETCQYMHSA-N 295.303 -0.148 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 270847392 LLIIPDJNRPUGTG-MRVPVSSYSA-N 280.288 -0.072 5 20 CBBD COC(=O)c1cnc(NC[C@@H](O)C(N)=O)c([N+](=O)[O-])c1 281059449 YKWAGOFQLKIYOZ-SSDOTTSWSA-N 284.228 -0.966 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 341736809 LSDKHWVQOLFMEL-QMMMGPOBSA-N 271.204 -0.690 5 20 CBBD CCCNC(=O)CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 350682014 MZGFNVGBADKGQY-UHFFFAOYSA-N 269.261 -0.036 5 20 CBBD COC[C@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 354080928 AFAFLQYDUUDGRK-QMMMGPOBSA-N 287.276 -0.902 5 20 CBBD C[C@@H]1C[C@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 385054514 WQUXHXXPMFQREJ-APPZFPTMSA-N 254.246 -0.227 5 20 CBBD CCC[C@@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 412529947 WQJVVUCSYOXEFR-VHSXEESVSA-N 299.283 -0.053 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 445207101 BTWBDDAQXJXPGG-GFCCVEGCSA-N 296.283 -0.508 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 577624070 DVFKVFZTULLQES-LBPRGKRZSA-N 298.299 0.089 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(c2c([N+](=O)[O-])ncn2C)C1 592003594 ITKYBBXTMRJIBY-JGVFFNPUSA-N 284.272 -0.312 5 20 CBBD C[C@H](N)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 592383464 VXTGDZMWJBZMTG-LURJTMIESA-N 260.275 -0.385 5 20 CBBD NCCN(CCOc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CO 595902237 OHYUHPOGEWZOIY-GFCCVEGCSA-N 299.327 -0.413 5 20 CBBD CCCc1[nH]nc(C(=O)N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 600216978 KOCUZCRQUCCMKH-YUMQZZPRSA-N 284.272 -0.552 5 20 CBBD O=C1CC[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CN1 809025960 JICKZVRGDZQOAI-QMMMGPOBSA-N 268.229 -0.387 5 20 CBBD CC1(C)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](CO)O1 817628358 RYKDPDQMKJGGQG-DJLDLDEBSA-N 258.274 -0.350 5 20 CBBD NC(=O)[C@H]1CCCN1C1CCN(CC[N+](=O)[O-])CC1 930073207 XEQMWOYOBIMLCF-LLVKDONJSA-N 270.333 -0.323 5 20 CBBD CC(C)C(=O)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543304 BSZDJCBFFUNSDW-NXEZZACHSA-N 287.316 -0.755 5 20 CBBD Cc1cnc(N(C)CCNC(=O)CC(N)=O)c([N+](=O)[O-])c1 1099970820 LNCGFEIPQXYYMH-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC2(CCOC2)C1 1324617315 OWPMHBYAARYEBU-UHFFFAOYSA-N 267.245 -0.565 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCCNCC1 1326612125 PDELTMBQFFWZEM-MRVPVSSYSA-N 268.277 -0.555 5 20 CBBD CN1C[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 1525388188 SVSRKDOHOPEJGP-QMMMGPOBSA-N 282.256 -0.045 5 20 CBBD CC1(C(=O)O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 1604502381 CREDZMYEDPDASK-UHFFFAOYSA-N 253.218 -0.122 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cnn(CC(=O)O)c1 1605561380 GODZLCKJUFWOIR-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1(C(=O)O)CCOCC1 1605561904 VUNDILILJYSCNS-UHFFFAOYSA-N 298.255 -0.308 5 20 CBBD Cn1cc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 41159585 WJVRCFBCKIDFAT-LLVKDONJSA-N 280.288 -0.325 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)NCC(=O)O)c1 88147243 OXOXNANPXZGLDW-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD Nc1c(C(=O)N[C@@H]2CCC(=O)NC2=O)cccc1[N+](=O)[O-] 157564907 AVYRYQGQCPNVCX-SSDOTTSWSA-N 292.251 -0.288 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1Cn1nccc1[N+](=O)[O-] 172611550 OFASIGMKOOJVMX-QMMMGPOBSA-N 274.302 -0.132 5 20 CBBD CC(=O)N1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174646557 QSAKHCJODNUABF-GFCCVEGCSA-N 297.315 -0.684 5 20 CBBD NCCNC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 262503785 ITVNIHCGUIDTKM-UHFFFAOYSA-N 298.324 -0.139 5 20 CBBD COCCN(CCN(C)C)C(=O)Cn1ccc([N+](=O)[O-])n1 264188810 OCJDAPNAWWYODA-UHFFFAOYSA-N 299.331 -0.172 5 20 CBBD CC(CO)(CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 274893105 DEGBMEHTEXGVHM-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD Cc1ccc(C(=O)N[C@@H](CO)C(N)=O)cc1[N+](=O)[O-] 286476606 UFZABJJFYMLMQN-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD O=C(NCCN1CCOCC1)c1cc([N+](=O)[O-])cnc1O 298076765 JAMPVQCVNGNCNB-UHFFFAOYSA-N 296.283 -0.243 5 20 CBBD CNC(=O)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 343031723 SRCWIAKBUNHVPJ-QMMMGPOBSA-N 296.287 -0.687 5 20 CBBD NC(=O)NCC(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 345568259 PIPLFNVFROYUBR-UHFFFAOYSA-N 292.255 -0.244 5 20 CBBD COCCOC[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 358686939 UTENSJLCMVPOCG-SECBINFHSA-N 286.288 -0.041 5 20 CBBD COC(=O)[C@H]1CC[C@@H](C(=O)Nc2c([N+](=O)[O-])cnn2C)O1 362165409 FGHMYELFNZXZQJ-JGVFFNPUSA-N 298.255 -0.013 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2C(=O)NCC[C@H]2C)c1[N+](=O)[O-] 443040957 WQBHJKIQBRTZGH-VDTYLAMSSA-N 281.272 -0.119 5 20 CBBD COC[C@@H](CCO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 515179351 JSYATFLTWKMLNO-SSDOTTSWSA-N 284.272 -0.301 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H]1O 570561836 OCSVSMMQHVPSEA-QWRGUYRKSA-N 282.300 -0.320 5 20 CBBD NCCN(Cc1c(F)cccc1[N+](=O)[O-])C[C@H](O)CO 595903524 XJVCOKYWLKTDNZ-VIFPVBQESA-N 287.291 -0.152 5 20 CBBD COC(=O)C[C@@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 599161982 DPVGOGVMNPBABR-SSDOTTSWSA-N 298.255 -0.575 5 20 CBBD Cc1cc(=O)n(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 611181609 VRACSGLGJGTAFK-JTQLQIEISA-N 279.256 -0.282 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2C[C@@]2(CO)C1 783790023 VXUBNKDUDVTHRD-KWQFWETISA-N 266.257 -0.368 5 20 CBBD O=C1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCCN1 796001145 SUPLKOWSOXPJER-UHFFFAOYSA-N 253.218 -0.720 5 20 CBBD CCONC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 848242790 OWTZNWNZHPSSSH-UHFFFAOYSA-N 283.244 -0.631 5 20 CBBD C[C@H]1CN(c2c([N+](=O)[O-])cnn2C)C[C@H](CO)O1 893416342 IESJUYVZMQLHIF-JGVFFNPUSA-N 256.262 -0.086 5 20 CBBD CCOCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093465300 POPMHYUTQGQTOC-UHFFFAOYSA-N 284.276 -0.468 5 20 CBBD NC(=O)C(=O)NCCNc1cccc(F)c1[N+](=O)[O-] 1094079689 WJZRRVIUGOSIGG-UHFFFAOYSA-N 270.220 -0.253 5 20 CBBD CCc1noc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1157775643 UDDMDMQELQPRIV-RKDXNWHRSA-N 297.315 -0.107 5 20 CBBD COC1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1319592636 ZCCXJGCKACULPO-UHFFFAOYSA-N 267.241 -0.386 5 20 CBBD O=C(NC[C@@H](CO)[C@@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1322483762 HCBZSKVQTRLASQ-SFYZADRCSA-N 284.272 -0.307 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN[C@H]3C[C@@H]32)n1 1579970214 RXYHLEXMNDDBGP-BQBZGAKWSA-N 287.301 -0.937 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]1(CC(=O)O)CCOC1 1608159075 KGVFANXBRJJDAH-LLVKDONJSA-N 298.255 -0.308 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])C(N)=O 10518415 JGLICGWVWBQYCQ-ZCFIWIBFSA-N 273.270 -0.253 5 20 CBBD COc1cc(C(=O)NCC(N)=O)ccc1[N+](=O)[O-] 109120000 RMFCQTWVORSHBU-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD NC(=O)CCCOC(=O)CCn1cc([N+](=O)[O-])cn1 177052202 HOYXFBCHXNJCQJ-UHFFFAOYSA-N 270.245 -0.010 5 20 CBBD CCN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 286075100 MRTNFZPVMKWKQL-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)N(C)C 298868972 SOTHFAFGPDLKLI-QMMMGPOBSA-N 255.278 -0.142 5 20 CBBD Cn1c(C(=O)NCCNc2cnccn2)ccc1[N+](=O)[O-] 341909830 JPVWFKJCNFNGSV-UHFFFAOYSA-N 290.283 0.565 5 20 CBBD O=C(N[C@H]1C=C[C@H](CO)C1)c1cc([N+](=O)[O-])n[nH]1 354065067 PFLIMNYCHZOURO-BQBZGAKWSA-N 252.230 -0.015 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H]1CO 357649659 FCBWKJRIHJQEHL-RNFRBKRXSA-N 253.262 0.032 5 20 CBBD COC[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)OC 357856845 URSQTYXHGKZURB-SSDOTTSWSA-N 272.261 -0.281 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCn1cncn1 520530809 PXUIFOCIYKDKIH-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD CN1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 554857421 NCLUEUGIZZTOQE-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@H](O)CO 592430495 UVOYBECDTVDNPI-UWVGGRQHSA-N 286.284 -0.723 5 20 CBBD Nc1ccc(N[C@H]2CCCN(CCO)C2=O)nc1[N+](=O)[O-] 596197138 UGDXZDBNSQKLMT-VIFPVBQESA-N 295.299 -0.033 5 20 CBBD C=CC(=O)NCCNC(=O)Cn1ccc([N+](=O)[O-])n1 732100037 NRXCCIZRBNDFAU-UHFFFAOYSA-N 267.245 -0.790 5 20 CBBD CCOCCONC(=O)Cn1cc([N+](=O)[O-])cn1 772690950 HRZRJKXDVVBDDW-UHFFFAOYSA-N 258.234 -0.124 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 819889438 OPXYBYUICUAJHZ-SSDOTTSWSA-N 283.240 -0.312 5 20 CBBD O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CC(O)C1 827042592 UIYGTKRDDAFMDP-SNVBAGLBSA-N 252.226 -0.169 5 20 CBBD CCN1CC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 849699129 BEWQYRCPGMTTDO-MRVPVSSYSA-N 282.256 -0.045 5 20 CBBD CN[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1118085890 MWXYIZINSQNUMU-SSDOTTSWSA-N 254.250 -0.993 5 20 CBBD CNC(=O)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 1252097307 KQWMDNMWMQNMCV-UHFFFAOYSA-N 288.285 -0.644 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CCNC1=O 1253923039 PIYFQYCFHUWMTP-LURJTMIESA-N 267.245 -0.711 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCc2nn[nH]c2C1 1255223933 JJBHQDGSYFKMBR-UHFFFAOYSA-N 291.271 -0.116 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCn1ccnc1 1321849785 YJOHCVGGFCFODB-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCNC1=O 1321915122 NOFLFOWHPKQZJN-LURJTMIESA-N 253.218 -0.722 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2CNC[C@@H]2C1 1326400176 GKCLDBZEHHCCSB-OCAPTIKFSA-N 265.273 -0.380 5 20 CBBD C[C@@H](CN)NC(=O)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1328773033 SSDCYJHGJSXNRU-QMMMGPOBSA-N 292.295 -0.100 5 20 CBBD CS(=O)(=O)NCCCNC(=O)c1ccc([N+](=O)[O-])o1 44706194 WYCQTJSWECQTRD-UHFFFAOYSA-N 291.285 -0.143 5 20 CBBD Nc1c(C(=O)N2CCN(CCO)CC2)cccc1[N+](=O)[O-] 87083811 NVQRKGDQCCFKKL-UHFFFAOYSA-N 294.311 -0.073 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228688362 CZUXIJKRFVIWII-KCJUWKMLSA-N 284.272 -0.553 5 20 CBBD C[C@H]1C[C@@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262110492 ZZWFODCPXIXAMR-UWVGGRQHSA-N 294.311 -0.048 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262421815 FPQZMSRUAOICEJ-ZCFIWIBFSA-N 269.213 -0.654 5 20 CBBD C[C@@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 267277505 OBOZHPHXHYBPHI-RXMQYKEDSA-N 252.234 -0.708 5 20 CBBD O=C1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CCN1 272237735 SIGYUTHEWQSXKS-UHFFFAOYSA-N 293.235 -0.105 5 20 CBBD CC(C)c1[nH]nc(C(=O)N(C)C[C@H](O)CO)c1[N+](=O)[O-] 273950477 YFEOGTRQMIQSAU-ZETCQYMHSA-N 286.288 -0.134 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1COC[C@H]1O 296745518 AVPLYTMBALGWBS-MWLCHTKSSA-N 281.268 -0.117 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CCNC1=O 340483060 DDFSBLBXZMNGMJ-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])NCCCN1CCCC1=O 340674859 KYUATIVTCKTRDN-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD COC[C@](C)(CCO)NC(=O)c1cc([N+](=O)[O-])nn1C 360670726 YZYYFQAASMRQGU-NSHDSACASA-N 286.288 -0.154 5 20 CBBD NC(=O)CCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 444852182 BEDGPRPVECHPGT-UHFFFAOYSA-N 268.229 -0.309 5 20 CBBD C[C@H](CCO)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 593879683 JJPJFMDWWBFQHI-SECBINFHSA-N 283.284 -0.014 5 20 CBBD O=C(CNc1ccnc(O)c1[N+](=O)[O-])N1CCOCC1 596182405 CEYZHUSTDMMCON-UHFFFAOYSA-N 282.256 -0.034 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NC(CO)CO 787198063 JUTRWNSTGPOMBV-UHFFFAOYSA-N 255.230 -0.740 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)O1 808204762 PMHWODMBXCYJQR-NKWVEPMBSA-N 268.229 -0.389 5 20 CBBD O=C(NC1CC1)[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839685305 BWBAGQZLXMQLQF-OPRDCNLKSA-N 267.285 -0.079 5 20 CBBD COC(=O)CCCS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842308001 SWMYDFHCPHKDDP-RNFRBKRXSA-N 294.285 -0.949 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCOCC(=O)O 1118974680 JRMAQVMCUNEBGD-UHFFFAOYSA-N 272.217 -0.841 5 20 CBBD CN1C[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 1122870186 DZNSSBTWKUBSIL-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD COC[C@H](CCO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1319248165 LTFZJKWVBRYQPK-ZETCQYMHSA-N 272.261 -0.246 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CN(C)CCO1 1341460154 LRGNAWMWZPVVMB-WCBMZHEXSA-N 297.315 -0.223 5 20 CBBD Cn1cc(CN2CCC[C@@H](O)[C@@H]2C(=O)O)c([N+](=O)[O-])n1 1600952131 UGCMIJBLGGNHNE-RKDXNWHRSA-N 284.272 -0.262 5 20 CBBD COCCCN1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1754575479 UVZZABQBPQDUOU-GHMZBOCLSA-N 271.317 -0.169 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(=O)NC1CC1 68564490 JMKWRPZOTILSLD-UHFFFAOYSA-N 295.299 -0.115 5 20 CBBD COCCNC(=O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 157529751 OCCXIDFTRBFMSO-LBPRGKRZSA-N 297.311 -0.020 5 20 CBBD NC(=O)CCNC(=O)COc1cccc([N+](=O)[O-])c1 173020406 ARIWNWWWQJTELZ-UHFFFAOYSA-N 267.241 -0.035 5 20 CBBD COC[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 280087681 SXRBEOONLJTEGZ-SSDOTTSWSA-N 271.229 -0.568 5 20 CBBD NC(=O)[C@H](CO)Nc1ncnc2sc([N+](=O)[O-])cc12 343296298 YLQWGCFGVLGPDV-YFKPBYRVSA-N 283.269 -0.142 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCO1 343877171 NKSVVJBRGHTJKM-SSDOTTSWSA-N 298.255 -0.360 5 20 CBBD O=C(N[C@@H](CO)[C@H]1CCCO1)c1cc([N+](=O)[O-])n[nH]1 355459081 SVWSYQDZKAEXCY-JGVFFNPUSA-N 270.245 -0.412 5 20 CBBD C[C@H](O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357517184 SXQWYKYECSTFRZ-LURJTMIESA-N 254.246 0.272 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 362357374 FKLIRLYUOQEISJ-IONNQARKSA-N 297.267 -0.083 5 20 CBBD COC(=O)N1CC(NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 496198639 GRZYDVQQZIQFAD-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD C[C@@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cc(F)c2=O)C1=O 517144969 RVGXNJIMNVHXCS-LURJTMIESA-N 298.230 -0.164 5 20 CBBD C[C@H](C(=O)NC[C@@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1F 597584356 FSBPWHKPUJNTNO-QUBYGPBYSA-N 299.258 -0.200 5 20 CBBD CCNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 731647146 ITPFTPGAYSQPDK-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD NC(=O)CN1CCCN(c2ncc([N+](=O)[O-])cn2)CC1 760487302 MZANGJQQGFTSNS-UHFFFAOYSA-N 280.288 -0.618 5 20 CBBD CC(=O)NCC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 764486895 JILSYUPUCRWOLC-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD O=C1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1 823729738 JYHOQSTUTSPCQG-LLVKDONJSA-N 279.252 -0.413 5 20 CBBD C[C@H](CC(=O)O)C(=O)OCCn1cnc([N+](=O)[O-])n1 827342646 XIAMSFRNISOWLD-ZCFIWIBFSA-N 272.217 -0.160 5 20 CBBD Cn1ncc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1031662189 WLEDMLBJYXPJBR-GHMZBOCLSA-N 294.315 -0.972 5 20 CBBD CN1CCN(C(=O)CNC(=O)c2ccc([N+](=O)[O-])o2)CC1 1349638373 PORIFQJORLILLW-UHFFFAOYSA-N 296.283 -0.308 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 1349796371 KSUCAVSTLPPAMM-WDSKDSINSA-N 269.217 -0.994 5 20 CBBD C[C@H](CCO)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 97440675 RXPMVWDLWYDFJD-MWLCHTKSSA-N 272.305 -0.240 5 20 CBBD C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@H](CO)O1 190111427 YBLLSBAKEAUGCJ-VHSXEESVSA-N 270.289 -0.127 5 20 CBBD Nc1ccc(C(=O)N[C@H]2CNC(=O)C2)cc1[N+](=O)[O-] 226711706 NZEJBMQXPXDMKF-SSDOTTSWSA-N 264.241 -0.205 5 20 CBBD Cn1ccc(CCNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 227227829 POVWJVFOKXVPBO-GFCCVEGCSA-N 294.315 -0.282 5 20 CBBD CC(C)[C@@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 269241027 CQBTYRUURQGKGZ-JTQLQIEISA-N 282.300 -0.144 5 20 CBBD O=[N+]([O-])c1ccc(N2CC(O)C2)nc1N1CC(O)C1 277432792 LYKYASMDZVEDMA-UHFFFAOYSA-N 266.257 -0.648 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CC[C@H](O)[C@H]3C2)c1 344067562 PVEHDEWHQRQEBL-RYDUCSDGSA-N 296.327 -0.145 5 20 CBBD CCN(C[C@H](C)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 352233369 YDVRWVYYOVPLSP-ONGXEEELSA-N 272.305 -0.145 5 20 CBBD Nc1noc(CCNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 359017384 JBRCUAKHLXOFDW-UHFFFAOYSA-N 293.243 -0.259 5 20 CBBD NC(=O)c1ccc(NCCn2cc([N+](=O)[O-])cn2)nc1 361062487 MEERLMNMAWGCBX-UHFFFAOYSA-N 276.256 0.397 5 20 CBBD COC[C@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 431862208 XKWZJZCVEMELOV-MRVPVSSYSA-N 283.244 -0.642 5 20 CBBD O=C(NC[C@@H]1CNC[C@H]1O)c1ccc(O)c([N+](=O)[O-])c1 436731149 NYMHMYPRAYYFBR-GZMMTYOYSA-N 281.268 -0.390 5 20 CBBD CO[C@H]1COCC[C@@H]1CN=c1nc(N)c([N+](=O)[O-])c[nH]1 450694057 NQVXCUKKSYRHRE-APPZFPTMSA-N 283.288 -0.148 5 20 CBBD CC1=NNC(=O)[C@@H]1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 552011147 YZQQWRRRKRDKFW-ZCFIWIBFSA-N 280.244 -0.440 5 20 CBBD COC(=O)[C@H]1CC[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 562615452 IOAQHLZORJFCGM-JGVFFNPUSA-N 297.271 -0.356 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cn1C 567340068 ZZZAPXOCARWQMU-UHFFFAOYSA-N 283.288 -0.018 5 20 CBBD O=C(NCCN1CCCC1=O)c1c[nH]nc1[N+](=O)[O-] 576048310 NGUBMKLJVOHWCU-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD CN(CCO)Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 594650189 UXLXZPSORMVXIB-UHFFFAOYSA-N 278.272 -0.005 5 20 CBBD C[C@@H](O)C1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 598383668 IKQLFELZFFRYTE-SSDOTTSWSA-N 254.246 -0.179 5 20 CBBD Nc1nc(N2CCN3CC[C@H]2C3)ncc1[N+](=O)[O-] 599084447 XQDZMLVRIPHFLQ-ZETCQYMHSA-N 250.262 -0.139 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1 609531296 NJQSGJQSFRSCAK-LLVKDONJSA-N 295.343 -0.091 5 20 CBBD COCCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839666451 NDVRNRPPBOLDOJ-IVZWLZJFSA-N 257.290 -0.512 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN(CCCO)CC1 892164441 DFHWKACUFAJPOE-UHFFFAOYSA-N 269.305 -0.167 5 20 CBBD CC(=O)N[C@H]1[C@@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@@H]21 1060373302 IDRFVBZHNPVILY-QMSLJYSESA-N 278.272 -0.462 5 20 CBBD COCCC(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1099891096 GQQWFJLAPJAAKG-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD COC(=O)NC1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1321238925 DSLNYEYFFPSOKQ-JTQLQIEISA-N 299.287 -0.808 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NN1CC(=O)NC1=O 1322201629 XLEPCOAXAQWGOR-UHFFFAOYSA-N 296.243 -0.927 5 20 CBBD CN(CCNS(C)(=O)=O)C(=O)c1ccc([N+](=O)[O-])[nH]1 1339016829 GIVUCAJNHFJAHW-UHFFFAOYSA-N 290.301 -0.456 5 20 CBBD Nc1c([N+](=O)[O-])cnn1Cc1nnc2n1CCOC2 1344479754 WOQVGPOLJZQHND-UHFFFAOYSA-N 265.233 -0.457 5 20 CBBD O=C(O)[C@H](CO)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1574817381 BPOOJTNRCFGWLC-IUCAKERBSA-N 284.224 -0.810 5 20 CBBD O=C(NCCc1cccc([N+](=O)[O-])c1)c1n[nH]c(=O)[nH]1 89912498 CQUDWZHEFPUYLT-UHFFFAOYSA-N 277.240 -0.021 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCOCC1 130608518 KTHREEDLFTZMDV-UHFFFAOYSA-N 269.261 -0.167 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CCN(CCO)CC2)n1 166687195 QJWYWOHGULDERY-UHFFFAOYSA-N 296.283 -0.198 5 20 CBBD CCCCN(CC(N)=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173537828 XVTQNVMAPZYHRG-NSHDSACASA-N 299.331 -0.260 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC[C@@H]1CCNC1 178944634 MATNGUVWDWINDL-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD COC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 234756210 MSHALYQRCXXJEO-ZETCQYMHSA-N 257.246 -0.330 5 20 CBBD CN(CCOCCO)C(=O)CCn1cc([N+](=O)[O-])cn1 282080272 FQJYZIBWQUQCOX-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD Cn1cncc1C(=O)NCCn1cc([N+](=O)[O-])cn1 349100774 VPVMOMNQKKIMTO-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 351937475 OEJOPVKHUQJOOY-QMMMGPOBSA-N 284.272 -0.301 5 20 CBBD CC(C)(C(=O)N[C@H]1[C@@H]2CNC[C@@H]21)n1cc([N+](=O)[O-])cn1 495177378 ZTICZKKPEWMBRF-MYJAWHEDSA-N 279.300 -0.140 5 20 CBBD O=C(NC[C@@H]1CCCNC1=O)c1cc([N+](=O)[O-])cnc1O 590333500 PVBHXXIMMXIWHO-ZETCQYMHSA-N 294.267 -0.049 5 20 CBBD NC(=O)c1cc(N2CCNC(=O)C2)ccc1[N+](=O)[O-] 596050033 NBAZCBZDNJSRKM-UHFFFAOYSA-N 264.241 -0.370 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CCCNC2=O)c1[N+](=O)[O-] 619868209 ZVXBPIFBAHTZOF-ZETCQYMHSA-N 281.272 -0.118 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 748918366 WFBHOGIKSBOJOT-ZCFIWIBFSA-N 269.213 -0.827 5 20 CBBD CC[C@H](OC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 781668394 SIXQHMDBQJBCAE-ZETCQYMHSA-N 268.229 -0.007 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 783762713 UQRODWZWQIGWOM-SSDOTTSWSA-N 294.267 -0.002 5 20 CBBD O=C1CN(NC(=O)c2ccccc2[N+](=O)[O-])C(=O)N1 790260611 RLMYTAAMMNSYCP-UHFFFAOYSA-N 264.197 -0.209 5 20 CBBD NC(=O)C[C@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 808227277 AMIWNRLXJDIMNV-MRVPVSSYSA-N 253.262 -0.054 5 20 CBBD CN(CCC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 818463016 JPPOBRQMQRZTSW-VIFPVBQESA-N 272.261 -0.441 5 20 CBBD O=C(O)C[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 819351433 KNQJCDOGIRTEEQ-QMMMGPOBSA-N 297.271 -0.100 5 20 CBBD O=C(O)C[C@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])cn1 833207408 MNPQXYHQWGJACZ-VIFPVBQESA-N 297.271 -0.934 5 20 CBBD CON1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 854856633 AXGPFMJZMYTEKN-UHFFFAOYSA-N 255.234 -0.363 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCO[C@@H]2COCC[C@@H]21 888772723 NIYNXGNSKXIQDM-VHSXEESVSA-N 296.283 -0.192 5 20 CBBD CN1CCN(C(=O)CN(C)c2ncc([N+](=O)[O-])cn2)CC1 894955198 OTKFYNSUXSECEP-UHFFFAOYSA-N 294.315 -0.405 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCSC1=O 1318840368 OBHSSHSAFMFGKX-RXMQYKEDSA-N 271.258 -0.665 5 20 CBBD NC(=O)C[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 1323484497 WVVKSTYULYNABC-SECBINFHSA-N 267.289 -0.011 5 20 CBBD CN1C(=O)NC2(CCN(CC[N+](=O)[O-])CC2)C1=O 1333730199 PXAWQQUQADSZBZ-UHFFFAOYSA-N 256.262 -0.721 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCO[C@H](COC)C1 1340993659 SLROPTLNIONQKQ-VIFPVBQESA-N 285.304 -0.074 5 20 CBBD C[C@H](N=c1cc[nH]cc1[N+](=O)[O-])C(=O)N[C@@H](C)C(=O)O 1607460483 IXUJJCVHJRIVNR-BQBZGAKWSA-N 282.256 -0.199 5 20 CBBD COCC(=O)N1CCN(c2c([N+](=O)[O-])ncn2C)CC1 32321436 CIPUSOAKVFKGHC-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD CNC(=O)COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 102509427 PZFLYHJHUPBQSO-UHFFFAOYSA-N 270.245 -0.184 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CCO1 112669523 HOHCJRFFCRFCNL-SNVBAGLBSA-N 297.267 -0.053 5 20 CBBD COC(=O)[C@H]1COCCN1CCn1c([N+](=O)[O-])cnc1C 163550805 ABMQXWXSODYRRS-SNVBAGLBSA-N 298.299 -0.026 5 20 CBBD CCN1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 188079772 DHMYMAMNQNONEM-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD CO[C@H]1COC[C@@H]1NCCn1cc([N+](=O)[O-])ccc1=O 290209153 UXCFNCPZJAPKKU-QWRGUYRKSA-N 283.284 -0.240 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCOCC(F)(F)F 342945096 RNXFHCNHPGSWOO-UHFFFAOYSA-N 297.193 -0.119 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[C@H](O)CN1 358803709 SUQBVWKZFYILGX-WDEREUQCSA-N 295.295 -0.058 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1[C@H]2CNC[C@H]12 366526020 HHOCVTWDPQMLDF-IUCAKERBSA-N 279.300 -0.176 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1CCCNC1 428628345 UHQMYKIEACZXKZ-JTQLQIEISA-N 294.311 -0.128 5 20 CBBD CCNC(=O)CN(CC)C(=O)c1c[nH]nc1[N+](=O)[O-] 558737082 WQGGIFOXZFHCCP-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD Cn1ccc(NCCNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 560567976 LRDWBGSOQSLPOT-UHFFFAOYSA-N 279.260 -0.107 5 20 CBBD Cn1c(C(=O)N[C@@]2(C(N)=O)CCOC2)ccc1[N+](=O)[O-] 573979015 DXXBRMNNDXQRSX-NSHDSACASA-N 282.256 -0.693 5 20 CBBD CC(CO)(CO)CNc1ncc([N+](=O)[O-])cc1C(N)=O 590570261 WGFAKBHEGOPELL-UHFFFAOYSA-N 284.272 -0.509 5 20 CBBD Nc1nccc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 594377845 WBXAJKWYMYBNAI-IZLXSQMJSA-N 279.256 -0.434 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1)N1CC(O)(C(=O)O)C1 706480254 UFFPAKAHCGPRKH-UHFFFAOYSA-N 266.209 -0.134 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(Cc2cn[nH]c2)CC1 823012852 GPOULUQEEKLMHC-GHMZBOCLSA-N 279.300 -0.281 5 20 CBBD CCNS(=O)(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839718142 OMUBJTGCUMENDW-DJLDLDEBSA-N 291.329 -0.808 5 20 CBBD C[C@H](O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C)C1 840424862 FGGHTEINJIJZNI-UKKRHICBSA-N 271.317 -0.435 5 20 CBBD COCCN1C[C@H](C(=O)OCCC[N+](=O)[O-])CC1=O 860913927 LQSCDUFOXFQCGO-SECBINFHSA-N 274.273 -0.309 5 20 CBBD CCn1cnnc1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1321706260 GGYLHVUMINUDLV-UHFFFAOYSA-N 293.287 -0.238 5 20 CBBD CS(=O)(=O)N1CC[C@H](CNCC[N+](=O)[O-])C1 1336304112 TXEGTZVXTPLAPD-MRVPVSSYSA-N 251.308 -0.866 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](CO)[C@@H](O)C1 1344550232 WITIINRYZRXFTQ-XPUUQOCRSA-N 270.245 -0.867 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H](C(=O)O)C1 1574812376 IWHVLIPAAHFZLZ-ZKCHVHJHSA-N 297.271 -0.046 5 20 CBBD C[C@H]1NCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 1579500481 HDZUCLTWUFYJJB-RQJHMYQMSA-N 254.250 -0.947 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](F)C(=O)O)n1 1597899595 MNVQTXWTLUSONK-YFKPBYRVSA-N 274.208 -0.036 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@@](C)(CO)C(=O)O)n1 1597899633 NTKAHVOTCHPOGK-JTQLQIEISA-N 286.244 -0.623 5 20 CBBD CNc1ccc(C(=O)N2CC(O)(C(=O)O)C2)cc1[N+](=O)[O-] 1598678656 XERQOYHWPRQVHZ-UHFFFAOYSA-N 295.251 -0.092 5 20 CBBD COCC(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1610240211 AVQAZOPHULGWIJ-UHFFFAOYSA-N 270.197 -0.330 5 20 CBBD O=C(O)CNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 21010817 UDAWAGDQLHZJRT-UHFFFAOYSA-N 276.226 -0.337 5 20 CBBD C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C(N)=O 46176661 ADFWATSDLXJERB-SSDOTTSWSA-N 267.241 -0.036 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 69644165 RBTVWBISZGITAB-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD CN1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1=O 152707803 SLYFEZZILHXPTC-UHFFFAOYSA-N 295.299 -0.173 5 20 CBBD CCCC[C@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 162750755 BFRGHGMUAOGJHK-MRVPVSSYSA-N 270.293 -0.180 5 20 CBBD COC[C@@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 230158136 LLQGATAJPXOIDY-QWRGUYRKSA-N 288.304 -0.861 5 20 CBBD NC(=O)c1ccc(CN2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 236256196 KEEWOZSFFLVXNR-QWRGUYRKSA-N 281.268 -0.769 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](N)C1CC1 237576841 PULNNSSFBWOMFN-VIFPVBQESA-N 267.289 -0.047 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1F)NCCO 268648457 OMAXFLYFSMUGTR-UHFFFAOYSA-N 285.231 -0.428 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCOC1 269067274 DDYRABZPMGMWPU-MRVPVSSYSA-N 254.246 -0.056 5 20 CBBD CN(C)CCO[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 339682421 IKQIZGPCYRDRJR-SECBINFHSA-N 296.331 0.124 5 20 CBBD CCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 343475023 LKQBGOBVJJMFOG-SECBINFHSA-N 296.283 -0.473 5 20 CBBD O=C(N[C@@H]1CCCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 352955772 JBOXMZRXVAJKRK-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD CC(C)c1[nH]nc(C(=O)N(C)C[C@@H](O)CO)c1[N+](=O)[O-] 354163197 YFEOGTRQMIQSAU-SSDOTTSWSA-N 286.288 -0.134 5 20 CBBD CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 357849087 NUSKCVPSLQRPHH-ZETCQYMHSA-N 255.234 -0.829 5 20 CBBD C[C@@H]1CCS(=O)(=O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 365330397 LDZWIWWRNABQNF-IWSPIJDZSA-N 276.314 -0.313 5 20 CBBD CC(C)N1C(=O)C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548748085 NYWRFRUQHXDZSF-ZETCQYMHSA-N 295.255 -0.416 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](CO)C1CC1 771025378 JASAJKVCDCOXQN-JTQLQIEISA-N 281.268 -0.356 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(=O)O 833009675 OAPMJXOGBVUHIL-MRVPVSSYSA-N 269.213 -0.526 5 20 CBBD Cc1ccnn1CC(=O)OCCn1cnc([N+](=O)[O-])n1 860583705 BCKVZQBYCXREBW-UHFFFAOYSA-N 280.244 -0.065 5 20 CBBD CCC(=O)N1CCC(CO)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1080856634 NZGCQNSODBXUQI-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NOCC(N)=O 1254103879 AHZOSMKPGUHORZ-UHFFFAOYSA-N 268.229 -0.217 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1318294740 FAMCCERKTGSGNU-MRVPVSSYSA-N 294.267 -0.910 5 20 CBBD O=C(NCC(=O)N1CCCC1)c1n[nH]cc1[N+](=O)[O-] 1319830859 RGJIJUDRQDNEBU-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1O 1319946702 DNWKXHSGELIWHD-POYBYMJQSA-N 254.246 -0.219 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC[C@H](CO)C1 1321039467 JDVDNIKZUXBNGC-QMMMGPOBSA-N 287.297 -0.007 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1337497044 YYUYUCQTFOJTIT-ZCFIWIBFSA-N 280.248 -0.808 5 20 CBBD O=C(N[C@@H]1CCNC[C@H]1F)c1n[nH]cc1[N+](=O)[O-] 1580617229 OHGZVTOVVAMYOM-PHDIDXHHSA-N 257.225 -0.252 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OC1(C(=O)O)CC1 1601386978 QEKYHEBRLPCNIF-UHFFFAOYSA-N 255.186 -0.048 5 20 CBBD CN1C[C@H](C(=O)O)N(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 1606199471 FXLJAUPQLQWYMZ-MRVPVSSYSA-N 296.239 -0.710 5 20 CBBD COC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)O 1606813071 JOZCDMPIELVZIY-YFKPBYRVSA-N 258.190 -0.853 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610733118 NAXQRHZPLVYDTE-WCTZXXKLSA-N 258.230 -0.912 5 20 CBBD Cn1c(Cn2cc([N+](=O)[O-])ccc2=O)cc(=O)n(C)c1=O 11288092 ZDOVDMVUADISIG-UHFFFAOYSA-N 292.251 -0.798 5 20 CBBD CCNC(=O)NC(=O)Cn1c([N+](=O)[O-])cnc1C 64332073 UITQVIFIULSDSI-UHFFFAOYSA-N 255.234 -0.055 5 20 CBBD Cc1nn(C)c(N2CCN(C(=O)CO)CC2)c1[N+](=O)[O-] 121234030 CEAZIQNTXWAMRO-UHFFFAOYSA-N 283.288 -0.722 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCNC(=O)C1 125747669 GZXTULNLXNNVNM-UHFFFAOYSA-N 281.272 -0.552 5 20 CBBD C[C@@H](CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 180588697 SRFZHZAGVHZANB-ZCFIWIBFSA-N 254.246 -0.070 5 20 CBBD O=C(CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)N1CCCC1 228812138 NKZRDQODZJRENL-NSHDSACASA-N 297.315 -0.636 5 20 CBBD CC(C)(CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cnc1N 230871266 KFHBVKZZQVGCKD-UHFFFAOYSA-N 281.272 -0.044 5 20 CBBD C[C@@H](O)CCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266512027 BMQQXPAEODFRPC-KOLCDFICSA-N 272.305 -0.145 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285991334 PQIQWQMWPPUWSA-RXMQYKEDSA-N 256.218 -0.049 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1ncn(C)n1 286876815 WGBZURAQICUVKR-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ncccc1O 338070901 QSPMYPNFEMABIP-UHFFFAOYSA-N 264.201 -0.074 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(=O)NC1CC1 356117708 NZZDOGUHQQXRHC-UHFFFAOYSA-N 267.245 -0.663 5 20 CBBD O=C(NC[C@H]1CC[C@H](CO)O1)c1cc([N+](=O)[O-])cnc1O 356548894 MOWUAGHIJPWWDY-RKDXNWHRSA-N 297.267 -0.035 5 20 CBBD Nc1nc(N[C@H]2CCc3nnnn3CC2)ncc1[N+](=O)[O-] 420648392 YXXFLWPIYUXRIV-LURJTMIESA-N 291.275 -0.230 5 20 CBBD Nc1nccc(C(=O)N[C@@H]2CC[C@H]2O)c1[N+](=O)[O-] 565492070 PFWAQHOVNONEKD-RNFRBKRXSA-N 252.230 -0.175 5 20 CBBD Cn1cncc1CC(=O)NCCn1cc([N+](=O)[O-])cn1 571235487 TUNMVPWHZFETKV-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD COC(=O)[C@@H]1CNCCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 592553357 JUXMRWJNWOMBIE-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD CN(CCS(C)(=O)=O)c1ncc([N+](=O)[O-])cn1 760519270 HWSDPVBSXVQTML-UHFFFAOYSA-N 260.275 -0.134 5 20 CBBD Cn1c(C(=O)NN2CCCNC2=O)ccc1[N+](=O)[O-] 783601261 VXFUKAPXEFWHCZ-UHFFFAOYSA-N 267.245 -0.007 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 783753638 BMTHJRWSJFCTGD-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD CNC(=O)CN1CCC(C)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1045436126 ITHFTBHYZNYCQE-NXEZZACHSA-N 298.343 -0.632 5 20 CBBD CN1CC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1322133514 MTUAEHUBCOQUKM-MRVPVSSYSA-N 283.244 -0.954 5 20 CBBD CCOC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1324659557 OTZGMPAOZCTERR-UHFFFAOYSA-N 256.218 -0.379 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCc1nccs1 1337661175 FWJHOVOYYPUZNS-UHFFFAOYSA-N 268.258 -0.041 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCOC2(CCOCC2)C1 1338205046 DAQNEZINXFCJKV-UHFFFAOYSA-N 297.315 -0.022 5 20 CBBD CS(=O)(=O)c1cccc(NC[C@@H](O)CO)c1[N+](=O)[O-] 137976135 TVKPLHYCLZVXAJ-SSDOTTSWSA-N 290.297 -0.237 5 20 CBBD C[C@H](O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 161466263 BGZITJXIXUYJHN-QMMMGPOBSA-N 271.277 -0.139 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 227868802 IXLKERXWLSASAT-QMMMGPOBSA-N 253.214 -0.829 5 20 CBBD O=C1CC[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CN1 277765532 RUMTVGNGEHKDLY-SSDOTTSWSA-N 280.240 -0.296 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1COC[C@@H]1O 342431470 JGVUPTVMHLMKKH-RQJHMYQMSA-N 256.218 -0.850 5 20 CBBD NC(=O)NCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 735809679 BJRQUNAWRSJTER-UHFFFAOYSA-N 292.255 -0.131 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@@H](O)C1 862581552 SUFGZNYJTOFETP-RYUDHWBXSA-N 295.295 -0.162 5 20 CBBD Cc1nn(C)c(C(=O)OCC(=O)N(C)C)c1[N+](=O)[O-] 920660783 YZFIPPLBMUWXFR-UHFFFAOYSA-N 270.245 -0.118 5 20 CBBD NC(=O)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])cn2)CC1 1057411925 AXWYWZROROKEFP-UHFFFAOYSA-N 293.283 -0.122 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1nccc(C)c1[N+](=O)[O-] 1100706032 JEIHWRJEKFHAFE-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD CN(CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C1CC1 1116342116 NTHBGCKPWRORJG-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD O=[N+]([O-])c1ncn(CCN2CCCS2(=O)=O)n1 1319327077 RRVWUAPLVYXMND-UHFFFAOYSA-N 261.263 -0.778 5 20 CBBD CCON(C)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323668525 OKNPOSITXMFDNY-UHFFFAOYSA-N 285.260 -0.683 5 20 CBBD NC(=O)C1(NCCn2cc([N+](=O)[O-])cn2)CCOCC1 1328429583 PBZMGXFKVLPJAC-UHFFFAOYSA-N 283.288 -0.585 5 20 CBBD NCCCCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1332450065 KKJXMMSDFXYHRC-UHFFFAOYSA-N 270.293 -0.178 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1601763466 IBECQUXTADMSRJ-PHDIDXHHSA-N 284.228 -0.775 5 20 CBBD O=C(O)c1ccnc(N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 1602479595 IVRLHPXNTWVSCG-ZETCQYMHSA-N 297.223 -0.022 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1610731777 AOSHLRVEYXRTHM-OIBJUYFYSA-N 298.255 -0.772 5 20 CBBD CNC(=O)CN(C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 8225337 KBJPWMPNTVEJGX-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])[nH]1 20215044 VPXYAHMQBOIXOL-VDTYLAMSSA-N 269.213 -0.417 5 20 CBBD Cn1c(C(=O)NCCCN2CCNCC2)ccc1[N+](=O)[O-] 35307416 MJFPMIGQPKUHSH-UHFFFAOYSA-N 295.343 -0.042 5 20 CBBD COC(=O)[C@H]1COCCN1CCn1ccc([N+](=O)[O-])n1 267847595 WAKVQKVPJZQJKD-SECBINFHSA-N 284.272 -0.335 5 20 CBBD COC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 351915215 KSCOUJNDLOKAIC-ZETCQYMHSA-N 283.240 -0.566 5 20 CBBD CN(C)S(=O)(=O)CCCn1ncc([N+](=O)[O-])c1N 353730725 JMMGAAGCCWHITR-UHFFFAOYSA-N 277.306 -0.345 5 20 CBBD COCC[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 356775408 KGYPCRGKMQDJQA-JTQLQIEISA-N 297.267 -0.079 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1C=C[C@@H](CO)C1 360757203 XQMWUYOHKQREAK-SFYZADRCSA-N 266.257 -0.005 5 20 CBBD COC[C@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 382580348 VLQMSGSHKHGYRY-SNVBAGLBSA-N 272.261 -0.695 5 20 CBBD Cn1nnc(CNC(=O)c2cccc([N+](=O)[O-])c2N)n1 398077362 BZKJVGHHRIDZET-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD CC(CO)(CO)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 566924343 OXKVLTMLNDWBCH-UHFFFAOYSA-N 284.272 -0.707 5 20 CBBD COC(=O)CSCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 568417075 QYOFMVKONZQEHB-UHFFFAOYSA-N 288.285 -0.046 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@H](N3CCNCC3)C2)c1 573447191 AZJBEAWLRPQNEX-LBPRGKRZSA-N 294.359 -0.229 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CNC(CO)CO)c1 578651857 MDGMBNLMVCSAJN-LLVKDONJSA-N 286.284 -0.723 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1C[C@@H](O)C1 597410912 YVAZSAKVWJRWHY-OTSSQURYSA-N 267.241 -0.604 5 20 CBBD CNCCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 598916421 YNUWECZGVPLGDR-UHFFFAOYSA-N 266.257 -0.131 5 20 CBBD CCN(OC)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 844066022 CZTQHNFSZXPKGF-UHFFFAOYSA-N 297.271 -0.288 5 20 CBBD CCN1C[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 846461695 OWWCPCLMLCMBAF-DJLDLDEBSA-N 255.274 -0.364 5 20 CBBD O=C(NC(CO)CO)[C@@H](O)c1cccc([N+](=O)[O-])c1 857715676 MKQJBEWRQVSHSO-JTQLQIEISA-N 270.241 -0.902 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](Nc2ccnc(O)c2[N+](=O)[O-])C1 1059393850 NOPBFISNSLIQBG-IZLXSQMJSA-N 295.255 -0.760 5 20 CBBD C[C@H](CS(C)(=O)=O)N(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 1116414184 WZKFHYMAWGQLGD-ZCFIWIBFSA-N 290.301 -0.177 5 20 CBBD Cc1noc(CN2C[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 1327535717 SBBCKWJCGPJVEJ-SFYZADRCSA-N 257.246 -0.324 5 20 CBBD C[C@@](O)(CNC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1593400429 CLXGXXNLHZQUDY-SNVBAGLBSA-N 286.244 -0.867 5 20 CBBD O=C(O)[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccn1 1601664040 BEPOQJAEBZKDRW-VDAHYXPESA-N 265.225 -0.011 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])N[C@H](CO)C(=O)O 19470789 VJSGCCJRVFZFFX-MRVPVSSYSA-N 268.225 -0.301 5 20 CBBD O=C(N[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])c[nH]1 52603286 BQUBXJGRHRSHTQ-LURJTMIESA-N 273.270 -0.160 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 171713772 MQHQBFCFZOSYQV-LLVKDONJSA-N 295.299 -0.226 5 20 CBBD C[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 190119566 GPCDSDBSJPYTOJ-GXSJLCMTSA-N 270.289 -0.127 5 20 CBBD C[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 191860027 FUXKQFXWZKXNME-MWLCHTKSSA-N 298.299 -0.210 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249582287 RPWNIWADJOUSQK-MWLCHTKSSA-N 297.315 -0.685 5 20 CBBD COC(=O)c1cc(C)nc(NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 289819272 ZXJPTYCOQNBCMH-ZETCQYMHSA-N 298.255 -0.657 5 20 CBBD C[C@H](O)C[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330386748 BGPUXRLZEFKYFV-IUCAKERBSA-N 283.288 -0.052 5 20 CBBD COCCOC1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 331527357 MRMCHPRQNQFKOE-UHFFFAOYSA-N 270.245 -0.195 5 20 CBBD COC(=O)[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 338439339 XHKQRZGSVCSNCA-SSDOTTSWSA-N 270.245 -0.283 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1O 351853083 BLSYFAJBKPIBEK-YUMQZZPRSA-N 254.246 -0.370 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1ccccc1[N+](=O)[O-] 354482513 YSUMCDMTLCVVRM-UHFFFAOYSA-N 292.251 -0.124 5 20 CBBD CC(C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nn[nH]n1 354782883 INTPGFVWCFBBAJ-UHFFFAOYSA-N 280.248 -0.644 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)OC[C@@H]2C1 493427701 QETGBYVSWBZXPO-ZETCQYMHSA-N 267.245 -0.031 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(C[C@H]2CNC(=O)O2)c1=O 495935438 OBSGHGOTTVVMLS-SSDOTTSWSA-N 297.223 -0.349 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1ccc([N+](=O)[O-])cn1 516136867 JLLHHLYJGWSQIO-NSHDSACASA-N 281.224 -0.037 5 20 CBBD CNc1nccc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 594375389 COIQOWCFCLIRNB-LJGSYFOKSA-N 293.283 0.025 5 20 CBBD COCC1(N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 597941798 YVTMTPGREQXBQD-UHFFFAOYSA-N 269.261 -0.176 5 20 CBBD CNC(=O)[C@H](O)CNc1nc(C)ccc1[N+](=O)[O-] 758115764 WQCWKDAXGIGEMX-MRVPVSSYSA-N 254.246 -0.183 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCc1nc(O)n[nH]1 774988429 JPBAUQOQVGLDLB-UHFFFAOYSA-N 268.189 -0.491 5 20 CBBD NC(=O)N1CCC[C@@H](C(=O)OCCC[N+](=O)[O-])C1 860912747 CQBODBPKKFNQPC-MRVPVSSYSA-N 259.262 -0.013 5 20 CBBD NC(=O)N1CCC[C@H]1COC(=O)Cn1cc([N+](=O)[O-])cn1 860978533 AMTUTUKMVBBMNC-QMMMGPOBSA-N 297.271 -0.122 5 20 CBBD O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNCC[N+](=O)[O-] 905158089 DEKFYVUMYVKFRN-XWLWVQCSSA-N 279.296 -0.340 5 20 CBBD CCOCCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093520024 JZVHXTJCDJQZAR-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1cnnn1C 1323961697 LTNVUBAUDJRJIK-UHFFFAOYSA-N 280.244 -0.028 5 20 CBBD Cn1cnnc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 1345377810 ADIHDTQQKGKJNH-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD NC(=O)[C@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 1349319595 OTKVMNBICHQMKG-VHSXEESVSA-N 269.257 -0.936 5 20 CBBD NC(=O)c1ccnc(NCCC(=O)O)c1[N+](=O)[O-] 1610640214 VKHSDCKKKLJNSU-UHFFFAOYSA-N 254.202 -0.025 5 20 CBBD NCCNC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 158668644 CQULYECODDGODT-UHFFFAOYSA-N 281.268 -0.017 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H]1C(N)=O 195332877 KDTAYAHSQCBACW-QMMMGPOBSA-N 281.272 -0.424 5 20 CBBD NC(=O)[C@@H](O)CNc1nc2sccn2c1[N+](=O)[O-] 227830771 VQINVEXGQXIUIA-BYPYZUCNSA-N 271.258 -0.438 5 20 CBBD COC(=O)N1CC(NC(=O)Cn2cc([N+](=O)[O-])nc2C)C1 269370338 RWJSQTSBBZPIJV-UHFFFAOYSA-N 297.271 -0.333 5 20 CBBD O=[N+]([O-])c1cc2c(c(CN3C[C@@H](O)[C@H](O)C3)c1)OCOC2 278681827 IWFMSTFTMOEGBU-VXGBXAGGSA-N 296.279 -0.001 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](O)C(N)=O 289747332 ULFGKMNXUFSJDP-ZCFIWIBFSA-N 257.250 -0.622 5 20 CBBD C[C@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)CN(C)C 312446283 CPBKCHOSOFNBEQ-PWSUYJOCSA-N 285.348 -0.061 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352435601 QTDSDPVMCBFUGT-ZCFIWIBFSA-N 253.218 -0.592 5 20 CBBD O=C(CNC(=O)CNc1ccccc1[N+](=O)[O-])NCCO 356523054 WAUGDIHPBBZFKF-UHFFFAOYSA-N 296.283 -0.769 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCO1 428018237 STQXBZIBHHWWBV-JTQLQIEISA-N 295.251 -0.373 5 20 CBBD CNc1nc(C(=O)NCCOCCO)ccc1[N+](=O)[O-] 454631388 NIXZUFZIECBERJ-UHFFFAOYSA-N 284.272 -0.230 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 494649162 QDINYSNUAZLUKT-MWLCHTKSSA-N 298.299 -0.210 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 571418667 ZQISDALKPYDYMP-ZETCQYMHSA-N 293.239 -0.941 5 20 CBBD C[C@@H]1NCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 592224680 OFGSFAVQKKEIRM-WCBMZHEXSA-N 267.289 -0.095 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C)C[C@H]2CN)c1[N+](=O)[O-] 592309009 NBZCPEFHMQMWPC-MRVPVSSYSA-N 282.304 -0.659 5 20 CBBD NC(=O)CNC(=S)NCCNc1ccc([N+](=O)[O-])cc1 727073118 TYQVAVLQSHRTQA-UHFFFAOYSA-N 297.340 -0.044 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)CC(=O)O 738370619 LFTXYJSRQMTWBE-UHFFFAOYSA-N 256.218 -0.357 5 20 CBBD Cn1ncc([N+](=O)[O-])c1-c1nc(N2CCNCC2)no1 823334999 PDJITUJSNLCKKZ-UHFFFAOYSA-N 279.260 -0.212 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCO1 861964152 FZVRRLDEPGEKHS-MRVPVSSYSA-N 256.218 -0.720 5 20 CBBD C[C@@H]1C[C@@H](N)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1326702507 MCGZHRHPFDFFFQ-SFYZADRCSA-N 268.277 -0.476 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NCCSCC(=O)O)n1 1327013118 HQWUEQFLUMOZGX-UHFFFAOYSA-N 288.285 -0.124 5 20 CBBD CN(CCO)C(=O)C(=O)NCCc1ccccc1[N+](=O)[O-] 1327118100 GPQVFFLBPGKCAK-UHFFFAOYSA-N 295.295 -0.296 5 20 CBBD Cn1cnc(C(=O)OCCn2ccc([N+](=O)[O-])n2)n1 1327576068 VYMGVXKUPLJTQZ-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCS(=O)(=O)CC1 1336697551 JBJLEDLGJNSBJX-UHFFFAOYSA-N 260.275 -0.437 5 20 CBBD CONC(=O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1605144160 SDFVHXRZOORLCV-UHFFFAOYSA-N 294.231 -0.741 5 20 CBBD CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 25267273 ZKMPOPCOKHLBTB-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1O 186783733 YWLVQTFFFGLTPC-USWWRNFRSA-N 284.316 -0.145 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 230691881 XVYKSIVTXPGARL-LURJTMIESA-N 279.256 -0.468 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCOC[C@@H]1C(=O)O 262055658 AYMQLPDPYRAMDM-MRVPVSSYSA-N 298.255 -0.588 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 263345540 YXEKHIRTMPZSIH-ZETCQYMHSA-N 283.240 -0.312 5 20 CBBD CCc1[nH]nc(C(=O)NCC(=O)OC)c1[N+](=O)[O-] 263984884 RUAHLOXKFAHZKG-UHFFFAOYSA-N 256.218 -0.217 5 20 CBBD NC(=O)COCCNC(=O)c1csc([N+](=O)[O-])c1 268611766 HJXDCUWWRPGNPZ-UHFFFAOYSA-N 273.270 -0.112 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)NCCO 272372132 HJYIFGGONQIJPJ-UHFFFAOYSA-N 283.240 -0.861 5 20 CBBD Cc1ccc(NC(=O)C(=O)NC[C@H](O)CO)cc1[N+](=O)[O-] 275601478 FSZRZXBCPFBMMU-VIFPVBQESA-N 297.267 -0.689 5 20 CBBD O=C(CCN1C[C@@H](O)[C@H](O)C1)Nc1ccccc1[N+](=O)[O-] 278859174 RXHMSUIAWSLIFG-VXGBXAGGSA-N 295.295 -0.039 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H]1CCNC1=O 283120598 YGPHUWKGGRHZRA-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 298885764 MVTRLBWJJUMXGX-UHFFFAOYSA-N 289.269 -0.530 5 20 CBBD NC(=O)N[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 342772673 YQPNPUTTXVICCC-YFKPBYRVSA-N 267.249 -0.786 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354725979 ULNPQLOCBZHEPQ-CAHLUQPWSA-N 284.228 -0.934 5 20 CBBD Cn1nnnc1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 357110814 RAWKSGLBYMMKPC-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(O)(C(F)F)C1 425010795 OWYGDALPCLYROM-UHFFFAOYSA-N 276.199 -0.370 5 20 CBBD C[C@H](N)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 592475521 LWIYOCAHBALZFA-VHSXEESVSA-N 269.305 -0.161 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 592934653 ZJOSRKZUTXCLMO-RQJHMYQMSA-N 298.255 -0.686 5 20 CBBD CC(C)(C)n1nnc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 594398243 PWMLSTCXIUOECM-UHFFFAOYSA-N 294.275 -0.011 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCOC(=O)C1(C(N)=O)CC1 731767964 UOHMLUPABJMKJZ-UHFFFAOYSA-N 282.256 -0.092 5 20 CBBD Cn1c(C(=O)OCC(=O)NC(N)=O)ccc1[N+](=O)[O-] 761056170 RWNXPJFMTISOGQ-UHFFFAOYSA-N 270.201 -0.715 5 20 CBBD C[S@@](=O)CCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 781447901 OCTPBIJNFWPSAR-GOSISDBHSA-N 272.286 -0.088 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)O[C@H]1CCC(=O)NC1=O 798647092 ZUVOYFKJGOFINL-ZETCQYMHSA-N 294.223 -0.466 5 20 CBBD CCN(C(C)=O)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 967721548 NXJPVGFWUXBWTR-NXEZZACHSA-N 255.274 -0.269 5 20 CBBD O=C(NC1CN(C(=O)C2CC=CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991278209 GDHGLLYNXCZOEC-GHMZBOCLSA-N 279.296 -0.055 5 20 CBBD COc1ccnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1 1126932287 QMERQMLCIAGJIM-VXGBXAGGSA-N 294.311 -0.039 5 20 CBBD Cc1[nH]nc(C(=O)N2CCCN(C(N)=O)CC2)c1[N+](=O)[O-] 1318530928 ISFZJQGDTGETPM-UHFFFAOYSA-N 296.287 -0.147 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H](COC)C(=O)O)c1[N+](=O)[O-] 1597399264 BQRQKQYDEZWVQY-LURJTMIESA-N 286.244 -0.290 5 20 CBBD CC(CO)(CO)NC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1609746078 DGSXSQSWRKMOQK-UHFFFAOYSA-N 298.251 -0.234 5 20 CBBD CC(C)NC(=O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 174708168 PNXFGDJRFXOHRA-NSHDSACASA-N 299.331 -0.391 5 20 CBBD CNc1c(C(=O)NCCOCC(N)=O)cccc1[N+](=O)[O-] 231524516 JDAGYEQWLMSWGR-UHFFFAOYSA-N 296.283 -0.132 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)O1 268543794 SIDBWJSEHKAXLD-RQJHMYQMSA-N 283.240 -0.050 5 20 CBBD COCCN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 330557571 GBVADECWHVPGLH-UHFFFAOYSA-N 297.315 -0.268 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 337418735 SWBBEFVHYIHDCY-SNVBAGLBSA-N 288.329 -0.090 5 20 CBBD CN(CC(N)=O)c1ncc([N+](=O)[O-])cc1C(N)=O 339001869 UNWAZWONTCQQKS-UHFFFAOYSA-N 253.218 -0.990 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 341748996 SWRIEGOIGCYROU-QMMMGPOBSA-N 293.235 -0.083 5 20 CBBD Cc1c(C(=O)N[C@H](CO)C(N)=O)cccc1[N+](=O)[O-] 352994657 WEHYUGDVBPZSDD-MRVPVSSYSA-N 267.241 -0.521 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])nn1C 359514759 IIHIGTJVMQKANO-LURJTMIESA-N 270.245 -0.133 5 20 CBBD CC(=O)NCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 362345411 GCMJNOPQMLGLRZ-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])cn1C 525895133 BHELLPBMKKZOGV-UHFFFAOYSA-N 290.301 -0.788 5 20 CBBD COCC[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(N)=O 538349923 TVQLUOXMEGXIBQ-QMMMGPOBSA-N 284.272 -0.447 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CC[C@@H](CO)[C@H](O)C2)n1 578466857 UTZNJPLECJCDRB-VHSXEESVSA-N 270.289 -0.534 5 20 CBBD CN(C)S(=O)(=O)CCNc1ccnc(O)c1[N+](=O)[O-] 596242186 QGANPXWEOLVIIV-UHFFFAOYSA-N 290.301 -0.001 5 20 CBBD Nc1nc(N2C[C@@H]3C[C@@]3(CO)C2)ncc1[N+](=O)[O-] 782407572 PCGKFETZGLKKKE-WKEGUHRASA-N 251.246 -0.214 5 20 CBBD Cn1nnc(COC(=O)Cn2cc([N+](=O)[O-])cn2)n1 799464671 IJJBWODFGZKFOI-UHFFFAOYSA-N 267.205 -0.942 5 20 CBBD Cn1cc(CN2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cn1 839661669 DTQWVDRQEDWEFQ-VXGBXAGGSA-N 293.327 -0.271 5 20 CBBD CON(C)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 853741147 QZQYLJRSQHLLBM-UHFFFAOYSA-N 269.261 -0.006 5 20 CBBD CNC(=O)CC[S@@](=O)CCn1cc([N+](=O)[O-])cn1 1118224718 OEFQNIIUCBUMJZ-GOSISDBHSA-N 274.302 -0.324 5 20 CBBD CC(C)[C@@H](CO)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319886972 BODWUTNUWIMNGW-SECBINFHSA-N 283.284 -0.110 5 20 CBBD CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 35408830 SAZNMFDGBSBNJA-SSDOTTSWSA-N 256.218 -0.229 5 20 CBBD CNC(=O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 46171797 VJPOEFGLOOYQJV-UHFFFAOYSA-N 273.270 -0.381 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)c1n[nH]cc1[N+](=O)[O-] 136031971 MZPQQKVBKJDMKG-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD Cc1cn(CC(=O)N2CCC[C@@H](C(N)=O)C2)nc1[N+](=O)[O-] 337939077 ZFPAMFMSRXPMCB-SECBINFHSA-N 295.299 -0.176 5 20 CBBD CN(C[C@@H](O)CO)C(=O)Cc1ccccc1[N+](=O)[O-] 355602629 DPJYRLMWHJSWPX-SNVBAGLBSA-N 268.269 -0.051 5 20 CBBD COC[C@@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 525264745 LEGSBEFHJDRMAK-NSHDSACASA-N 286.288 -0.387 5 20 CBBD CNC[C@H](O)CNC[C@@H](O)COc1ccccc1[N+](=O)[O-] 584172816 GZBLCZJEXNWCDC-WDEREUQCSA-N 299.327 -0.496 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])C1(O)CNC1 595922926 MHBRNYFJGVVMRB-UHFFFAOYSA-N 280.284 -0.543 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 597587600 ZNBAVAAHZOIQBY-AXFHLTTASA-N 293.279 -0.339 5 20 CBBD COC(=O)c1ccnc(NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 598620772 DXUDAVBOHVUTFO-LURJTMIESA-N 284.228 -0.966 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN(CCCO)C2CC2)c1 610369665 RRMSYBXJWNOKLV-LBPRGKRZSA-N 284.316 -0.001 5 20 CBBD CC(=O)NCCCOC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748915591 CXKNHGZPMLWYPH-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H]1C 840411081 SZMLJIMGAPQICC-GMTAPVOTSA-N 299.327 -0.253 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H](O)CO)c1 843064566 ZIBTVPFIKWJUDG-MNOVXSKESA-N 256.258 -0.429 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@H]1CCCN(S(C)(=O)=O)C1 860788766 VEENPFFIAUNVPI-BDAKNGLRSA-N 294.329 -0.134 5 20 CBBD CN(CCCNc1ncccc1[N+](=O)[O-])C(=O)C(N)=O 1109601256 ODOBBZQQXMMBAG-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD CCN(C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1)C1CC1 1323904068 CKBDFGVVXOXISL-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD CN(Cc1cnc[nH]1)C(=O)Cn1cnc([N+](=O)[O-])n1 1329349134 FKVNRVQYLYBATQ-UHFFFAOYSA-N 265.233 -0.432 5 20 CBBD CCC(=O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1338058442 WLVAYQIOJPYCFI-UHFFFAOYSA-N 267.241 -0.148 5 20 CBBD CCN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H]1CCNC1 1349899175 ZFWPOKWXWIBAGF-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1600768355 SSFZBJHGJTUOLL-LLVKDONJSA-N 298.255 -0.702 5 20 CBBD Cc1nnc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)o1 1606120667 DEADNENLEXHGOX-UHFFFAOYSA-N 277.204 -0.289 5 20 CBBD CO[C@@]1(C(=O)O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 1777155547 LRFZMDLFMCIXCY-NSHDSACASA-N 284.272 -0.033 5 20 CBBD NC(=O)CNC(=O)COc1ccccc1[N+](=O)[O-] 18188369 SNQOTYFRWQGUMQ-UHFFFAOYSA-N 253.214 -0.425 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1OC 35162684 KKZUAJOPJSRCEU-SECBINFHSA-N 298.251 -0.133 5 20 CBBD NC(=O)c1csc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1 118636208 YZVLPTVDQMBFRK-UHFFFAOYSA-N 296.268 -0.015 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(CO)CCOCC1 230907588 ALKPRACDFMKDGW-UHFFFAOYSA-N 284.272 -0.551 5 20 CBBD CCOC(=O)c1ccnc(NC(CO)CO)c1[N+](=O)[O-] 266303732 YZITYNIORLJQON-UHFFFAOYSA-N 285.256 -0.068 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCOC1 337359649 CJYQVXYXIXXUBB-QMMMGPOBSA-N 267.241 -0.338 5 20 CBBD CN(C)CCn1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 351958136 JIGIHDURLWSNJN-UHFFFAOYSA-N 293.287 0.328 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H](C)O 354698609 TYFSVQDKGMGFBS-WKEGUHRASA-N 298.251 -0.047 5 20 CBBD Cc1[nH]nc(C(=O)NC2[C@H]3CNC[C@H]23)c1[N+](=O)[O-] 495112989 VOTIJAKPEGGBNS-WDSKDSINSA-N 251.246 -0.426 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H](O)C(F)(F)F 591786306 UELWNCPJDIEQPB-INEUFUBQSA-N 297.193 -0.386 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC2[C@H]3CNC[C@H]23)n1 592338426 SQDBQYGAKVMTAO-BQBZGAKWSA-N 265.273 -0.241 5 20 CBBD C[C@H](CNS(=O)(=O)c1cccnc1[N+](=O)[O-])C(=O)O 593943631 NBPXZVFYVMEQTO-ZCFIWIBFSA-N 289.269 -0.011 5 20 CBBD COc1c(C(=O)N[C@@H]2CNC[C@H]2O)cccc1[N+](=O)[O-] 699901907 FJYRQRFIGYQWPR-PSASIEDQSA-N 281.268 -0.334 5 20 CBBD Cc1nn(CCC(=O)NOCC(N)=O)c(C)c1[N+](=O)[O-] 772948723 LDYAADDQYYHEER-UHFFFAOYSA-N 285.260 -0.669 5 20 CBBD CCc1nncn1CCNC(=O)c1c([N+](=O)[O-])cnn1C 1116426453 GEFCETMZBAWPHK-UHFFFAOYSA-N 293.287 -0.088 5 20 CBBD CO[C@@H](CN)Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1 1118102865 LUJDJLXOOSUGBY-ZCFIWIBFSA-N 282.260 -0.106 5 20 CBBD NC(=O)CNCCCCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1178458336 BGDWOGDJCAIKQO-NXEZZACHSA-N 286.332 -0.597 5 20 CBBD CCNC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1261754193 OOEVHQMBEQZXRW-UHFFFAOYSA-N 269.261 -0.497 5 20 CBBD COC[C@@H](O)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1319874967 ASCJETFORPOPER-ZETCQYMHSA-N 272.261 -0.246 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@]2(O)CCOC2)c1[N+](=O)[O-] 1319983521 HSPNPURTJPECBI-LLVKDONJSA-N 284.272 -0.482 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN([C@H]2CCOC2)CC1 1338059867 MHKOWTDRCZSEGN-JTQLQIEISA-N 296.331 -0.497 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 1349796369 KSUCAVSTLPPAMM-PHDIDXHHSA-N 269.217 -0.994 5 20 CBBD C[C@@H](c1nnc(N2CCN(C)C(=O)[C@H]2C)n1C)[N+](=O)[O-] 1350589433 UXSUSBZPUHFPLL-JGVFFNPUSA-N 282.304 -0.180 5 20 CBBD CCNC(=O)CN(CC)C(=O)Cn1cc([N+](=O)[O-])cn1 44670655 AKIQRPUOCIDXKR-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 49098040 XFIBXYMKNIVVIT-SCZZXKLOSA-N 285.304 -0.782 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1c([N+](=O)[O-])ncn1C 331283693 FEOUQRRENGVPIH-UWVGGRQHSA-N 298.299 -0.173 5 20 CBBD CN1C(=O)N[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)CC[C@@H]21 332259413 UTNLCRUMHDLDGW-MNOVXSKESA-N 294.315 -0.111 5 20 CBBD O=C(NC[C@H]1CNC[C@H]1O)c1ccc(O)c([N+](=O)[O-])c1 436731152 NYMHMYPRAYYFBR-LDYMZIIASA-N 281.268 -0.390 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cc(C2CC2)[nH]n1 597777416 FOFDKTWIZGNWSN-UHFFFAOYSA-N 277.244 0.426 5 20 CBBD C[C@H](O)C1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 598383681 IKQLFELZFFRYTE-ZETCQYMHSA-N 254.246 -0.179 5 20 CBBD Cc1nn(C)c(C(=O)OCCN2CCNC2=O)c1[N+](=O)[O-] 729202924 ABGJYYFLDDEFAR-UHFFFAOYSA-N 297.271 -0.181 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CNC(=O)C1 801946626 LTGQGCSNMJTGNU-RXMQYKEDSA-N 282.231 -0.066 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H](N2CCOC2=O)C1 855504238 ZBUPNFQYGDEHMN-ZETCQYMHSA-N 295.255 -0.015 5 20 CBBD CN(CC[N+](=O)[O-])[C@H]1CCN(S(C)(=O)=O)C1 930540458 HIRORWINSIEGKW-QMMMGPOBSA-N 251.308 -0.771 5 20 CBBD O=C(Cc1ccon1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990557041 MDJZRAQYDAQDQK-NXEZZACHSA-N 294.267 -0.791 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnn(C)n1 1116314601 OGSLJEJOZRGIQY-UHFFFAOYSA-N 280.248 -0.348 5 20 CBBD CCc1[nH]nc(C(=O)Nn2cnnc2)c1[N+](=O)[O-] 1116802521 XHGMNIPUMKJLJU-UHFFFAOYSA-N 251.206 -0.144 5 20 CBBD Cn1cc([C@@H](O)CNC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 1319343977 NNZHURDDAQKYGM-VIFPVBQESA-N 294.271 -0.625 5 20 CBBD CNC(=O)C[S@@](=O)CCn1cc([N+](=O)[O-])cn1 1321679006 AJPPKXFKKDMELQ-KRWDZBQOSA-N 260.275 -0.714 5 20 CBBD COC[C@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322721425 WTOAOADUIAWHKH-SECBINFHSA-N 258.234 -0.555 5 20 CBBD NCC1(O)CCN(CCn2cc([N+](=O)[O-])cn2)CC1 1326421319 PUULIKMOBZKCFG-UHFFFAOYSA-N 269.305 -0.423 5 20 CBBD Cc1noc(CN2C[C@H]3C(=O)NC(=O)[C@H]3C2)c1[N+](=O)[O-] 1327535818 SLXMYVYKAIQXIU-KNVOCYPGSA-N 280.240 -0.404 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)Cn1cc(C(=O)O)cn1 1592831559 DFQZZLIFWKMPOU-LURJTMIESA-N 257.202 -0.210 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@H]1C(=O)O 1610648340 RWWYFFAEMKICBX-XCBNKYQSSA-N 295.251 -0.163 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)CC(=O)O 262162442 CXNBOSXKSPIEAF-QMMMGPOBSA-N 297.267 -0.017 5 20 CBBD NC(=O)[C@@H]1CCCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 267317209 NVBRCVJPPHGYAD-RKDXNWHRSA-N 295.299 -0.048 5 20 CBBD NC(=O)COCCNC(=O)c1cc([N+](=O)[O-])ccc1O 272339750 ABYNAFWBKPYFJY-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD CC1(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)COC1 345464898 VXQMROXRACOWNO-UHFFFAOYSA-N 267.241 -0.108 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 362871547 BQYFALMCICJZSW-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD CNC(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1O 412395750 SQMOZXNXLQTOPL-LURJTMIESA-N 282.256 -0.050 5 20 CBBD Cn1cnc(=O)n1C[C@H](O)COc1ccccc1[N+](=O)[O-] 414155276 MVGGUXBYWHGSQM-VIFPVBQESA-N 294.267 -0.070 5 20 CBBD COC(=O)CNC(=O)COc1ccc([N+](=O)[O-])c(CO)c1 428099191 LSVWLYIULMSEKG-UHFFFAOYSA-N 298.251 -0.245 5 20 CBBD O=C(NC[C@@H]1CNCCCO1)c1cc([N+](=O)[O-])cnc1O 519707277 CJYYYHGSOHBVAH-VIFPVBQESA-N 296.283 -0.196 5 20 CBBD CCN(CCO)CCNC(=O)c1cc([N+](=O)[O-])cn1C 546719557 KLTSHSUEOGZTLU-UHFFFAOYSA-N 284.316 -0.023 5 20 CBBD COCC1(O)CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 569139247 YPLOLWMNSUKTEQ-UHFFFAOYSA-N 282.256 -0.595 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)N1 593406364 CERYFOQURNWCNL-VIFPVBQESA-N 299.308 -0.097 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)O[C@H]1CCNC1=O 769965431 CSTMOPRODJVFBW-QMMMGPOBSA-N 253.214 -0.021 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 783759975 LBBSLJAFOZJWHY-ZETCQYMHSA-N 293.283 -0.125 5 20 CBBD O=CN1CCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 830577488 UTNAIWJLKXVAAY-JTQLQIEISA-N 281.272 -0.472 5 20 CBBD CNC(=O)Cc1noc(-c2cc([N+](=O)[O-])n[nH]2)n1 1334079101 ACFZUXJQKQVRHC-UHFFFAOYSA-N 252.190 -0.344 5 20 CBBD NC(=O)[C@H](CO)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] 1349573623 QCTCWTYBJUXBNZ-QMMMGPOBSA-N 285.231 -0.761 5 20 CBBD CNC(=O)CN1CCC(Nc2c([N+](=O)[O-])ncn2C)CC1 25579854 MDPAQLQETZFFIL-UHFFFAOYSA-N 296.331 -0.049 5 20 CBBD CNC(=O)CN1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1 111221016 CBOGNBBTKLSLBM-UHFFFAOYSA-N 296.331 -0.495 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1c1ncc([N+](=O)[O-])cn1 129620483 FROZAAWGEMNPHI-IONNQARKSA-N 254.246 -0.029 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCO1 174701836 DBILEVYEHUGMJI-KOLCDFICSA-N 270.289 -0.127 5 20 CBBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)C(N)=O)c1 227871940 QJTXJGDJVOJTGF-VIFPVBQESA-N 299.308 -0.107 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)NCCF 286016754 RNQWJPCAUUWSQB-YFKPBYRVSA-N 273.224 -0.478 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1COC[C@H]1O 342431468 JGVUPTVMHLMKKH-NKWVEPMBSA-N 256.218 -0.850 5 20 CBBD CCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])n1C 344460452 MTFWGLHYKDADSP-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD C[C@@H](CC(N)=O)Nc1ncc([N+](=O)[O-])cc1C(N)=O 361053265 QKNNZWVFQNNHIJ-YFKPBYRVSA-N 267.245 -0.236 5 20 CBBD COCC(COC)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 388482236 VWRODZOQIVHWLO-NSHDSACASA-N 288.304 -0.597 5 20 CBBD NCC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 428822775 YAQDMYVCGQMPIX-UHFFFAOYSA-N 267.289 -0.011 5 20 CBBD C[C@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)CCO1 522275010 RRWMILNEOUXTOS-QMMMGPOBSA-N 282.304 -0.479 5 20 CBBD CN(C[C@H](O)CNCCn1cc([N+](=O)[O-])cn1)C1CC1 577503494 QXPQQTYGZHMOQT-GFCCVEGCSA-N 283.332 -0.164 5 20 CBBD CC1(C)CN[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 591686785 ZNXODDFVPQFCSS-SECBINFHSA-N 267.289 -0.095 5 20 CBBD COC(=O)c1ccnc(NCc2nnn(C)n2)c1[N+](=O)[O-] 598622447 NEVNGUZGOLXIJN-UHFFFAOYSA-N 293.243 -0.088 5 20 CBBD CS(=O)(=O)NC1CN(c2ncc([N+](=O)[O-])s2)C1 599149736 VJLIYWQBDFQYOD-UHFFFAOYSA-N 278.315 -0.211 5 20 CBBD C[C@H]1CN(C)C(=O)CN1CCn1cc([N+](=O)[O-])cn1 782597714 RWYRXBFSPAJMEW-VIFPVBQESA-N 267.289 -0.046 5 20 CBBD C[C@]1(C(=O)O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 828024250 KHLLJHFWIJTWMN-JQWIXIFHSA-N 298.299 -0.051 5 20 CBBD COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 831134534 QUXXUAVAKFUIBS-QMMMGPOBSA-N 297.223 -0.264 5 20 CBBD CCN1CC[C@@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)C1=O 849704835 PQTFCHVGPGWABK-SSDOTTSWSA-N 283.244 -0.650 5 20 CBBD CC(C)(COC(=O)Cn1nc2n(c1=O)CCCC2)[N+](=O)[O-] 851129679 QNHJNCSOCUQSPA-UHFFFAOYSA-N 298.299 -0.020 5 20 CBBD CCS(=O)(=O)N(C)CCCNCC[N+](=O)[O-] 899870342 MIZFZNVWOBJJNQ-UHFFFAOYSA-N 253.324 -0.476 5 20 CBBD Cn1cc(Cn2cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c2)nn1 1116404569 WIBNNNRPKJNPRJ-UHFFFAOYSA-N 280.200 -0.159 5 20 CBBD O=CN1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1117759571 SZAPJNAWBGMEHN-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD C[C@H](N)[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261492164 SQKJFHHVHARPKG-DTWKUNHWSA-N 282.304 -0.228 5 20 CBBD COCC[C@@H](CO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1321164214 CZIGPWYYPYWKMQ-LURJTMIESA-N 258.234 -0.555 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCOCCO 1340817169 GDYDRKYTUORQMG-UHFFFAOYSA-N 286.288 -0.385 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC(=O)C1CC1 1342194561 ULXVJJLRHLOVFB-UHFFFAOYSA-N 279.252 -0.148 5 20 CBBD CO[C@](C)(C(=O)O)C(=O)OCCn1cc([N+](=O)[O-])cn1 1604461639 LLQVNNVJJBNNNN-SNVBAGLBSA-N 287.228 -0.176 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1 50700104 MWJWZGKUWBQQQD-UHFFFAOYSA-N 264.241 -0.251 5 20 CBBD CC(C)(CNc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 71955533 FDEDVEOMSISGCZ-UHFFFAOYSA-N 254.250 -0.110 5 20 CBBD CN(CCS(C)(=O)=O)Cn1cc([N+](=O)[O-])cn1 76265648 CRAJUNNTCLKUJG-UHFFFAOYSA-N 262.291 -0.275 5 20 CBBD COC[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)OC 230725335 RZSHJNMEXUSYEJ-MRVPVSSYSA-N 284.272 -0.037 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)OC 293979956 KVWASNMZGFXEHF-SSDOTTSWSA-N 271.229 -0.159 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)N(C)C 299522271 PLGMEXSZLFHOCA-SECBINFHSA-N 282.300 -0.177 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 337412278 PJQDPDGIQPKSNG-SECBINFHSA-N 288.329 -0.090 5 20 CBBD O=C(NCCN1CCC1)NCCn1cc([N+](=O)[O-])cn1 337724418 RZKZITGCCITNMZ-UHFFFAOYSA-N 282.304 -0.204 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCc2nn[nH]c2C1 351651442 XUIIAFUZWUWFIU-UHFFFAOYSA-N 290.283 -0.067 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 352981415 AKGGFCCDPLWMEE-SSDOTTSWSA-N 287.659 -0.176 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@](F)(CO)C1 355854233 HDWAFFMZQHJRCK-SECBINFHSA-N 258.209 -0.136 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C 355937855 BWKMTKUGYOUCFS-LURJTMIESA-N 254.246 -0.202 5 20 CBBD CNc1nc(C(=O)N[C@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 455989646 GQHPRASKQNQCON-ZCFIWIBFSA-N 279.256 -0.350 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OC[C@H]1CNC(=O)O1 495582904 DIVPLNRJRHSMNQ-SSDOTTSWSA-N 284.228 -0.249 5 20 CBBD CO[C@H](CN)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 569601210 VXEAAIAJDLJEOB-SECBINFHSA-N 279.256 0.383 5 20 CBBD COC(=O)[C@@H]1CNCCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 592551677 KPHDGDDZSPDIIQ-VIFPVBQESA-N 296.283 -0.100 5 20 CBBD C=CC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 731883683 VSQAVFKRWFQLOR-UHFFFAOYSA-N 294.267 -0.825 5 20 CBBD CONC(=O)c1cc(S(N)(=O)=O)cc([N+](=O)[O-])c1C 735845214 JZWBWYODBDGFNF-UHFFFAOYSA-N 289.269 -0.158 5 20 CBBD NC(=O)CS(=O)(=O)NC(=O)c1cccc([N+](=O)[O-])c1 766923299 QPXKNVQTEYUVCO-UHFFFAOYSA-N 287.253 -0.860 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CNCCO1 818011690 LXBWOCPYKAKGFQ-SECBINFHSA-N 280.284 -0.105 5 20 CBBD O=[N+]([O-])CCNCCN1CCN(c2ncccn2)CC1 1120472815 UFURVRYPEYSOFV-UHFFFAOYSA-N 280.332 -0.535 5 20 CBBD CC(=O)N(C)CC(=O)OCCn1cnc([N+](=O)[O-])n1 1122713040 IIQPIQFBHQPHRF-UHFFFAOYSA-N 271.233 -0.792 5 20 CBBD O=C(NCCc1nnc(S)o1)c1n[nH]cc1[N+](=O)[O-] 1261369727 LIRUHNFMILKIOX-UHFFFAOYSA-N 284.257 -0.038 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1324659980 RICVDVGPJAOREC-LURJTMIESA-N 269.261 -0.417 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@H]2CCNC2)c1=O 1328181063 GHKCINAYINWKOJ-ZETCQYMHSA-N 266.257 -0.535 5 20 CBBD NC(=O)c1ccnc(N2CCCNC(=O)C2)c1[N+](=O)[O-] 1348834397 QWUBOHHMMYYZAW-UHFFFAOYSA-N 279.256 -0.585 5 20 CBBD COc1c(O)ccc(CNC[C@H]2CNC[C@H]2O)c1[N+](=O)[O-] 1579136344 JWGJOWZQTMDCEJ-GXSJLCMTSA-N 297.311 -0.021 5 20 CBBD O=C(O)CC1(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 1610758270 KKNXQYDPMYPWHC-SECBINFHSA-N 284.272 -0.251 5 20 CBBD Cc1ccc(C(=O)NC(CO)CO)cc1[N+](=O)[O-] 87751843 TVWIREWFESLOIK-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD COc1nc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n[nH]1 126816108 RNQDPGJITGDDLP-UHFFFAOYSA-N 267.205 -0.443 5 20 CBBD COCCNCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 212780492 NUYIUHQNQIQILG-UHFFFAOYSA-N 256.262 -0.111 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 275436403 BFWVVZTXIMPVDB-CBAPKCEASA-N 298.255 -0.544 5 20 CBBD NC(=O)CN1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 299090518 GPPPSJXGAYALPB-UHFFFAOYSA-N 298.324 -0.101 5 20 CBBD Cc1nn(CCC(=O)N[C@H]2CNC(=O)C2)c(C)c1[N+](=O)[O-] 330736695 NKSJUCAKDHWRQG-SECBINFHSA-N 295.299 -0.197 5 20 CBBD C[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337797500 XDNALHFKPRHDLB-BQBZGAKWSA-N 281.272 -0.275 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@]1(CO)CCOC1 359574064 AZFFYNSNBKPKJN-NSHDSACASA-N 270.289 -0.126 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1=CCNCC1 427612215 LUDPTRZNDOIENB-UHFFFAOYSA-N 292.295 -0.208 5 20 CBBD CCCN(CCn1cc([N+](=O)[O-])cn1)CC(N)=O 429128772 BWSKPPSBJVVJJZ-UHFFFAOYSA-N 255.278 -0.011 5 20 CBBD COC[C@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 524716297 ZTGFLIMEVVJVPC-GFCCVEGCSA-N 299.283 -0.730 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)NCCN(C)C 552077721 VLUTWRHHFDUUAV-SSDOTTSWSA-N 298.303 -0.886 5 20 CBBD CC1(C)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCN1CCO 586810071 NCQISIHKANZTJY-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD Nc1nc(=NCC[C@@]2(O)CCCOC2)[nH]cc1[N+](=O)[O-] 593519821 UPVAAKCMNDVPGH-NSHDSACASA-N 283.288 -0.268 5 20 CBBD COCC1(O)CN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1 598626822 AVWZMCWYSBFGGF-UHFFFAOYSA-N 297.267 -0.026 5 20 CBBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 600217234 UUPCQGYDKDXVSW-UWVGGRQHSA-N 268.225 -0.522 5 20 CBBD CCN(CC)C(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 763990509 ABVGDYXIJGYXGL-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD CCNC(=O)COC(=O)c1ccnc(N)c1[N+](=O)[O-] 848786186 IFBXATFTRLMMIX-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD Cn1cncc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020139292 WXBKNNWZWRRVQP-CNVPUSNMSA-N 293.327 -0.178 5 20 CBBD O=C(N[C@H]1C[C@H](NCCn2cncn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020139764 MKYULPGVVYHAAN-GWOFURMSSA-N 294.315 -0.820 5 20 CBBD CC(=O)N(C)CC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093526555 LERSBWPVGFGFSF-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NC2(CNC(=O)C(N)=O)CC2)n1 1110324554 TWAOFBHIDLCIMI-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](CC(=O)O)C1 1255839980 QRLBIMKSHMZRQF-ZETCQYMHSA-N 298.255 -0.356 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 1324393766 LSJNKVWKGRGPEK-SSDOTTSWSA-N 290.301 -0.659 5 20 CBBD C[C@@H](c1nnc(N2CCN3C(=O)CC[C@@H]3C2)n1C)[N+](=O)[O-] 1338057269 OIRZCQZUZPPPKL-DTWKUNHWSA-N 294.315 -0.036 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CCC[C@H](C(N)=O)C1 1345888579 WJBXQKCWRWTVLG-VIFPVBQESA-N 296.331 -0.274 5 20 CBBD O=C(O)Cc1nnn(C[C@H](O)c2cccc([N+](=O)[O-])c2)n1 1602154074 APINGKLQWRIDQC-VIFPVBQESA-N 293.239 -0.058 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)NC(CO)CO 87749730 SZOXBYBAKYSNGJ-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD NC(=O)c1ccc(CN(CCO)CCCO)c([N+](=O)[O-])c1 111245328 CZRPWIXFYOZJLO-UHFFFAOYSA-N 297.311 -0.130 5 20 CBBD CC(C)(CNC(=O)NCCn1cc([N+](=O)[O-])cn1)C(N)=O 133535904 BREQHNYJEYGBFK-UHFFFAOYSA-N 298.303 -0.398 5 20 CBBD CCN(CC(N)=O)C(=O)CCn1cc([N+](=O)[O-])cn1 189673828 YLKVNJQCDYAWEP-UHFFFAOYSA-N 269.261 -0.485 5 20 CBBD C[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)C[C@@H](CO)O1 230007402 FTZRKCKRCVUCIY-SFYZADRCSA-N 256.262 -0.086 5 20 CBBD NC(=O)CNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 263704350 LGAOUNFLOMBPSR-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD O=C(C[C@H]1CCCC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 288694144 XRVIILGIRLBYQW-SECBINFHSA-N 295.299 -0.034 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)OC 294191487 XIKRLDFUSKNPKB-LURJTMIESA-N 272.217 -0.764 5 20 CBBD CCN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 298684991 BCIFJAUIDGYYAF-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2nc(O)n[nH]2)c1 353199179 BMOIPTICPLAMMA-UHFFFAOYSA-N 295.211 -0.585 5 20 CBBD CO[C@@H]1COC[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 413454347 HVKQIACTBCCMGY-CAHLUQPWSA-N 255.234 -0.207 5 20 CBBD COC(=O)[C@@H]1CN(C)CCN(c2ncc([N+](=O)[O-])cn2)C1 413511456 ZQFLNKCMYYTSBX-SECBINFHSA-N 295.299 -0.074 5 20 CBBD O=C(NC[C@@H](O)[C@H]1CCOC1)c1cnc(O)c([N+](=O)[O-])c1 445008148 PWPUSMRMQVVOFH-OIBJUYFYSA-N 297.267 -0.177 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)O[C@H]1CCOC1=O 748918058 STIWSXAEKHJBGP-QMMMGPOBSA-N 282.208 -0.385 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)O1 808200154 CLGDHGGKQLQLKR-POYBYMJQSA-N 268.229 -0.389 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CCO1 821511048 PASMEUZZUHHQRY-VIFPVBQESA-N 296.239 -0.271 5 20 CBBD CC(C)(CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 826567262 CHOXPPZAGCCFDJ-UHFFFAOYSA-N 271.233 -0.587 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H](C)N1CCOCC1 839658990 WCBZAJMQVTZUJH-LNFKQOIKSA-N 271.317 -0.123 5 20 CBBD Cc1cnc(NCCNC(=O)CC(N)=O)c([N+](=O)[O-])c1 1093539115 VNEGQXUSIXHVPF-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD C[C@@H](N)CNC(=O)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1118043548 PCTFTUAJEHKTRC-MRVPVSSYSA-N 292.295 -0.100 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@]1(O)CCOC1 1319485181 MAKITDPHGXTRTJ-GFCCVEGCSA-N 297.267 -0.976 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1c([N+](=O)[O-])cnn1C 1320685034 XTUDKLKJKOFEOT-UHFFFAOYSA-N 284.276 -0.671 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 1331169681 UBBUAANAQNHLOX-QMMMGPOBSA-N 271.233 -0.982 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1336696758 DMPOIYYPVRKTPE-NSHDSACASA-N 286.288 -0.154 5 20 CBBD NC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1SCCO 1341405588 SHMNSZKOBREDJW-UHFFFAOYSA-N 299.308 -0.106 5 20 CBBD O=[N+]([O-])c1ccc(N2CC(O)(CO)C2)c(-c2nn[nH]n2)c1 1607081858 PMIPVQCVAOFZGG-UHFFFAOYSA-N 292.255 -0.682 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 35149042 DPGLKEPLFUQTKY-RXMQYKEDSA-N 289.269 -0.548 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O 161455738 CUMIQHQZKKGXDS-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 264089296 FUHAZCZSNFIUKM-LURJTMIESA-N 281.272 -0.159 5 20 CBBD COCCN1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 264558005 QEXMIKQXHSRSIR-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@H]1CN2CCN1CC2 269477830 KXIAIJRKPGJYQW-VIFPVBQESA-N 266.305 -0.260 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H](C)O 277929588 ATLATQXXYNNESQ-XRGYYRRGSA-N 299.239 -0.652 5 20 CBBD COC[C@@H](O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338647618 AANFGVBZXNSLKF-VIFPVBQESA-N 286.288 -0.350 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(F)(F)CO 356741781 JLONHEGZLNJABO-UHFFFAOYSA-N 264.188 -0.314 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])nn1C 356745614 ORISUQJITYLXGR-UHFFFAOYSA-N 284.276 -0.671 5 20 CBBD CN(C)C(=O)COC1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 360995745 NFFDKVUIUQBNAM-UHFFFAOYSA-N 296.283 -0.148 5 20 CBBD O=C1OC[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN12 363812255 FKLKPZPXAGBLSJ-SNVBAGLBSA-N 281.272 -0.072 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1[C@@H]2CNC[C@@H]21 368645797 HOGRRBGSGGIPBA-MTBHXBHISA-N 251.246 -0.875 5 20 CBBD CNC(=O)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525699747 BSTRDIKMCVSSPL-UHFFFAOYSA-N 288.285 -0.596 5 20 CBBD NC(=O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CCCC1 604244380 NAHWCGCNKQDKEF-UHFFFAOYSA-N 296.287 -0.557 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])cn1C 737612545 VPNWNZGCNSVTAJ-UHFFFAOYSA-N 299.239 -0.367 5 20 CBBD CC(=O)N(C)CC(=O)OCCn1ccc([N+](=O)[O-])n1 748116284 AALWARICGBCQTC-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 782596679 SNSRXRMZBFWODO-ONGXEEELSA-N 297.315 -0.685 5 20 CBBD C[C@](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)(C(=O)O)C1CC1 827735014 OIFBHUGAXYSGOJ-CMPLNLGQSA-N 298.299 -0.005 5 20 CBBD CC(C)CS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842297931 RNMZTDOFLZQAGL-RNFRBKRXSA-N 250.276 -0.246 5 20 CBBD COC[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C 886873075 IGPNHLXFBDRHGK-JTQLQIEISA-N 298.299 -0.026 5 20 CBBD Nc1nc(NCCNC(=O)c2cn[nH]c2)ncc1[N+](=O)[O-] 1093489275 YJZFYWBDNPYARO-UHFFFAOYSA-N 292.259 -0.468 5 20 CBBD CN(C)CC[C@@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 1118336960 IDWOWXFNVVOSSA-SNVBAGLBSA-N 284.320 -0.814 5 20 CBBD CCn1ncc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936246 CNGARGGSXGWSNJ-NXEZZACHSA-N 282.304 -0.831 5 20 CBBD O=C(NCCCNCc1nncs1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767801 VFDRXTGXPLAUNJ-HTQZYQBOSA-N 285.329 -0.201 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCn1ccnn1 1330677185 WRNSAGGWHSPQKR-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCn2cnnc2C1 1336412380 FIKPKVASGRQHII-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1608643560 HAVRISPFVDUMIY-ZCFIWIBFSA-N 270.201 -0.757 5 20 CBBD CNC(=O)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 184051022 PRZWHXBRFQVGGD-JTQLQIEISA-N 283.288 -0.762 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCN1 237614636 AIEGGXKRUFRSLY-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD O=C(N[C@H](CO)CN1CCCCC1)c1n[nH]cc1[N+](=O)[O-] 293554260 HHVVCOCKTVCSDC-VIFPVBQESA-N 297.315 -0.106 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNc2ncc([N+](=O)[O-])cn2)O1 302241166 XUQRBQGBHJZFHL-HTQZYQBOSA-N 267.245 -0.170 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H](F)C[C@H]1CO 332637057 AAQKDHUTYHPUOG-WDSKDSINSA-N 258.209 -0.137 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)O1 347736674 RRLZWQGVDVHLEH-CBAPKCEASA-N 282.256 -0.314 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(=O)NC(C)(C)C 356456759 LXNWFJZLRSOQFK-UHFFFAOYSA-N 283.288 -0.027 5 20 CBBD CC[C@@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362340806 UKVQIMPXXIXYIY-SECBINFHSA-N 271.233 -0.444 5 20 CBBD CNC(=O)CCCC(=O)NCCn1cc([N+](=O)[O-])cn1 444238339 AWMBSYHGDDNRKA-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 546017988 MRJDVNARDBIRMG-QMMMGPOBSA-N 266.257 -0.106 5 20 CBBD CC(=O)CNC(=O)[C@H](C)Sc1ncc([N+](=O)[O-])c(N)n1 573863348 OTVZWLQCWXTVJZ-LURJTMIESA-N 299.312 0.153 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](CO)[C@@H](O)C1 577014331 ZLMHBHWBBXAVLZ-YUMQZZPRSA-N 256.262 -0.492 5 20 CBBD CCN(C)C(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 594342536 ARYMXKMIFFJQLS-UHFFFAOYSA-N 295.299 0.240 5 20 CBBD COC[C@](C)(O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594365575 VOIIQFVQHSFDDH-GFCCVEGCSA-N 298.299 0.089 5 20 CBBD O=C(O)CNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 740484356 MFPKKXDWDCBEES-UHFFFAOYSA-N 295.207 -0.297 5 20 CBBD O=C(O)Cn1cc(CCn2nccc2[N+](=O)[O-])nn1 833273406 NADRWBSUBVHYAW-UHFFFAOYSA-N 266.217 -0.290 5 20 CBBD CC(C)(C(=O)Nn1c(O)nnc1O)n1cc([N+](=O)[O-])cn1 854610893 OVOIIYNZXZGBJK-UHFFFAOYSA-N 297.231 -0.701 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](C)C(N)=O 915755713 YHYKMOFKZVZFJU-SSDOTTSWSA-N 294.267 -0.168 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2COCCO2)c1[N+](=O)[O-] 1115983918 DGQPPFQMLDMCMC-ZETCQYMHSA-N 270.245 -0.228 5 20 CBBD NC(=O)C[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1323419342 PELVHHJSYUFTEA-MWLCHTKSSA-N 297.315 -0.651 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)C1(CO)COC1 1344478729 MLOMLEHTEXFOAQ-UHFFFAOYSA-N 298.251 -0.691 5 20 CBBD O=C1C[C@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CN1 1609587148 GHEQYDCOQIDVCC-YFKPBYRVSA-N 290.243 -0.530 5 20 CBBD NC(=O)COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 28829643 GSQSSZLIGGHVBQ-UHFFFAOYSA-N 295.251 -0.257 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 73544498 YQJTVHPOMPEBBW-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD CN1N=C(C(=O)Nc2c([N+](=O)[O-])cnn2C)CCC1=O 184394132 GRNVUTJFFBCVGL-UHFFFAOYSA-N 280.244 -0.125 5 20 CBBD NS(=O)(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 190870938 OCSWOQKURZJIKR-UHFFFAOYSA-N 273.270 -0.139 5 20 CBBD O=C(O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262105591 JPBFLRZWGAEYQX-VIFPVBQESA-N 295.251 -0.168 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 279644136 ZHNFUMOJWKSUEK-KRTXAFLBSA-N 297.267 -0.035 5 20 CBBD CCN1CCC[C@H]1CNC(=O)Cn1cnc([N+](=O)[O-])n1 330574785 LJDXSNVRDKOXAP-VIFPVBQESA-N 282.304 -0.213 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 355749719 RAVQFWWTWLFLAO-QMMMGPOBSA-N 297.267 -0.169 5 20 CBBD COC[C@](C)(N)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357536229 UDUYGPIMBHQQAL-LLVKDONJSA-N 283.288 -0.136 5 20 CBBD C[C@H](CC(N)=O)Nc1ncc([N+](=O)[O-])cc1C(N)=O 361053261 QKNNZWVFQNNHIJ-RXMQYKEDSA-N 267.245 -0.236 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CCCCNC1=O 372561906 ABHRPXFOCNNACR-HRDYMLBCSA-N 255.274 -0.221 5 20 CBBD CN1CC[C@@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 425271303 XWJUOFHJVIEAJF-SSDOTTSWSA-N 280.288 -0.331 5 20 CBBD C[C@H]1CCNC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427573570 KKGNABTYKQRKSS-YUMQZZPRSA-N 268.277 -0.700 5 20 CBBD O=C(NCC(F)(F)CO)c1c[nH]nc1[N+](=O)[O-] 573581619 LAIVILLBAHFXGF-UHFFFAOYSA-N 250.161 -0.325 5 20 CBBD COC(=O)c1ccnc(NCCCO)c1[N+](=O)[O-] 590568719 BLQRGBNBQORQOC-UHFFFAOYSA-N 255.230 0.571 5 20 CBBD Nc1nccc(C(=O)N[C@H]2C[C@H](O)C2)c1[N+](=O)[O-] 598527597 FNVPHFXAUFXWRU-OLQVQODUSA-N 252.230 -0.175 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)Cn1ccc([N+](=O)[O-])n1 610499308 SONDIZBKVGFIBU-BDAKNGLRSA-N 293.283 -0.329 5 20 CBBD CCn1ncn(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1=O 816735006 ODLAGUONMCUAHT-UHFFFAOYSA-N 295.259 -0.670 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)c1c([N+](=O)[O-])cnn1C 820539796 XXOQDWBAAVDWBH-UHFFFAOYSA-N 299.287 -0.583 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C(=O)O 828442046 XCUXWYROEUFIOT-FBIMIBRVSA-N 298.299 -0.195 5 20 CBBD CNC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839696980 VZWNDAXNWNTDSP-HTQZYQBOSA-N 256.262 -0.865 5 20 CBBD Cc1[nH]nc(C(=O)NCCn2ccnn2)c1[N+](=O)[O-] 1119574125 OTGQCDRZFRAGNG-UHFFFAOYSA-N 265.233 -0.352 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](CO)OC[C@H]2C)c1[N+](=O)[O-] 1319815670 KNTJARKUIMLKOX-VXNVDRBHSA-N 298.299 -0.141 5 20 CBBD O=C(N[C@H](CO)C(=O)O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1574817379 BPOOJTNRCFGWLC-BDAKNGLRSA-N 284.224 -0.810 5 20 CBBD O=C(O)C1=NO[C@H](Cn2cc([N+](=O)[O-])ccc2=O)C1 1608591491 OIKVIIQOWGFIMK-ZETCQYMHSA-N 267.197 -0.014 5 20 CBBD O=C(O)[C@@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1608646287 JYKLXBNVSPCJAE-ZETCQYMHSA-N 283.244 -0.793 5 20 CBBD CCNC(=O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 48800841 MYTVSQJGHIUUPC-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCN1CCOCC1 143064502 KAHBOZLCVWYKEH-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CN2CCN1CC2 269477829 KXIAIJRKPGJYQW-SECBINFHSA-N 266.305 -0.260 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCOC[C@]12CCOC2 286131219 YKFGUNZZGZQFLN-LLVKDONJSA-N 282.256 -0.051 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](O)C1CCOCC1 330846641 OWWBZJPPMWVTOA-JTQLQIEISA-N 298.299 -0.305 5 20 CBBD CN1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C(=O)N1 354498513 YSEDJDYYUNVVSE-SSDOTTSWSA-N 279.256 -0.748 5 20 CBBD CCN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])n1C 355832665 MSPOMTPFWAKMSL-UHFFFAOYSA-N 254.246 -0.119 5 20 CBBD CCCN(CC(N)=O)c1ncc([N+](=O)[O-])c(N)n1 488752924 YWUKUZAOZYKLHO-UHFFFAOYSA-N 254.250 -0.331 5 20 CBBD N=C(O)OCCNC(=O)CCn1cc([N+](=O)[O-])cn1 494623326 DRSHBGFIVLRODK-UHFFFAOYSA-N 271.233 -0.193 5 20 CBBD CN1C[C@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 582634096 FQUNEPXTNAWKNN-SECBINFHSA-N 295.299 -0.130 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nc(O)n[nH]1 610658610 VJRHLEKYWZWTNM-UHFFFAOYSA-N 266.217 -0.313 5 20 CBBD NC(=O)NC(=O)COC(=O)Cc1cccc([N+](=O)[O-])c1 745328792 FGPQNJMFBLIQNE-UHFFFAOYSA-N 281.224 -0.125 5 20 CBBD COC(=O)COCC(=O)OCCn1ccc([N+](=O)[O-])n1 803803981 CSDVOICBHVIDMM-UHFFFAOYSA-N 287.228 -0.476 5 20 CBBD C[C@H](COC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O)[N+](=O)[O-] 813114046 YAPVNDNNFAOJGB-JMCQJSRRSA-N 299.283 -0.085 5 20 CBBD CN(CC(C)(C)S(C)(=O)=O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839716658 BUIHAPIGUOGMJW-HTQZYQBOSA-N 278.330 -0.067 5 20 CBBD CN(C)C(=O)CC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1094160233 DMEIYWXJTGRFEK-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD O=C(NCCCN1C(=O)CCC1=O)c1c[nH]nc1[N+](=O)[O-] 1322272563 DECSWHOQCPVDRJ-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](CC(N)=O)C2)c1[N+](=O)[O-] 1323364518 DCJOHXUFGBNCFR-MRVPVSSYSA-N 295.299 -0.026 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN[C@H]3C[C@@H]32)nc1 1580876075 ZSVLWUOPANIHGD-IUCAKERBSA-N 284.297 -0.275 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(=O)NC1CC1 67824438 DBMLBIFMTCJFJI-UHFFFAOYSA-N 281.272 -0.505 5 20 CBBD CC(C)(CO)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 135091427 VDMGLYHKYPRKMR-SNVBAGLBSA-N 272.305 -0.240 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C 186825476 YKKQUAVWDJIVTP-SSDOTTSWSA-N 281.272 -0.369 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1OC 276736903 AHBLUEXOZYMHMJ-AOOOYVTPSA-N 298.299 -0.028 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@](C)(O)CO)c1[N+](=O)[O-] 338618826 BCBFVQCBSWFRLU-SNVBAGLBSA-N 272.261 -0.647 5 20 CBBD Nc1c(C(=O)NCCn2ncnn2)cccc1[N+](=O)[O-] 338962103 OFKNAEFRMSZMIH-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@H](O)C1 339723681 KPEDWXOEANRSLZ-VIFPVBQESA-N 267.241 -0.650 5 20 CBBD CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 343456332 QSOOSGUFUWKGSG-ZCFIWIBFSA-N 269.261 -0.288 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[C@@H](O)CN1 358803702 SUQBVWKZFYILGX-GHMZBOCLSA-N 295.295 -0.058 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])o1 394069284 BHPFYJMYODMZQL-QMMMGPOBSA-N 268.273 -0.179 5 20 CBBD Cn1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1 436837139 NVWBDRIYUYZJDV-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CNC[C@@H](O)CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 519659825 ZGZJZTNIXDMBAO-NEPJUHHUSA-N 299.327 -0.496 5 20 CBBD O=C1C[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CN1 543567284 ILPGRDCZHRAQPE-ZCFIWIBFSA-N 293.235 -0.058 5 20 CBBD COCCOCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 549194411 OLNDFJGHOLORJS-UHFFFAOYSA-N 258.234 -0.289 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H]2CNC[C@@H]21 584469229 SDUBUDQYGMQQET-SVRRBLITSA-N 251.246 -0.248 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 592462847 AFXOVOKHWFBEOH-VXNVDRBHSA-N 297.267 -0.081 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 592942060 YMSPZILFLVINJG-RQJHMYQMSA-N 298.255 -0.686 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCC1=O 598294700 GUYWILVDOJPYKX-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD C[C@@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C[C@@H]1O 611257459 OILALQIQUSKNRP-SFYZADRCSA-N 287.297 -0.009 5 20 CBBD COCCONC(=O)c1c([N+](=O)[O-])c(C)nn1C 748772623 LDWIXKHQTYHOIO-UHFFFAOYSA-N 258.234 -0.055 5 20 CBBD O=C(CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)NCCO 843070589 DMLZSFYTOPZWER-LLVKDONJSA-N 283.284 -0.674 5 20 CBBD O=C1CC[C@@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)N1 845101266 YFVNMQXNEMAXEW-ZETCQYMHSA-N 268.229 -0.387 5 20 CBBD CON1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 853671232 JRASDTRFJKHXLZ-UHFFFAOYSA-N 254.250 -0.350 5 20 CBBD Cc1nc(N[C@H]2C[C@@H](NC(=O)C(N)=O)C2)ccc1[N+](=O)[O-] 1059803943 MCNBMWGQLGZIFE-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD O=C(NCC(=O)N1CCCC1)c1c[nH]nc1[N+](=O)[O-] 1116945258 RVVYUXOZFRZZBI-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD CNC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1254799431 IYUGUCPFYASIQG-MRVPVSSYSA-N 267.245 -0.664 5 20 CBBD CC(=O)NC(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1589099907 CNZKHENHIVDXDG-UHFFFAOYSA-N 283.196 -0.883 5 20 CBBD CCN(C)C(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590676591 JCVVAINQZONHEQ-UHFFFAOYSA-N 280.248 -0.550 5 20 CBBD CC(C)NC(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 48782150 WLWAUNOSOPMPHD-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD CC(C)N1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 49033061 GGYGQIBPODSPBE-UHFFFAOYSA-N 282.304 -0.261 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1cc([N+](=O)[O-])c[nH]1 85848234 UESANDCJKNOFNG-SNVBAGLBSA-N 269.213 -0.104 5 20 CBBD NC(=O)[C@@H]1CCCN1CCn1cc([N+](=O)[O-])cn1 174847970 UZKBPZFXZMXXSU-VIFPVBQESA-N 253.262 -0.259 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 230685722 FMPDCIDBUPNREM-YFKPBYRVSA-N 267.245 -0.564 5 20 CBBD NC(=O)CCCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230721496 WMFTYYPYMYHSCI-UHFFFAOYSA-N 281.272 -0.043 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNc1ncc([N+](=O)[O-])c(N)n1 279165663 UICIZHNWIALGLR-LHLIQPBNSA-N 269.261 -0.081 5 20 CBBD COC[C@@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 338682494 AYIBQROLQRFUPW-VIFPVBQESA-N 272.261 -0.695 5 20 CBBD C[C@@H](NC(=O)Cn1nccc1[N+](=O)[O-])C(=O)N(C)C 339216428 ZLARRCYEYCAALM-SSDOTTSWSA-N 269.261 -0.616 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[S@]1=O 352315366 VVGFTCHSUHPZLE-WPCRTTGESA-N 286.313 -0.229 5 20 CBBD CC(CO)(CO)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 590401032 OVAJXETUMKRDNN-UHFFFAOYSA-N 285.256 -0.584 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@H](O)[C@@H](O)C1 600217190 RSMCTBVWXXUMLD-UWVGGRQHSA-N 268.225 -0.522 5 20 CBBD CN(C[C@H](O)CO)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 825953693 LQRBHSKFLLJWSV-QMMMGPOBSA-N 294.271 -0.436 5 20 CBBD O=C(CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NC1CCCC1 839608387 SSDAHUWLGSQULE-RKDXNWHRSA-N 255.274 -0.173 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@@H]1CO 934015804 BWSSTEVYNMWISB-SNVBAGLBSA-N 253.258 -0.177 5 20 CBBD C[C@@H]1C(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1148126774 YXKMDJLAIKPKLU-ZCFIWIBFSA-N 279.256 -0.587 5 20 CBBD C[S@](=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1338672678 VSOTXSJACJVXJD-KRWDZBQOSA-N 260.275 -0.714 5 20 CBBD Cc1c(CN)c(NC(=O)Cn2ccc([N+](=O)[O-])n2)nn1C 1350412821 YLZGCWQVSSGXTE-UHFFFAOYSA-N 293.287 -0.069 5 20 CBBD O=C(O)[C@@H]1CNCCCN1CCn1ccc([N+](=O)[O-])n1 1601852599 MTQDNAWCHZYUKV-VIFPVBQESA-N 283.288 -0.460 5 20 CBBD C[S@@](=O)CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1605362278 FIMVNJVDHLFRKN-GOSISDBHSA-N 271.262 -0.650 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCN(C)C(=O)C1 152759302 PKHUFAWFHSXWGC-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)C(N)=O 228479619 ACPQFJOPCONTKQ-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD COC(=O)CCNC(=O)Cn1cccc([N+](=O)[O-])c1=O 263716483 XHVAJHOWUFOUQV-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD CCS(=O)(=O)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 270290119 URDHTZAVCOKNMF-UHFFFAOYSA-N 289.317 -0.162 5 20 CBBD COCCN1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 282498693 QQRXEPZONDWUGP-UHFFFAOYSA-N 283.244 -0.794 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 286349716 ZESQKMJVNDOULZ-JTQLQIEISA-N 272.261 -0.165 5 20 CBBD CCNC(=O)NC(=O)Cn1cc([N+](=O)[O-])c(C)n1 294344131 YSLVTKLAIMHRJJ-UHFFFAOYSA-N 255.234 -0.055 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(C)(O)C2)c1[N+](=O)[O-] 408164580 MOAFVVRNFYJLJH-UHFFFAOYSA-N 254.246 -0.156 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 436919338 LHCQTZFUONADEC-QMMMGPOBSA-N 284.224 -0.436 5 20 CBBD O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1c[nH]nc1[N+](=O)[O-] 554877773 PYJLXGAHGHOUJZ-LURJTMIESA-N 279.256 -0.189 5 20 CBBD C[C@@H](O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 598387211 SDXQMUIXPRJXBN-SSDOTTSWSA-N 254.246 -0.179 5 20 CBBD Cn1nnnc1COC(=O)Cn1cc([N+](=O)[O-])cn1 733433692 BGWKZMLRMGSWTD-UHFFFAOYSA-N 267.205 -0.942 5 20 CBBD O=C(O)NCCOC(=O)Cn1ccc([N+](=O)[O-])n1 739974253 WEHKHWNTHPNRFD-UHFFFAOYSA-N 258.190 -0.398 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O 773515608 UBOTVQKSZVCCBQ-MRVPVSSYSA-N 283.240 -0.470 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@H](O)C[C@H]1CO 886094304 PAJKXEKDAISWMK-VHSXEESVSA-N 253.258 -0.083 5 20 CBBD Cc1cc[nH]c1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991293513 BFHMUAIABYONLN-NXEZZACHSA-N 292.295 -0.071 5 20 CBBD Cc1nc(C)n(CCNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936891 WLYWKYBIYIOLFE-GHMZBOCLSA-N 296.331 -0.734 5 20 CBBD NC(=O)C(=O)NCCCNCc1ccccc1[N+](=O)[O-] 1165614604 XHYKYUUGJVCUHN-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD O=C(C[C@H]1CC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 1261730815 IIQGIXUSIVKQQK-ZETCQYMHSA-N 267.245 -0.814 5 20 CBBD O=C(NCC1(NCc2csnn2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1754514091 PNHWOVWFZYNCCC-RKDXNWHRSA-N 297.340 -0.058 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CN3CCC2CC3)c1 37883517 RWIPLSSDLAJEDQ-OLZOCXBDSA-N 295.343 -0.164 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1nc[nH]n1 37920529 GQRYZHGGLSJUIL-UHFFFAOYSA-N 251.206 -0.774 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)[C@@H]1C 104892709 ATBUAPXFGRVPJH-ZETCQYMHSA-N 281.272 -0.553 5 20 CBBD CN(C)C(=O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 193813612 IGIKREBITVVLOH-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD CCCNS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 292793348 YTTHPMWKEFPRLH-UHFFFAOYSA-N 277.306 -0.375 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCn3ncnc3C2)c1 332251250 SJGJVFFNPSEDLC-UHFFFAOYSA-N 263.261 -0.101 5 20 CBBD CO[C@H]1C[C@@H](CO)N(Cc2c([N+](=O)[O-])ncn2C)C1 332657780 FIYSZSYWMJSWRF-IUCAKERBSA-N 270.289 -0.090 5 20 CBBD NC(=O)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 342062431 BFWAYVBSQKOIGY-UHFFFAOYSA-N 280.240 -0.475 5 20 CBBD Cc1nnc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1C 345365396 ARFRLZDGJGLNCA-UHFFFAOYSA-N 292.255 -0.168 5 20 CBBD NC(=O)CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1F 347686560 UMKZMMPWIDPLRP-UHFFFAOYSA-N 298.230 -0.853 5 20 CBBD CC[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)O 386757094 HRTVMCKIUMLTGI-MIMYLULJSA-N 272.305 -0.099 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]1 438909784 KDQVFFJJRXPKJI-UHFFFAOYSA-N 276.274 -0.798 5 20 CBBD O=C(NCC1(N2CCOCC2)CC1)c1c[nH]nc1[N+](=O)[O-] 555308214 LDGQPGCEQKYLMZ-UHFFFAOYSA-N 295.299 -0.088 5 20 CBBD CC(C)(CO)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 610925986 SNTURAKQMRBITD-UHFFFAOYSA-N 283.284 -0.109 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NC1=NCC(=O)N1 617405679 QHIKCIJIEXQTTG-UHFFFAOYSA-N 278.224 -0.181 5 20 CBBD C[C@H](O)[C@@H](O)CNc1nccc(C(=O)O)c1[N+](=O)[O-] 717351918 UCXWMQBIWCDZOF-FSPLSTOPSA-N 271.229 -0.158 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)[C@H]1COCCO1 748112835 WZEZSXMLGQUHQQ-MRVPVSSYSA-N 271.229 -0.250 5 20 CBBD COC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 760075812 JNOFLADQXSPNDU-ZETCQYMHSA-N 282.256 -0.593 5 20 CBBD CC[C@](C)(NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 770008464 YNKSOXWJAINTGH-NSHDSACASA-N 283.288 -0.130 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1C 798128534 YPBOLGJREGVEAH-LLVKDONJSA-N 295.295 -0.331 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1n[nH]c2ccc([N+](=O)[O-])cc12 833768098 ZXEPQANFUSFZHH-QMMMGPOBSA-N 294.223 -0.354 5 20 CBBD CN(C)CCN(CCN(C)C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839693208 NLCACLZGGMOQBW-GHMZBOCLSA-N 272.349 -0.397 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCN2CCCC2)c1=O 915668727 OEGPWKSAKAFWFL-UHFFFAOYSA-N 280.284 -0.049 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 972873529 CDQIBQKLEGWVEQ-DBRKOABJSA-N 277.227 -0.320 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)CCOC)C1 1079743694 BLEWDXREUMMWIO-GHMZBOCLSA-N 299.327 -0.253 5 20 CBBD Cc1nn(CN(C)CCNS(C)(=O)=O)cc1[N+](=O)[O-] 1116506210 IASIAUYCQGDUBO-UHFFFAOYSA-N 291.333 -0.462 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1N 1118270176 XCUCLIKIDWDLFC-BDAKNGLRSA-N 282.304 -0.228 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1cc[nH]n1 1123891227 KWOCGGCSDFHZKK-UHFFFAOYSA-N 293.287 -0.429 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1cncn1 1318301992 JXDXXUNOXMBNRJ-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD O=[N+]([O-])CCN1CCC[C@@H](N2CCCS2(=O)=O)C1 1333015857 DCRANESWJYNRRY-SNVBAGLBSA-N 277.346 -0.237 5 20 CBBD CC(=O)N[C@@H](C)C(=O)OCCn1cnc([N+](=O)[O-])n1 1343994087 QAQPOPROKGTCAK-LURJTMIESA-N 271.233 -0.746 5 20 CBBD C[C@@H](O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1589997625 SYHVZGFAJOUBFT-LHLIQPBNSA-N 294.271 -0.072 5 20 CBBD COCC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1599213913 DJQYJGJRCWWSGX-ZCFIWIBFSA-N 286.244 -0.452 5 20 CBBD O=C(NC[C@H]1CCO[C@H]1C(=O)O)c1c[nH]nc1[N+](=O)[O-] 1608461655 UOHODHZDLLPAKZ-IYSWYEEDSA-N 284.228 -0.463 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 185955720 BQHUZDUPWZTGGH-UHFFFAOYSA-N 285.281 -0.109 5 20 CBBD O=C(NCCN1CCNCC1)c1ccc([N+](=O)[O-])c(O)c1 262001576 AYLKWBZUWTUAJF-UHFFFAOYSA-N 294.311 -0.065 5 20 CBBD CN(C[C@H](O)CN1CCOCC1)c1ncc([N+](=O)[O-])cn1 273965815 OLRUQOLXFJGQSD-NSHDSACASA-N 297.315 -0.486 5 20 CBBD Cn1c(C(=O)NCCc2nc(N)no2)ccc1[N+](=O)[O-] 359575797 BZNKDSQZAFPBOZ-UHFFFAOYSA-N 280.244 -0.129 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(F)(F)F 360739237 RIAFKSBCNBEDED-RXMQYKEDSA-N 282.178 -0.019 5 20 CBBD NC[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CCO1 570515236 JWJAFOTWYFTTGC-QMMMGPOBSA-N 280.284 -0.023 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(N)=O 760062428 IUJMFOFTIRKVHQ-SSDOTTSWSA-N 270.245 -0.837 5 20 CBBD CO[C@](C)(CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 848268159 XVGYFOGDRIHNKN-NSHDSACASA-N 284.272 -0.301 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2nncs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020140097 YJPZFHIOIMFWMV-FNCVBFRFSA-N 297.340 -0.060 5 20 CBBD CN(CCC(N)=O)C(=O)c1c([N+](=O)[O-])cnn1C 1117268920 CTBTYFGISZJXCI-UHFFFAOYSA-N 255.234 -0.724 5 20 CBBD Cn1ccnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932103 IUZUZYHAYUSFMW-RKDXNWHRSA-N 267.289 -0.709 5 20 CBBD O=C(NCCCNCc1csnn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767328 LEVFPDYUXZJZHU-RKDXNWHRSA-N 285.329 -0.201 5 20 CBBD NC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1325855299 GFPBHTXYLCOAOX-SSDOTTSWSA-N 254.250 -0.960 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](O)C2)c1[N+](=O)[O-] 1340153639 JAMPYDQVWBPUBP-ZETCQYMHSA-N 254.246 -0.156 5 20 CBBD C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1356533416 DECWMAAWRAUMRP-IONNQARKSA-N 296.291 -0.974 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)Nc2cnn(CC(=O)O)c2)n1 1594548751 RCBFYVPRVQOJNJ-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@H]2C(=O)O)c1[N+](=O)[O-] 1607500567 RWHCGXVJMOQOEH-RXMQYKEDSA-N 254.202 -0.075 5 20 CBBD O=C(O)[C@@H]1CNCCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1608646755 UOEOPZSYNYPMQW-ZETCQYMHSA-N 283.244 -0.793 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)Cn1cc([N+](=O)[O-])cn1 44680686 CVBZARGYHSYXHE-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD COC(=O)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 176229700 AUUOHABAFJMICG-SECBINFHSA-N 284.272 -0.335 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@@H](C)O 265552317 ZBBCZFJFEDOTQY-SSDOTTSWSA-N 256.262 -0.013 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1CCN(C)C1=O 265691000 YASJIOZOFNFSIH-SECBINFHSA-N 295.299 -0.211 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCC(=O)NC(N)=O 268262560 ZMVCBIUFLDIHFI-UHFFFAOYSA-N 256.222 -0.675 5 20 CBBD COCCN1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 270805812 VMZJXYZDPNZQDL-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD COC[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 280140386 XEAOCAATULVLAQ-ZETCQYMHSA-N 269.257 -0.086 5 20 CBBD O=C1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CN1 351787275 YWIKGGPUYLJVLI-RXMQYKEDSA-N 253.218 -0.674 5 20 CBBD C[C@H](N)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 351829759 OUCPNSDKJRVRLX-DTWKUNHWSA-N 267.289 -0.013 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H]2CNC[C@H]2C1 353763167 SRSGTWUQIXNVMF-SFYZADRCSA-N 265.273 -0.001 5 20 CBBD Cn1c(C(=O)NCc2nnc(N)o2)ccc1[N+](=O)[O-] 354845528 SDSQLJFMFPMDHT-UHFFFAOYSA-N 266.217 -0.172 5 20 CBBD NC(=O)NCC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 359622822 IHTXEVMRWXHQCY-UHFFFAOYSA-N 294.267 -0.016 5 20 CBBD C[C@@H]1CN(CCNC(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 534272134 UEMJUSUVIMCYOF-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)CC[C@H]2C1 554871054 PBICAOZZDYDMCA-ZETCQYMHSA-N 279.256 -0.235 5 20 CBBD CC1(C)NCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 565711005 BTFDFDHDIKHAFU-SSDOTTSWSA-N 268.277 -0.557 5 20 CBBD CNc1nccc(C(=O)N[C@](C)(CO)COC)c1[N+](=O)[O-] 594342813 IYJZFAGWFOIEAP-GFCCVEGCSA-N 298.299 0.159 5 20 CBBD C[C@@H]1[C@H](N)CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 594624762 AZPLLDTVYZVNNU-HTQZYQBOSA-N 268.277 -0.476 5 20 CBBD N[C@H]1C[C@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 594694783 SZNCBGQSPKCJBP-BQBZGAKWSA-N 283.313 -0.201 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 619565842 GZDLZJMAOULATI-SECBINFHSA-N 292.251 -0.348 5 20 CBBD CNC(=O)COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 789842032 ZCQJPIKPQRVMJS-UHFFFAOYSA-N 295.251 -0.386 5 20 CBBD CC(C)(CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])N1CCOCC1 839454843 BQZVUBARCFRNNH-NXEZZACHSA-N 271.317 -0.121 5 20 CBBD CC(=O)NCCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1116855391 XRYLQARCYLLNQB-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD Cc1nc(N2CCN(C)C[C@@H]2CO)ncc1[N+](=O)[O-] 1348850222 JAWFCCITDTZTQO-SECBINFHSA-N 267.289 -0.194 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@@H](O)C2)c(-c2nn[nH]n2)c1 1593479454 ZBAUDZKPGGFJDH-UWVGGRQHSA-N 292.255 -0.683 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1610732871 JHJAYJMSOYYLAR-XPUUQOCRSA-N 284.228 -0.632 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN(CCO)CC1 35118743 HWBSXPSIQKRVDN-UHFFFAOYSA-N 268.273 -0.327 5 20 CBBD CNC(=O)CN1CCN(c2ccc([N+](=O)[O-])cn2)CC1 48976580 MLIVMCWEJLKNIZ-UHFFFAOYSA-N 279.300 -0.142 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 135513934 FXNDPHJSPXHBOC-SECBINFHSA-N 298.255 -0.808 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2ccncn2)c1 236518727 HCHLJTXWGDCIRK-NSHDSACASA-N 278.272 -0.268 5 20 CBBD CNC(=O)CN(C)C(=O)c1cccc([N+](=O)[O-])c1N 267198766 NDZRQNLPUNSMPH-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD CN(C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 289283280 SVZWYOKBZJXXBX-NXEZZACHSA-N 299.287 -0.808 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])cnc1O)NC1CC1 298099907 UWFKJEMJCDAFGM-UHFFFAOYSA-N 280.240 -0.296 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)NCCF 337559044 YZPKDBWLTLFDEJ-LURJTMIESA-N 299.262 -0.224 5 20 CBBD CNC(=O)[C@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 341933544 HLSBHWRAEQNUGA-ZETCQYMHSA-N 294.267 -0.216 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1 343677930 LDPZTCNIHQVUCK-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD COC(=O)C[C@@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 366291422 LMZMDXBMBQQGOQ-SSDOTTSWSA-N 298.255 -0.278 5 20 CBBD CCN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H](C)C1=O 426344863 KGQGZVOPDWXLTL-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C)NC1=O 540881446 SMQDRDKBIZPHNP-JTQLQIEISA-N 278.268 -0.022 5 20 CBBD CC1(O)CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 554914701 IFRQCODVUOAYLI-UHFFFAOYSA-N 273.270 -0.255 5 20 CBBD CNc1nccc(C(=O)NCCc2nc[nH]n2)c1[N+](=O)[O-] 577864980 ZYOYXWVJHDQNOR-UHFFFAOYSA-N 291.271 0.122 5 20 CBBD COCCCN(CCO)C(=O)c1ccnc(N)c1[N+](=O)[O-] 581735250 KWNWDUVPPXJALL-UHFFFAOYSA-N 298.299 0.043 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 593815400 KWCIZAIGANYNCI-MWLCHTKSSA-N 298.299 -0.210 5 20 CBBD CNC(=O)CCNC(=O)c1cc([N+](=O)[O-])cn1C 604266256 HIDNQSWIGDGXOZ-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD CON(C)C(=O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 737835709 KUZLYTMPRKPBNS-UHFFFAOYSA-N 285.212 -0.526 5 20 CBBD CON(C)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 776561630 HMZAKNDYZDRQBA-UHFFFAOYSA-N 271.277 -0.140 5 20 CBBD COCC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 795450326 BXROEMQHNNXCEM-UHFFFAOYSA-N 257.202 -0.450 5 20 CBBD O=C(O)CNC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 821533652 XDHTVSZGRNRNFP-UHFFFAOYSA-N 295.207 -0.297 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@H](CC(=O)O)C2)c1[N+](=O)[O-] 832847211 DKFJBSYCEVTOGN-SSDOTTSWSA-N 298.255 -0.058 5 20 CBBD O=C(O)C[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 833220444 UOFCRGSEARDHPW-MRVPVSSYSA-N 270.245 -0.076 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840418047 DQQCKJUTAPLPJH-AXTSPUMRSA-N 258.274 -0.350 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@@H]3CC[C@H](C2)N3)c1 923410086 FDGWHEFTOKSZPA-UMNHJUIQSA-N 281.316 -0.412 5 20 CBBD CCC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1009637039 RSUHUEHFLODAKB-RKDXNWHRSA-N 255.274 -0.268 5 20 CBBD O=C(NCCC1(CNCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1164494408 IUDIXSUKQMPOCV-NXEZZACHSA-N 271.317 -0.480 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CCOCC1 1343164773 ASFYNPYDLCKMRD-UHFFFAOYSA-N 271.277 -0.462 5 20 CBBD O=C(N[C@H]1CCCNC1=O)c1cc([N+](=O)[O-])c[nH]1 50636302 AUSDWEVICSZGIH-ZETCQYMHSA-N 252.230 -0.069 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(O)CCC1 135493910 SAOMCTNMSQUUOH-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD O=C(NC[C@H]1CN2CCN1CC2)c1n[nH]cc1[N+](=O)[O-] 179184780 MBIGKSDUJIXHJZ-QMMMGPOBSA-N 280.288 -0.953 5 20 CBBD CN1CC[C@@H](CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 225270171 VVGGSNMPQYJIFO-CMPLNLGQSA-N 283.332 -0.307 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1(C(=O)O)CCC1 263187204 XEARQWRKAQTQSE-UHFFFAOYSA-N 295.251 -0.120 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])cc1O 274774824 JMHOREACMXUJHT-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)O1 285624202 JZQRFFNRSVZSLA-IYSWYEEDSA-N 283.244 -0.919 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1COC[C@H]1O 296787037 DGIHHHXWSFGGJE-GHMZBOCLSA-N 282.252 -0.151 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@@H](CO)O1 349662450 BIFDMROFICCPTE-IUCAKERBSA-N 296.283 -0.158 5 20 CBBD NC(=O)C[C@H](N)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 353092269 XVMOHPNRNWBKDC-JTQLQIEISA-N 295.299 -0.674 5 20 CBBD O=C1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CN1 358891734 RMICHYCDGIZQGI-ZETCQYMHSA-N 285.281 -0.238 5 20 CBBD NC(=O)NC(=O)CCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359024767 IFWSRGBNXAHLBJ-UHFFFAOYSA-N 296.243 -0.882 5 20 CBBD CO[C@@H]1COC[C@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 564930293 NUJXGPKCNNQGCL-HBNTYKKESA-N 286.288 -0.844 5 20 CBBD O=C(NCc1cnn[nH]1)c1cnc(O)c([N+](=O)[O-])c1 618381946 QRBLEYYEOVZLSI-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1C 763710007 PNUWUJHIFAJYOG-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD CNS(=O)(=O)C[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839700883 NCVMFVGHGMMYRE-IWSPIJDZSA-N 291.329 -0.808 5 20 CBBD COC(C)(C)CCS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842349497 OMBQWHMQSFEUHU-HTQZYQBOSA-N 294.329 -0.087 5 20 CBBD CNc1nccc(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 847572814 UVGDJZRDKYCDSL-UHFFFAOYSA-N 292.259 -0.552 5 20 CBBD CCN(CCNc1ncc([N+](=O)[O-])c(N)n1)C(=O)COC 1106653656 MXRUVMWHDNNRJU-UHFFFAOYSA-N 298.303 -0.126 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@H]2C[C@@]2(CO)C1 1116942195 KNAIGJBLWSNEQD-LDWIPMOCSA-N 252.230 -0.228 5 20 CBBD CCCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 1120797301 DQGOAOHQZVBDLK-ZCFIWIBFSA-N 269.261 -0.038 5 20 CBBD CO[C@@H]1CN[C@](C)(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1573960178 GDFACNJZNFQKEW-JQWIXIFHSA-N 297.315 -0.326 5 20 CBBD CNc1nccc(C(=O)NCCOCC(=O)O)c1[N+](=O)[O-] 1598681684 MGQPKRXJMOANOQ-UHFFFAOYSA-N 298.255 -0.138 5 20 CBBD O=C(O)CCC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 1608704588 NYQNNWJHBHTTJH-UHFFFAOYSA-N 285.212 -0.232 5 20 CBBD O=C1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCN1 21224631 PIOMOCUTBOBXNQ-UHFFFAOYSA-N 285.281 -0.285 5 20 CBBD COCC(=O)N1CCN(Cn2nccc2[N+](=O)[O-])CC1 48621525 IPMPMVGTXJKZKT-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD CC(C)N(CC(N)=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75611830 XDNRFQSHILCMKE-JTQLQIEISA-N 285.304 -0.652 5 20 CBBD CCCC[C@@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 162750637 BFRGHGMUAOGJHK-QMMMGPOBSA-N 270.293 -0.180 5 20 CBBD CN(CCN1CCOCC1)C(=O)Cn1cc([N+](=O)[O-])cn1 171417401 HJQKJURQZYGFQO-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD COCCNCCNC(=O)Cn1cc([N+](=O)[O-])cn1 179387669 BHQVPWWOTRHCAC-UHFFFAOYSA-N 271.277 -0.857 5 20 CBBD CNC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 285401575 ZKOAULMVIHNBKO-UHFFFAOYSA-N 292.295 -0.011 5 20 CBBD C[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)C[C@H](CO)O1 299957675 FTZRKCKRCVUCIY-HTQZYQBOSA-N 256.262 -0.086 5 20 CBBD NS(=O)(=O)N1CCN(c2sccc2[N+](=O)[O-])CC1 301940448 ULXMLYLONGXPQQ-UHFFFAOYSA-N 292.342 -0.018 5 20 CBBD CN1CCC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 331089155 GGFISTZOJIWMNQ-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCCCNC1=O 371574232 ZAUOPHGIFOXQJK-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2nnn(C)n2)c1 430101905 PVKHJRABTRYGFT-UHFFFAOYSA-N 294.227 -0.885 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@H](C)O 442924867 ZHKKIBCOKZIVJO-IMTBSYHQSA-N 285.256 -0.415 5 20 CBBD O=C1C[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CN1 445131027 FLPIZUXSXHCKLK-LURJTMIESA-N 266.213 -0.686 5 20 CBBD O=C(CNC(=O)c1c[nH]nc1[N+](=O)[O-])NCC1CC1 554871295 SEGHDQRNJSAIEW-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD O=C(O)CCCNC(=O)NCCn1cc([N+](=O)[O-])cn1 563077961 KSZWQYDUJDLQMP-UHFFFAOYSA-N 285.260 -0.045 5 20 CBBD CCN(CCO)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 568105897 BLOHOSGMQBBBBD-UHFFFAOYSA-N 297.315 -0.384 5 20 CBBD CN(C)c1noc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])n1 588689881 JTPWPGJLJQBUSM-UHFFFAOYSA-N 281.232 -0.303 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)C2)n1 592973861 AHCAWSBNXRWFSK-OCAPTIKFSA-N 283.240 -0.462 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)CCF 593862931 NSRSHWFDKURLMU-SSDOTTSWSA-N 260.225 -0.372 5 20 CBBD COC(=O)C[C@@H](O)CNc1ncc([N+](=O)[O-])s1 599165013 NXWJBRPZHWLWLL-RXMQYKEDSA-N 261.259 0.387 5 20 CBBD CC(C)c1nnnn1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 788422878 YFBYHNRQUUIMHT-VIFPVBQESA-N 281.276 -0.038 5 20 CBBD C[C@@H]1CN(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 840673050 XDTBDZDMPSDHJV-ZYUZMQFOSA-N 286.284 -0.169 5 20 CBBD Cc1nn(CN2CCCNC(=O)C2)cc1[N+](=O)[O-] 872825787 RDRLMIWRNFWZBT-UHFFFAOYSA-N 253.262 -0.121 5 20 CBBD CN1CC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 928563779 RINICIQSAGTWDG-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD O=C(NC1CN(C(=O)c2ncccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991293165 LCLZQKJPURILDC-RKDXNWHRSA-N 291.267 -0.918 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N[C@H]1C[C@@H](NC(=O)C(N)=O)C1 1059803866 HLBPHAHYASREII-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD CNC(=O)CC(=O)N(C)CCNc1ncccc1[N+](=O)[O-] 1101556658 XQMMEISNOPEBNJ-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1nnnn1C 1116740889 KWTYBXYVAMOQFQ-UHFFFAOYSA-N 294.275 -0.670 5 20 CBBD COC[C@H](C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 49179689 ITHYKEOYFFXMQA-SSDOTTSWSA-N 257.250 -0.415 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](O)C1 127932117 NEMNXBSDDAHWNZ-QMMMGPOBSA-N 287.297 -0.187 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230721457 CUOOZHDVQZUAOT-UHFFFAOYSA-N 296.287 -0.427 5 20 CBBD NC(=O)c1ccc(CN2C[C@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 245712185 PGCQDIKYMJFMTI-WDEREUQCSA-N 295.295 -0.379 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249616186 SUXYVRUSVAJWFD-IEBDPFPHSA-N 297.315 -0.734 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCN[C@@H](C(N)=O)C1 280087344 SDOMQPCINADJET-MRVPVSSYSA-N 282.304 -0.617 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@H](O)C2)c1 304289835 BYJJXERTCMSEHA-UWVGGRQHSA-N 256.262 -0.781 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCN(C)C1=O 330877251 XMTTWTQFZFAKCI-QMMMGPOBSA-N 281.272 -0.553 5 20 CBBD O=C1N[C@H]2CCN(C(=O)c3c[nH]nc3[N+](=O)[O-])C[C@@H]2CO1 495935890 PEJHLXAYQZNXMR-SVRRBLITSA-N 295.255 -0.112 5 20 CBBD C[C@H]1COCCN1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 548941762 HMRGPFAXFRNXGH-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD COCCN1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1=O 558692380 HKKOVXADWQHULM-UHFFFAOYSA-N 296.283 -0.178 5 20 CBBD CNc1nccc(C(=O)N(C)C[C@H](C)O)c1[N+](=O)[O-] 590444859 JGOFUJJWCBTDCN-ZETCQYMHSA-N 268.273 0.484 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 758280067 VTZRHBJTOFSJHD-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD CN(C)C(=O)OCCNC(=O)c1c([N+](=O)[O-])cnn1C 855647561 GTKYDTJHCKPSRD-UHFFFAOYSA-N 285.260 -0.244 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCS(=O)CC1 1115987984 RSXQHWSWISMCQG-UHFFFAOYSA-N 272.286 -0.618 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 1318353749 UWYVMWIZTGWTKV-ZETCQYMHSA-N 281.272 -0.416 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@@H](CO)[C@H](CO)C2)c1 1331431708 DMZNQHQHBGYGEY-UWVGGRQHSA-N 270.289 -0.676 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CC(O)(C(=O)O)C1 1597843806 LRQJNUXQYQZWGP-UHFFFAOYSA-N 270.245 -0.245 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CC2CNC2)c1 1602298787 FTATZWBVVMQZCI-UHFFFAOYSA-N 253.214 -0.326 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H]2CCCO2)c1 37882053 BYTAMAXDRVHIEN-WDEREUQCSA-N 270.289 -0.079 5 20 CBBD C[C@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 159795193 JAEYZJXYWWOETL-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 175633198 QENQXROIPAFVAL-QMMMGPOBSA-N 283.288 -0.368 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H](CO)O1 230419612 LBQPBDDDQGQHNG-IONNQARKSA-N 296.283 -0.206 5 20 CBBD Cc1cc(=O)n(CN(C)S(C)(=O)=O)cc1[N+](=O)[O-] 270550387 BBVSPPFJFCQQLR-UHFFFAOYSA-N 275.286 -0.086 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc(F)cc([N+](=O)[O-])c1N 271240265 DVUTWQQCYCDHCU-ZETCQYMHSA-N 287.247 -0.259 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](C)O 276235453 NRJKBKBZEPMLLJ-WKEGUHRASA-N 297.267 -0.171 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 281103207 LGEWZPUZTWMDQE-GFCCVEGCSA-N 295.299 -0.224 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@H](O)C1CC1 304788099 QBJUAQXSWKBRAO-NEPJUHHUSA-N 284.316 -0.145 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 343052506 QBBHWONBGHLDKJ-UHFFFAOYSA-N 298.303 -0.479 5 20 CBBD COCC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 343927346 OAKDJKIHJBQEIL-SECBINFHSA-N 286.288 -0.387 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)NC(C)(C)C 344450965 AUTFTSRSYAXGMT-ZETCQYMHSA-N 298.303 -0.394 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2cnn[nH]2)c1 352152973 KGRWMKGVTQNHNJ-UHFFFAOYSA-N 279.212 -0.291 5 20 CBBD CN(CC(N)=O)C(=O)c1cc(O)cc([N+](=O)[O-])c1 356349146 UPQNCGMLUZVLFQ-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])o1 358902451 JWEJEZILAPDKIR-JTQLQIEISA-N 272.213 -0.158 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])o2)CCOC1 515355317 FYASBXYCSPDLBR-SNVBAGLBSA-N 269.213 -0.438 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 592477267 UMGZFCBSQWJBSI-DTWKUNHWSA-N 283.288 -0.634 5 20 CBBD CN(CCOCCN)CCn1cc([N+](=O)[O-])cn1 600734593 HSKDIMASLMJRIB-UHFFFAOYSA-N 257.294 -0.302 5 20 CBBD O=[N+]([O-])c1cnc(SC[C@H](O)CO)c(-c2nn[nH]n2)c1 823651995 VHPGDIZYEVLZIM-ZCFIWIBFSA-N 298.284 -0.385 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1COCO1 861967719 HTMPBWBGJNBOLD-VIFPVBQESA-N 284.272 -0.021 5 20 CBBD Cc1[nH]nc(C(=O)NCC2(O)CCN(C)CC2)c1[N+](=O)[O-] 1116200989 DCQZTGUZPULFLE-UHFFFAOYSA-N 297.315 -0.187 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ncnn1C 1116942498 WYTFIWWDKVZTPZ-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD NCC1(O)CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 1332283966 YCLZVYPLCGUQFW-UHFFFAOYSA-N 297.315 -0.506 5 20 CBBD O=[N+]([O-])c1cnc(N2CC[C@@H](CO)[C@@H](O)C2)nc1 1343664499 APNFFIOMIIJCIX-CBAPKCEASA-N 254.246 -0.436 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN[C@@H]3C[C@@H]32)n1 1579970217 RXYHLEXMNDDBGP-RQJHMYQMSA-N 287.301 -0.937 5 20 CBBD O=C(N[C@H]1CC[C@H]1C(=O)O)c1c[nH]nc1[N+](=O)[O-] 1601571556 PDVUXOLQXXDHEB-XINAWCOVSA-N 254.202 -0.089 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCC(=O)O 1604413238 DZHAJDZSFXCFJL-YFKPBYRVSA-N 286.196 -0.066 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H](C(=O)O)C[C@@H](O)C1 1608158700 CQGBPKWPMPFROK-NKWVEPMBSA-N 298.255 -0.764 5 20 CBBD C[C@H](N)C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40835086 CGMNCMIMVIVJOF-VIFPVBQESA-N 279.300 -0.014 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 44666717 LVYGAGNAWAFOMM-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 48802496 XELGQAYNKFOWAD-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCOCCO 180371730 DDKLSARDYHFWFP-UHFFFAOYSA-N 272.261 -0.694 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 264473558 UYBSNYIAVMHXJZ-ZETCQYMHSA-N 281.272 -0.023 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 298056179 CAULAFVKTPIXTI-UHFFFAOYSA-N 282.256 -0.144 5 20 CBBD CCN1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1=O 331517844 UXBCMKKBYCJQQI-UHFFFAOYSA-N 296.287 -0.733 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@]1(O)CCOC1 339104354 XJOWTLOGEKYIDC-LLVKDONJSA-N 299.287 -0.758 5 20 CBBD O=C(NCC(=O)N1CCCC1)c1cc([N+](=O)[O-])n[nH]1 349617540 PDDMXLVVPOIEEV-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD Nc1nc(N[C@@H]2CCc3nnnn3CC2)ncc1[N+](=O)[O-] 420648393 YXXFLWPIYUXRIV-ZCFIWIBFSA-N 291.275 -0.230 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)NCCn1cc([N+](=O)[O-])cn1 426965718 QUUQKUUXVCVDES-ZETCQYMHSA-N 284.276 -0.646 5 20 CBBD Nc1nc(=NCC[C@]2(O)CCCOC2)[nH]cc1[N+](=O)[O-] 593519819 UPVAAKCMNDVPGH-LLVKDONJSA-N 283.288 -0.268 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)C1(O)CCOCC1 748120618 RHPNUYIMMISVCL-UHFFFAOYSA-N 285.256 -0.124 5 20 CBBD O=C(NS(=O)(=O)C[C@H]1CCCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 842299742 SILATKHOZBUWJS-IWSPIJDZSA-N 292.313 -0.333 5 20 CBBD CN(C)c1nc(N)nc(Cn2ncc([N+](=O)[O-])n2)n1 863374655 SODFGOFSEYCXBJ-UHFFFAOYSA-N 265.237 -0.932 5 20 CBBD NC(=O)C(=O)N[C@H]1[C@@H]2CN(c3ncccc3[N+](=O)[O-])C[C@@H]21 1060468509 MHRSFHJROLWRFN-QMSLJYSESA-N 291.267 -0.974 5 20 CBBD COC[C@H](O)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1116485415 WHBGHFHHQYRACA-MRVPVSSYSA-N 286.288 -0.236 5 20 CBBD Cn1cc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1157760356 DLSJJTMKFBLAEG-GHMZBOCLSA-N 281.316 -0.319 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1)C1CC1 1261208649 ARXJOIMZMAVBQP-MRVPVSSYSA-N 283.288 -0.655 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3C[C@@H](CO)[C@H](CO)C3)nn12 1331312727 MYBYRBYEPQADSP-IUCAKERBSA-N 293.283 -0.326 5 20 CBBD O=C1[C@@H]2C[C@@H](O)CN2C(=O)N1CCn1cc([N+](=O)[O-])cn1 1333575609 TVFYHDSHFOJOGM-BDAKNGLRSA-N 295.255 -0.811 5 20 CBBD CNC(=O)CCN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 1341363293 RVYLGYLCYGWCKJ-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CC[C@@H](C)[C@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1594908510 HATQTFWWOOQIHN-MUWHJKNJSA-N 285.260 -0.198 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])NC(CO)CO 87750195 SCBIHLKQMWVJFF-UHFFFAOYSA-N 270.241 -0.557 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCNC(=O)[C@@H]1C 104890750 QDJVIMQPSVYUAC-QMMMGPOBSA-N 295.299 -0.163 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(NC[C@@H](O)CO)n1 236495900 DKKBNQXGMHIUMX-RXMQYKEDSA-N 257.202 -0.547 5 20 CBBD COC(=O)C(C)(C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266558718 WZWIYPDSEXGKAI-SECBINFHSA-N 286.288 -0.307 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286007950 HZTORYGFRUMSMN-SFYZADRCSA-N 284.272 -0.070 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](CO)O1 302785465 VFHUDOMCKMINLT-RQJHMYQMSA-N 269.261 -0.447 5 20 CBBD CN(C)C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 330554249 DERGVNAMQLBHQR-VIFPVBQESA-N 297.315 -0.269 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)CC[C@H]2C1 346073687 LWHFVESOSIGAHT-VIFPVBQESA-N 293.283 -0.376 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@H](CO)O1 349662452 BIFDMROFICCPTE-RKDXNWHRSA-N 296.283 -0.158 5 20 CBBD CN(C)C(=O)COC1CN(c2c([N+](=O)[O-])ncn2C)C1 362129912 OUAMLWFDXAOAES-UHFFFAOYSA-N 283.288 -0.378 5 20 CBBD CC(C)CN(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362526145 QGHDOOVYXDFYFL-UHFFFAOYSA-N 285.260 -0.245 5 20 CBBD Cc1nn(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c(=O)s1 424144796 YDDOJDMNFHWBJB-QMMMGPOBSA-N 285.285 -0.221 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN[C@H](CO)[C@H]1CCCO1 447921120 JLQSDNVIMBPPGB-VXGBXAGGSA-N 297.311 -0.114 5 20 CBBD CNc1nccc(C(=O)N[C@H]2C[C@@H](O)C2)c1[N+](=O)[O-] 566469758 HEIACFXSOKCMHP-LJGSYFOKSA-N 266.257 0.285 5 20 CBBD NC(=O)[C@@H]1CC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 580568798 PQRVMRUKYJWNPK-RKDXNWHRSA-N 281.272 -0.581 5 20 CBBD COC(=O)[C@H]1CNCCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 592553356 JUXMRWJNWOMBIE-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN1Cc1onc(C)c1[N+](=O)[O-] 595456330 FYFPWRDJWYICQP-HTQZYQBOSA-N 285.256 -0.001 5 20 CBBD CCOC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 600410525 JSOPQLZUSSGSMI-SECBINFHSA-N 299.287 -0.550 5 20 CBBD CCNC(=O)CC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 782349972 DLBYMUWYBPXRMW-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 783759974 LBBSLJAFOZJWHY-SSDOTTSWSA-N 293.283 -0.125 5 20 CBBD NC(=O)[C@]1(O)CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C1 804645984 JDXIYLKXWZAVCZ-NSHDSACASA-N 296.239 -0.071 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 814042338 ICUBQVLYPVNRRS-MADCSZMMSA-N 299.283 -0.085 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)c1nn(C)cc1[N+](=O)[O-] 820539762 XNEFKXPODBYSFU-UHFFFAOYSA-N 299.287 -0.583 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1COCO1 861964153 FZVRRLDEPGEKHS-QMMMGPOBSA-N 256.218 -0.720 5 20 CBBD CN(CCS(C)(=O)=O)c1c([N+](=O)[O-])cnn1C 892310275 OEZAUDHUNYFVBJ-UHFFFAOYSA-N 262.291 -0.191 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C(N)=O)C1 1116428299 MQVMYHVMOIMCIU-ZETCQYMHSA-N 281.272 -0.334 5 20 CBBD Cc1noc(CN2CCO[C@H](C(N)=O)C2)c1[N+](=O)[O-] 1118494135 AKHIQCBQVCMNMV-QMMMGPOBSA-N 270.245 -0.423 5 20 CBBD COCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1122316267 GKLQPFSLQRARGN-UHFFFAOYSA-N 271.277 -0.820 5 20 CBBD COCCOC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319483337 TXZLPRUZPYXCRQ-UHFFFAOYSA-N 256.214 -0.054 5 20 CBBD O=C1CCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319608330 LSDJPKVLTSYZAR-UHFFFAOYSA-N 265.225 -0.095 5 20 CBBD C[C@H](CS(C)(=O)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1319718850 YFIANTYIJFAYNR-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD Cc1nnc(CCNC(=O)Cn2cnc([N+](=O)[O-])n2)s1 1327724278 VYDGBMWDVOMZRO-UHFFFAOYSA-N 297.300 -0.295 5 20 CBBD N[C@@H](CO)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 1574261945 HELXGEDSGUFDCK-LBPRGKRZSA-N 294.311 -0.437 5 20 CBBD CN(C)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 122819702 LAEZHRPDADSDDP-UHFFFAOYSA-N 253.262 -0.137 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(NC(=O)C2CC2)C1 189383562 LVCXWZFYHJAPRW-UHFFFAOYSA-N 293.283 -0.321 5 20 CBBD CCOC(=O)c1ccnc(N(CCO)CCO)c1[N+](=O)[O-] 267019525 IMIUDGDRWCRJDQ-UHFFFAOYSA-N 299.283 -0.043 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 283029165 OUSNHPOCJVCNPF-SECBINFHSA-N 281.272 -0.472 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2cnn(C)n2)c1=O 289399294 SJLIQJWGZZACBV-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD NC(=O)c1ccc(N2CC[C@](O)(C(N)=O)C2)c([N+](=O)[O-])c1 314834045 GEQACSQDWPEURH-GFCCVEGCSA-N 294.267 -0.880 5 20 CBBD C[C@](O)(CO)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 338624891 SDLXDBGFAFAIMV-SNVBAGLBSA-N 271.229 -0.832 5 20 CBBD COCCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 340954653 MDTUTDHPVULLJS-UHFFFAOYSA-N 255.230 -0.108 5 20 CBBD CN1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 343333139 GHIXGBRTFLXJJA-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD Cn1cncc1CNC(=O)c1cc([N+](=O)[O-])nn1C 355254507 JUCHLPWTOXWOKW-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CC[C@@H](CO)O2)c1[N+](=O)[O-] 356542887 GOLSUXUUIZOMMC-YUMQZZPRSA-N 284.272 -0.104 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 592006810 WVJWJZYSZQHBJZ-NKWVEPMBSA-N 297.271 -0.673 5 20 CBBD NC(=O)[C@@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CCO1 611525710 SHBIOKQBAVULFD-JTQLQIEISA-N 296.283 -0.640 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCN(C)C(=O)C1 615929320 ZRVDWRKHMIFLKB-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD O=C(O)C1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 819281173 MDXYUHWOJGVQMH-NSHDSACASA-N 298.299 -0.051 5 20 CBBD CNc1ccc(C(=O)NC[C@H](O)C(=O)O)cc1[N+](=O)[O-] 833700165 FMSFZSRBDSISGU-VIFPVBQESA-N 283.240 -0.188 5 20 CBBD CN(C(=O)C1CC1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953469391 CIWTZZVMBIIHLU-NXEZZACHSA-N 267.285 -0.269 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CC[C@H](C1)N2CCCO 1029304919 NSWGOLRDROEOTP-WRWGMCAJSA-N 283.328 -0.291 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCn2cccn2)C1 1042711118 QXWFINGRKVLGPU-VXGBXAGGSA-N 293.327 -0.309 5 20 CBBD CC(C)=CC(=O)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543841 ZVSGFWSHMIAZPJ-GHMZBOCLSA-N 299.327 -0.445 5 20 CBBD CN(CCCNC(=O)CC(N)=O)c1ncccc1[N+](=O)[O-] 1095502740 FSRWZCPXSIERKU-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)NC(=O)[C@@H]2C1 1116504540 NKVPCHKZFPEXFX-LURJTMIESA-N 280.244 -0.931 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 1321215338 BBNHLYFJHYVYSV-ZETCQYMHSA-N 271.229 -0.423 5 20 CBBD O=C(NCCN1C(=O)CSC1=O)c1c[nH]nc1[N+](=O)[O-] 1322720534 MRWGWGXIWPBPDV-UHFFFAOYSA-N 299.268 -0.257 5 20 CBBD CNC(=O)[C@@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 1330043299 QXPZCBBFBJDRCK-QMMMGPOBSA-N 282.256 -0.353 5 20 CBBD CN(C)[C@@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C[C@H]1O 1777036993 SWXHBVNUAMHXEO-NXEZZACHSA-N 296.283 -0.201 5 20 CBBD NC(=O)CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 43784461 LCLRAQKNHCFKEU-UHFFFAOYSA-N 265.273 -0.403 5 20 CBBD O=[N+]([O-])c1c(N2CCNCC2)ncnc1N1CCOCC1 165833335 RGBVHQLBRDSZRM-UHFFFAOYSA-N 294.315 -0.369 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCNC(=O)N(C)C 179572265 AURZJNLRZBQVPD-UHFFFAOYSA-N 298.303 -0.513 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NCCn1cc([N+](=O)[O-])ccc1=O 193661090 FISIAIIDJGUWSL-BXKDBHETSA-N 294.311 -0.129 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCNC(=O)C1 230691603 QIFJQDBXKHBCLH-UHFFFAOYSA-N 279.256 -0.466 5 20 CBBD C[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1CO 248910814 IXPSBSOCJWHIOH-YUSALJHKSA-N 284.316 -0.145 5 20 CBBD C[C@H](O)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 270875370 NQGLAMGMHQFMRF-QMMMGPOBSA-N 297.267 -0.147 5 20 CBBD COC(=O)[C@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)OC 292403058 VBDZPKMRKAORDC-QMMMGPOBSA-N 298.255 -0.311 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 330445782 RCPHSSPMXGOAJY-SSDOTTSWSA-N 281.272 -0.403 5 20 CBBD Cn1cc([C@H](CO)Nc2ncc([N+](=O)[O-])c(N)n2)cn1 339702126 RIHFBQJODLBOBV-ZETCQYMHSA-N 279.260 -0.154 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 344212330 HCJYBMYWELOLTN-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD Nc1nc(N[C@@H]2CCCS(=O)(=O)C2)ncc1[N+](=O)[O-] 345637505 ARCHOZJDAGEKCJ-ZCFIWIBFSA-N 287.301 -0.044 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)S(N)(=O)=O 349080911 RYGLNLMBGLRGTH-RXMQYKEDSA-N 276.274 -0.670 5 20 CBBD CCOC(=O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 352935514 PLFWKSMDIBOMIQ-UHFFFAOYSA-N 299.287 -0.014 5 20 CBBD Nc1noc(CCNC(=O)c2c(N)cccc2[N+](=O)[O-])n1 354499502 BSSMAJWVXFYRFH-UHFFFAOYSA-N 292.255 0.115 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N(C1CC1)[C@H]1CCNC1 435244919 JBOPYMBEZUPRMZ-VIFPVBQESA-N 280.288 -0.461 5 20 CBBD Cn1cc([C@@H](CO)NCCn2ccc([N+](=O)[O-])n2)cn1 494803999 ABKQHVXUTRAURO-SNVBAGLBSA-N 280.288 -0.152 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2CC[C@H]2O)c1[N+](=O)[O-] 564101037 WOGDUMVRAPAJSB-HTQZYQBOSA-N 266.257 0.285 5 20 CBBD CN(CCN1CCNCC1)C(=O)Cn1cc([N+](=O)[O-])cn1 592469511 SHZVSSDVBGWAJH-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD C[C@]1(C(=O)O)CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 595250873 OKECSAZRNNRGBU-CPCISQLKSA-N 297.271 -0.054 5 20 CBBD CC[C@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(=O)NC 596260302 ILFVEBDSANDIPV-ZETCQYMHSA-N 253.262 0.509 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc2ncc([N+](=O)[O-])n2n1 808047825 APROUIMPZLFNRW-ZCFIWIBFSA-N 280.244 -0.844 5 20 CBBD O=[N+]([O-])c1cnc(NCCOCCO)c(-c2nn[nH]n2)c1 823652310 ZPARAPRWCIDYQF-UHFFFAOYSA-N 295.259 -0.409 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCN1CCC1 861386462 AFXHVRHLKPTNGA-UHFFFAOYSA-N 255.234 -0.565 5 20 CBBD CCN1CCN(c2c([N+](=O)[O-])cnn2C)CC1=O 893163238 DRRXCCMYNFFIPA-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD CN(CCN(C)c1ncc([N+](=O)[O-])cc1F)C(=O)C(N)=O 1105543456 BNYQXNKQVUJDFY-UHFFFAOYSA-N 299.262 -0.491 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1csc([N+](=O)[O-])c1 1324269147 VUILPZPEWLTQNR-YFKPBYRVSA-N 259.243 -0.768 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](CN)C1 1326093293 QKICNAXLURRGKX-ZETCQYMHSA-N 269.261 -0.872 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@]2(CCNC2)C1 1327121719 PJDNWJMYFRLUHG-NSHDSACASA-N 280.288 -0.602 5 20 CBBD Cn1ncc(Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)n1 1608157570 BIEJVCSUPSPAJX-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD C[C@H](CCCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 94943784 BGOOTWCJJHRNEH-KOLCDFICSA-N 272.305 -0.097 5 20 CBBD COC(=O)[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 103134561 PJPGGYZUTHLLTO-VIFPVBQESA-N 270.245 -0.377 5 20 CBBD COc1c(C(=O)NCC(N)=O)cccc1[N+](=O)[O-] 137570428 VQGSMDTXIIINSL-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD NC(=O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N 219658841 CHSDAXJNWJFZJC-UHFFFAOYSA-N 256.193 -0.469 5 20 CBBD COC(=O)CNC(=O)Cn1cc([N+](=O)[O-])c(C)cc1=O 268452545 BECYHCSMPRLFTG-UHFFFAOYSA-N 283.240 -0.646 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)CNc1ccccc1[N+](=O)[O-] 272304870 XHTIRIDQZZBNTM-SECBINFHSA-N 297.267 -0.343 5 20 CBBD C[C@@H]1NC(=O)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337797505 XDNALHFKPRHDLB-NKWVEPMBSA-N 281.272 -0.275 5 20 CBBD COC[C@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 340550229 LOBCITYLNORBHD-VIFPVBQESA-N 286.288 -0.387 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 354061267 NCEJJZMGUZLFLO-SSDOTTSWSA-N 281.272 -0.036 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CCn2cncn2)c1=O 358065787 NKHKZPLTXJEIGO-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 359799648 SQNBVZUWDKTJRP-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD CCC[C@@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362524086 HIYLWHZXARGQRW-SNVBAGLBSA-N 285.260 -0.054 5 20 CBBD Nc1nc(N2CCN(C3COC3)CC2)ncc1[N+](=O)[O-] 368581551 GWIAHXQTBCNCTG-UHFFFAOYSA-N 280.288 -0.512 5 20 CBBD O=C(NC[C@@H](O)CO)C(=O)Nc1cccc([N+](=O)[O-])c1 442553190 KUDBUWPMUHPEDA-SECBINFHSA-N 283.240 -0.997 5 20 CBBD O=C1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CN1CC1CC1 549773982 SMZMKTOABYZESF-UHFFFAOYSA-N 279.256 -0.030 5 20 CBBD C[C@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])CCN1 566216526 JRLLEZIMTBKREF-QMMMGPOBSA-N 286.313 -0.028 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H]1O 590553668 ICCKVMVIGYCHKS-YUMQZZPRSA-N 269.257 -0.065 5 20 CBBD NC(=O)CCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 743309325 XHGMWNYEGWHKGD-UHFFFAOYSA-N 291.267 -0.064 5 20 CBBD CN1C(=O)CN(NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1=O 765229583 KRNIVELULMBMIT-UHFFFAOYSA-N 294.227 -0.658 5 20 CBBD O=C1CC[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CN1 809017138 FWHAUFJFXZXJAL-ZETCQYMHSA-N 268.229 -0.387 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@H]21 816959270 ZGTOTNPOTSAFND-BDINMYNLSA-N 280.240 -0.191 5 20 CBBD Nc1ccc(NC(=O)NC[C@H](O)CO)cc1[N+](=O)[O-] 823973720 KXAAHKGQQYIELN-ZETCQYMHSA-N 270.245 -0.348 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC(CCO)C1 826496657 CXKHFUDKTQMKKK-UHFFFAOYSA-N 291.271 -0.012 5 20 CBBD NC(=O)CC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093539065 STGPSWVOWVDWNE-UHFFFAOYSA-N 267.245 -0.607 5 20 CBBD O=C1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 1319354322 FRDLGGSJGPACGG-MRVPVSSYSA-N 267.245 -0.814 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]1(C(=O)O)CCOC1 1343713118 SIJSMSVFGXHOLU-JTQLQIEISA-N 284.228 -0.698 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCc1nc[nH]n1 1344524302 QDTQLWMTBUMPJX-UHFFFAOYSA-N 293.287 -0.033 5 20 CBBD CN1CCN(c2nnc(C[N+](=O)[O-])n2CC2CC2)CC1=O 1527131655 ZBPAPCMKPIVRQE-UHFFFAOYSA-N 294.315 -0.257 5 20 CBBD CN(CCOCCN)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1578473638 IHJCHFNHAUMRFF-UHFFFAOYSA-N 298.299 -0.810 5 20 CBBD CN1CC[C@H](Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)C1=O 1598584382 XSXVYOIHNWOJLX-SSDOTTSWSA-N 295.251 -0.067 5 20 CBBD O=C(O)c1cnc(N2CCC(CO)(CO)C2)c([N+](=O)[O-])c1 1602525374 JPBQSJDOIFFIES-UHFFFAOYSA-N 297.267 -0.131 5 20 CBBD COc1cc(CN[C@H](CO)C(=O)O)c([N+](=O)[O-])cc1O 1777301062 QCURLRXAAKIXAC-SSDOTTSWSA-N 286.240 -0.156 5 20 CBBD CNC(=O)CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 25265567 KGSPNBSJQLPUBC-UHFFFAOYSA-N 294.267 -0.813 5 20 CBBD NC(=O)C1(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCOCC1 56326818 FBDZXKVVCDFHEL-UHFFFAOYSA-N 296.283 -0.065 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CCNC1 179050124 HRNXMLCODUYZBA-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H](C)O)c1 193084769 VLVLNHZBLDCMHU-ZCFIWIBFSA-N 256.214 -0.076 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NCCn1cc([N+](=O)[O-])ccc1=O 193661130 FISIAIIDJGUWSL-CABZTGNLSA-N 294.311 -0.129 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 227871904 VATOCYLXAHDEDM-BYPYZUCNSA-N 259.243 -0.768 5 20 CBBD CC1(C)CNC(=O)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 282713183 PSCAQQVPNJHCAM-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@]1(CO)CCOC1 330896774 SWKIHFGQYWJRRE-LLVKDONJSA-N 284.272 -0.551 5 20 CBBD O=C(NC[C@H](O)COCC1CC1)c1cc([N+](=O)[O-])n[nH]1 354066248 UKQZBOIXQJGGBE-QMMMGPOBSA-N 284.272 -0.165 5 20 CBBD C[C@@H]1CS(=O)(=O)C[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 356613717 YMORPXNEEAOWEF-IYSWYEEDSA-N 288.285 -0.519 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cn1C 548138500 LCGJWZSQDSXNAT-GFCCVEGCSA-N 299.283 -0.023 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(CO)CO 566423240 CMORQSMZOCRRHF-UHFFFAOYSA-N 283.284 -0.215 5 20 CBBD Nc1nccc(C(=O)N2CC(O)(C(F)F)C2)c1[N+](=O)[O-] 566466131 KSUCADXNTJEDCZ-UHFFFAOYSA-N 288.210 0.024 5 20 CBBD C[C@]1(C(=O)O)CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 595250874 OKECSAZRNNRGBU-HQJQHLMTSA-N 297.271 -0.054 5 20 CBBD CC(CO)(CO)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 596246739 YNNZOPGEGDFEBY-UHFFFAOYSA-N 284.272 -0.509 5 20 CBBD NC(=O)c1ccnc(NCCN2CC[C@@H](O)C2)c1[N+](=O)[O-] 599176019 OKHIAWRGIODUPT-MRVPVSSYSA-N 295.299 -0.433 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 600457532 IXJHDHOTHOLHNB-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NN2CC(=O)NC2=O)c1 743288397 VHXSCTSVISCVGS-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD CS(=O)(=O)Oc1ccc([N+](=O)[O-])cc1-n1cnnn1 755279328 JCUHFMDDPGWGIT-UHFFFAOYSA-N 285.241 -0.091 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NS(=O)(=O)C1CCC1 774285339 ZCDHQXAHLSDEGS-UHFFFAOYSA-N 288.285 -0.210 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1COC(=O)C1 816676686 LQDSKVRQJZOTNL-ZETCQYMHSA-N 268.229 -0.387 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@H]21 816964112 KDGGTFDQBFAMQJ-JZYVYDRUSA-N 294.267 -0.331 5 20 CBBD COCCO[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839731562 SVZWVVMBFPKZAB-OPRDCNLKSA-N 258.274 -0.085 5 20 CBBD C[C@@H](COC(=O)CN1CC(=O)N(C)C1=O)[N+](=O)[O-] 860777049 JVMXUPAHBQPCEM-LURJTMIESA-N 259.218 -0.911 5 20 CBBD CCCCNC(=O)CN1CCN(CC[N+](=O)[O-])CC1 929131487 AFQQZZFWKXFKOH-UHFFFAOYSA-N 272.349 -0.203 5 20 CBBD Cc1nocc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991291974 AHERMMLNHSXPBN-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD CC(C)OCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093512754 ZEQWZTOAGRONPY-UHFFFAOYSA-N 298.303 -0.080 5 20 CBBD O=C(O)[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccn1 1601664037 BEPOQJAEBZKDRW-FTLITQJKSA-N 265.225 -0.011 5 20 CBBD C[C@@](O)(CNC(=O)c1cccc([N+](=O)[O-])c1O)C(=O)O 1604373373 PDILHUXVXFAFRO-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD O=C(O)CNC(=O)CNC(=O)c1ccccc1[N+](=O)[O-] 35097114 PANNKLQBGWJDJX-UHFFFAOYSA-N 281.224 -0.475 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCCO1 49121204 RBWWELIIOKVMIF-QMMMGPOBSA-N 269.261 -0.128 5 20 CBBD Cc1cc(C(=O)NC(CO)CO)cc([N+](=O)[O-])c1 128706065 BBUSECYQEYQKGD-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD NC(=O)C[C@H](N)C(=O)NCCc1ccccc1[N+](=O)[O-] 353706488 FFVLSMQVVKWTDP-VIFPVBQESA-N 280.284 -0.544 5 20 CBBD C[C@@]1(C(N)=O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361558175 VAXNRHASEZXPSG-ZYHUDNBSSA-N 297.315 -0.651 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 449693191 CRIIAITXKIFTBV-JTQLQIEISA-N 294.311 -0.066 5 20 CBBD CC[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 598197376 WSXMLYULIUCSHH-MRVPVSSYSA-N 256.262 -0.013 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CC[C@H](O)C2)c1[N+](=O)[O-] 600809575 VALVALKRCBRICH-QMMMGPOBSA-N 283.288 -0.577 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1CC(n2cncn2)C1 732829929 IPTNGRCPSCIGBB-UHFFFAOYSA-N 290.239 -0.016 5 20 CBBD Nc1nonc1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 761388752 IAEOUWNRQLTUAZ-UHFFFAOYSA-N 295.211 -0.421 5 20 CBBD Cc1nn(CCC(=O)Nn2cnnc2O)c(C)c1[N+](=O)[O-] 777767739 IIBWASIGJQKLAJ-UHFFFAOYSA-N 295.259 -0.134 5 20 CBBD C[C@H]1[C@@H](C)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCS1(=O)=O 839686125 LEVBBTKQBUVKIH-BZNPZCIMSA-N 276.314 -0.314 5 20 CBBD C[C@H](CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1117845722 VUCRXLOBAPRIOO-SSDOTTSWSA-N 282.256 -0.863 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@H]2CCNC2=O)c1[N+](=O)[O-] 1319984969 RYKARVSDNHACHO-ZETCQYMHSA-N 281.272 -0.403 5 20 CBBD O=C(NCC1(O)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1320426352 NSJSJAXBBQARCZ-UHFFFAOYSA-N 270.245 -0.411 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 1320490566 MMRYEKNBILOILR-ZCFIWIBFSA-N 267.245 -0.413 5 20 CBBD C[C@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@@H]1CO 1338724914 XCPKFEQPBZJWPY-GXSJLCMTSA-N 295.295 -0.014 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NCC[C@H](O)C(=O)O)n1 1597899613 NBWVLDNHWSGOAL-ZETCQYMHSA-N 286.244 -0.623 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1ccc([N+](=O)[O-])cc1 40507800 GDADBLHYLSWXOB-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD CCNC(=O)CN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 65791854 QTQLGJKXTLKGMH-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD O=C(NCCc1ccccc1[N+](=O)[O-])c1n[nH]c(=O)[nH]1 75158429 ALXVGJOLQSFUCO-UHFFFAOYSA-N 277.240 -0.021 5 20 CBBD C[C@H](O)C(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 152767349 DNDJKBYORIGQTJ-JTQLQIEISA-N 297.315 -0.684 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H](C)O[C@@H](CO)C2)c1[N+](=O)[O-] 187881463 KECDIBWWQSLZLQ-VXNVDRBHSA-N 298.299 -0.141 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 195143955 JLKGCXNNFHLIRQ-MUWHJKNJSA-N 293.283 -0.174 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC2OCCO2)c1 271926967 GHPUCDNYYPUAGK-UHFFFAOYSA-N 284.224 -0.084 5 20 CBBD COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286092682 WJVLETVRAIQGAD-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD CCOC1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 296153761 MUDNBFKZKXCHRV-SNVBAGLBSA-N 270.289 -0.127 5 20 CBBD CC(C)NC(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 343106096 JIYKKHBEYODAJW-UHFFFAOYSA-N 255.234 -0.428 5 20 CBBD CCn1cc(S(=O)(=O)NCCN)c([N+](=O)[O-])n1 353221963 YKGNMMCGDRNRRT-UHFFFAOYSA-N 263.279 -0.952 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)OC[C@H]2C1 362221063 NUESZFPUQZCCKF-MRVPVSSYSA-N 295.255 -0.546 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCCC[C@H]1O 428610644 KXFPBNSFBKCDTH-RKDXNWHRSA-N 283.288 -0.052 5 20 CBBD CNC(=O)CCCNC(=O)NCCn1cc([N+](=O)[O-])cn1 489950545 DMOYBDCFMWHYKH-UHFFFAOYSA-N 298.303 -0.383 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 494649160 QDINYSNUAZLUKT-KOLCDFICSA-N 298.299 -0.210 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@H]2C[C@@H]21 590433969 XTEVZGZJJFXLPI-XPUUQOCRSA-N 252.230 -0.058 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@H]2COC[C@H]2C1 601974001 RFZQLXQZOWYBPA-DTORHVGOSA-N 266.257 -0.104 5 20 CBBD O=[N+]([O-])c1c(N2C[C@H](O)[C@H](O)C2)nc2ccccn12 747819682 FTQRQRVTSMXHQX-OCAPTIKFSA-N 264.241 -0.216 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC(=O)[C@@H]1CCOC1 762863500 BJWJWSWMWVDPQV-MRVPVSSYSA-N 283.240 -0.060 5 20 CBBD CC(C)(C(=O)O[C@H]1CCNC1=O)n1cc([N+](=O)[O-])cn1 806003072 QAAKHMNMRKTSSM-QMMMGPOBSA-N 282.256 -0.042 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1COC(=O)C1 820083162 PHPKRGBLTBSIOM-QMMMGPOBSA-N 282.256 -0.078 5 20 CBBD CNC[C@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 843078595 QUMMENGPWZDQSM-NWDGAFQWSA-N 269.301 -0.202 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCC[N+](=O)[O-] 860915459 HAUBWAWLIQJOJT-UHFFFAOYSA-N 259.178 -0.604 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCNCC1 923279102 FAKUYJBHVYMTKU-GFCCVEGCSA-N 283.332 -0.164 5 20 CBBD CN(CCNS(C)(=O)=O)c1c([N+](=O)[O-])ncn1C 1318457389 SJKNCBYGYZQBBW-UHFFFAOYSA-N 277.306 -0.686 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[C@]2(CO)C1 1320586861 LCFVDTVKAHICJX-WRWORJQWSA-N 266.257 -0.217 5 20 CBBD C[C@@H](O)CCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1329400935 SDFOVPQQOJNULD-ZCFIWIBFSA-N 255.230 -0.374 5 20 CBBD Nc1c([N+](=O)[O-])cnn1C[C@@H]1CCS(=O)(=O)C1 1344056399 ITXQQHROJVAOIM-LURJTMIESA-N 260.275 -0.192 5 20 CBBD CC(C)[C@@H](C(N)=O)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589419163 FOEJWLRIRZVYRF-ZETCQYMHSA-N 280.248 -0.346 5 20 CBBD C[C@]1(C(=O)O)CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 1776508531 LFNRHXTZOZDWMA-SNVBAGLBSA-N 283.244 -0.353 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@H](O)CO)c2nonc12 90281690 VHCGYSYGVTYUJI-YFKPBYRVSA-N 254.202 -0.104 5 20 CBBD C[C@@H]1CCNC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 186707002 ZFSLFOSAOWNECT-SCZZXKLOSA-N 267.289 -0.095 5 20 CBBD O=C(Cn1cn[nH]c1=O)Nc1ccc(O)c([N+](=O)[O-])c1 189796006 JREOPDDRQJNSBW-UHFFFAOYSA-N 279.212 -0.176 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](O)C2)c1 236607447 VRXWDOWEIYOXSK-UWVGGRQHSA-N 268.225 -0.165 5 20 CBBD O=C1C[C@H](N(C(=O)c2cc([N+](=O)[O-])[nH]n2)C2CC2)C(=O)N1 286082153 TTXRGZUDAOIBAG-ZETCQYMHSA-N 293.239 -0.662 5 20 CBBD CN1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 298658139 BNHBUVWUYVBANE-UHFFFAOYSA-N 280.284 -0.470 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CC(=O)N(C)C1 299606171 DNZOEDAJIPERRK-MRVPVSSYSA-N 281.272 -0.553 5 20 CBBD C[C@@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC(=O)N1C 337437723 DJQCFXOGOUYDIT-MRVPVSSYSA-N 267.289 -0.009 5 20 CBBD CCN(CCC(=O)OC)C(=O)Cn1cnc([N+](=O)[O-])n1 338845672 FDGWJMXOSNNRBH-UHFFFAOYSA-N 285.260 -0.402 5 20 CBBD COC(=O)[C@@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 348110124 MCWPNERSTDSAST-LLVKDONJSA-N 284.272 -0.287 5 20 CBBD C[C@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])nn1C 356472156 YMLNAVMOQQYDIF-SSDOTTSWSA-N 279.260 -0.262 5 20 CBBD C[C@H]1CN(CCNC(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 558749128 QPDBIPNVFSXXGU-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD Nc1nccc(C(=O)N2CCN(CCO)CC2)c1[N+](=O)[O-] 578694578 KYGNNXLBBRXYIG-UHFFFAOYSA-N 295.299 -0.678 5 20 CBBD O=C(CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])NCCO 593530149 ULCUTINPELUKMF-UHFFFAOYSA-N 299.258 -0.499 5 20 CBBD CCNC(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 766972786 KUGDHENJXNSJBW-UHFFFAOYSA-N 256.218 -0.379 5 20 CBBD CC(C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 826630886 YLFUVCVJYQYDNI-MRVPVSSYSA-N 272.261 -0.395 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCc1nc[nH]n1 1325105167 WZDPYAUZTXXAMU-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD C[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1nnnn1C 1338258945 YFQDTSVWKFPDES-ZETCQYMHSA-N 294.275 -0.418 5 20 CBBD NC(=O)c1ccnc(N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 1594653113 DRAYOEATPWGVNY-ZETCQYMHSA-N 296.239 -0.622 5 20 CBBD O=C(O)C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 91293487 PVCNCHCLCZDLDM-SECBINFHSA-N 298.255 -0.507 5 20 CBBD Cc1nn(CCC(=O)NS(C)(=O)=O)c(C)c1[N+](=O)[O-] 102594718 DSHCOLZQTYURAG-UHFFFAOYSA-N 290.301 -0.126 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 227046888 YTTUGOIPGHLSQI-ZETCQYMHSA-N 271.229 -0.803 5 20 CBBD C[C@@H]1C[C@@H](CN)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 261691222 INVLLAOXZOCQJC-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD CCCNC(=O)NC(=O)Cn1cccc([N+](=O)[O-])c1=O 263686701 QGXMGLJWFXJUGT-UHFFFAOYSA-N 282.256 -0.008 5 20 CBBD CNC(=O)C[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 322770510 IEDBZPUPXZPFFM-PSASIEDQSA-N 285.304 -0.734 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 347521777 ARKORITYYDTXEN-UHFFFAOYSA-N 269.261 -0.076 5 20 CBBD CNc1nccc(C(=O)NCC(=O)NC(C)C)c1[N+](=O)[O-] 561334222 ZZLAXTPVGPCABS-UHFFFAOYSA-N 295.299 0.286 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H](CO)C2CC2)c1 565422058 LCMQNVNIFKNXAX-PWSUYJOCSA-N 284.316 -0.240 5 20 CBBD C[C@@H](NC(=O)C(=O)NC1CNC1)c1cccc([N+](=O)[O-])c1 576612169 XUWGRYHRMODEAH-MRVPVSSYSA-N 292.295 -0.140 5 20 CBBD COCCN(CC(=O)O)C(=O)c1n[nH]cc1[N+](=O)[O-] 592366704 JWEKJTIVTXLXDF-UHFFFAOYSA-N 272.217 -0.509 5 20 CBBD NC(=O)CC1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 619537248 KGJRMWCEWDWTJV-UHFFFAOYSA-N 279.256 -0.249 5 20 CBBD NC(=O)CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 749416059 UHLLBIOOUBOHHT-UHFFFAOYSA-N 277.240 -0.454 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 763698722 LZZVEWJIVRKZLR-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H](C)N1CCOCC1 839658988 WCBZAJMQVTZUJH-GWOFURMSSA-N 271.317 -0.123 5 20 CBBD COC(=O)C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839702565 YCWLEPIALSQAEF-DJLDLDEBSA-N 272.257 -0.558 5 20 CBBD C[C@@](CC(=O)O)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 864199764 XMYJRZADLQHPIX-NSHDSACASA-N 297.271 -0.054 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)C2)c1[N+](=O)[O-] 1317967294 RXXIVQWRTDRHCB-UHFFFAOYSA-N 267.245 -0.791 5 20 CBBD O=[N+]([O-])c1c(N2CC[C@H](CO)[C@@H](O)C2)ccnc1O 1333710846 XISDAIODZXVHNN-APPZFPTMSA-N 269.257 -0.125 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CCO[C@H](C)C1 1355638018 BCEVGIUDDOBVQH-SECBINFHSA-N 285.304 -0.074 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@]1(C)C(=O)O 1599918345 AWQWVZPYZVXNNX-CPCISQLKSA-N 297.271 -0.245 5 20 CBBD C[C@@H](O)[C@H](O)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603694202 QGQGWWXFAAZHEF-LHLIQPBNSA-N 294.271 -0.072 5 20 CBBD O=C(O)[C@]12COC[C@H]1CN(Cn1nccc1[N+](=O)[O-])C2 1606458905 NRNWKBDAMAPHGE-LDYMZIIASA-N 282.256 -0.218 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 26011889 AIALRXWMDUYGCZ-LURJTMIESA-N 282.256 -0.463 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN(CCO)CC1 49773788 COYTZPPIOOJFQW-UHFFFAOYSA-N 283.332 -0.290 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1nccc1[N+](=O)[O-] 117551539 WPKBISRODFFYSH-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 191729462 GRDCXSNMPCZQCL-WCBMZHEXSA-N 284.272 -0.601 5 20 CBBD C[C@@H](N)[C@H]1CN(c2nn(C)cc2[N+](=O)[O-])CCO1 231672437 ZHAFFXKQUDKUSG-VXNVDRBHSA-N 255.278 -0.119 5 20 CBBD C[C@H](CN)N(C)C(=O)CCn1cc([N+](=O)[O-])cn1 237604473 QZQTWQAIGPTXAN-MRVPVSSYSA-N 255.278 -0.013 5 20 CBBD Cc1cc(N2CCN[C@H](C(N)=O)C2)ncc1[N+](=O)[O-] 266806267 DPSFKZCDNBZWFY-QMMMGPOBSA-N 265.273 -0.438 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@]1(CCO)CCOC1 331353180 XXVNUGZKQQFACO-NSHDSACASA-N 284.272 -0.551 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@H]1CS(=O)(=O)CCO1 351507116 XPAAIJIDYZVNTH-ZETCQYMHSA-N 290.301 -0.446 5 20 CBBD C[C@@H]1OCC[C@H]1N(CCO)c1ncc([N+](=O)[O-])c(N)n1 360256607 HBIOOIDXMIOULD-JGVFFNPUSA-N 283.288 -0.057 5 20 CBBD NS(=O)(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cn1 531643990 CLPMCOACYCUNRH-UHFFFAOYSA-N 288.285 -0.602 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 600458555 MUOMNQSPIONLSM-SSDOTTSWSA-N 299.239 -0.651 5 20 CBBD COC[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 755641201 MKZNLTDPNSQPRQ-ZETCQYMHSA-N 283.240 -0.470 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCn1cncn1 766623772 DHUWHCZGYDIDLG-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD Cc1nn(CCC(=O)NOCCO)c(C)c1[N+](=O)[O-] 776583646 CPVRZKNVNKHMIY-UHFFFAOYSA-N 272.261 -0.162 5 20 CBBD C[C@]1(C(N)=O)CCN(Cn2nccc2[N+](=O)[O-])C1 794708477 BRCDISTUFIIWQC-JTQLQIEISA-N 253.262 -0.054 5 20 CBBD O=C1N[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC[C@@H]2CO1 844120840 HSECVKJTZNMRHZ-RQJHMYQMSA-N 295.255 -0.112 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc(N)c([N+](=O)[O-])n1 853535593 XBEFJOHARUZIAD-ZCFIWIBFSA-N 255.234 -0.909 5 20 CBBD CNC(=O)[C@H](O)CNc1nccc(C(=O)OC)c1[N+](=O)[O-] 856745311 CJRLGKZDWJKWIT-SSDOTTSWSA-N 298.255 -0.705 5 20 CBBD Nc1ccc(C(=O)NCCN2CC[C@@H](O)C2)cc1[N+](=O)[O-] 863330242 YDVBJFTWUQWYLT-SNVBAGLBSA-N 294.311 -0.027 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 863626910 RYWRMYIDLLYOAR-ZETCQYMHSA-N 285.260 -0.684 5 20 CBBD COC1(OC)CCOC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 912840213 GGAHFBPQGLWEMZ-IWSPIJDZSA-N 274.273 -0.454 5 20 CBBD CCOCC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062446145 LRMMXRITTIUARO-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD NC1CCC(NC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1326297637 NFKNGXHTNPOVMF-UHFFFAOYSA-N 268.277 -0.428 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@]1(C(=O)O)CCOC1 1574428434 CIEIEBPLWPQVRY-LLVKDONJSA-N 298.255 -0.540 5 20 CBBD CCN1CC[C@@H](n2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1590731118 IDALGZZYMNBGIO-ZCFIWIBFSA-N 292.259 -0.235 5 20 CBBD Nc1c(C(=O)N2CCNC(=O)C2)cccc1[N+](=O)[O-] 122794072 YJVWJBYILDILDO-UHFFFAOYSA-N 264.241 -0.251 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 276247271 LPDFZWYJYHUXEU-SECBINFHSA-N 292.251 -0.045 5 20 CBBD C[C@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330987058 GJCNMAAMGWPYSH-WCBMZHEXSA-N 281.268 -0.262 5 20 CBBD NS(=O)(=O)CCCCNc1ncc([N+](=O)[O-])cn1 336794885 GMQFNGMNKRITHT-UHFFFAOYSA-N 275.290 -0.135 5 20 CBBD CN(C)c1nc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1 340976464 HWZQHONIPJECPE-UHFFFAOYSA-N 266.221 -0.246 5 20 CBBD CCN(C[C@H](C)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 352233366 YDVRWVYYOVPLSP-GXSJLCMTSA-N 272.305 -0.145 5 20 CBBD CC[C@@H]1C(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 357516441 RBUZPTSKFVVLGJ-MRVPVSSYSA-N 293.283 -0.197 5 20 CBBD C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[S@]1=O 558743465 OFINZPUZAQSAHG-FWCARGHBSA-N 272.286 -0.089 5 20 CBBD C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@H](CO)O1 559034947 WYDDHVALNSFPAI-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD CCC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(N)=O 564011252 XLJXHTLKVJOOJQ-LURJTMIESA-N 255.234 -0.298 5 20 CBBD NC(=O)CN[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 577646778 WMNDIHPNPOCCKO-SECBINFHSA-N 292.251 -0.698 5 20 CBBD CCOC(=O)C[C@@H](CO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 590384647 PHIDTROSKMDABZ-LURJTMIESA-N 286.244 -0.638 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2c(N)cccc2[N+](=O)[O-])n1 590551934 SMMOVAKSSZCYBK-UHFFFAOYSA-N 291.271 -0.150 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@]1(C)CCNC1 595990713 DAKWXTIRXJIDDP-LLVKDONJSA-N 267.289 -0.032 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1cc([N+](=O)[O-])c[nH]1 600698984 HECSTJNKQUFAMS-VIFPVBQESA-N 268.273 -0.281 5 20 CBBD Cc1cc(=O)n(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 611181610 VRACSGLGJGTAFK-SNVBAGLBSA-N 279.256 -0.282 5 20 CBBD CNC(=O)CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 749415117 CDVFDSXGBCVVAS-UHFFFAOYSA-N 291.267 -0.193 5 20 CBBD CC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(OC)OC 834415190 NNHVHNGMJHXXRU-SSDOTTSWSA-N 287.276 -0.300 5 20 CBBD CC(C)[C@H](NC=O)C(=O)OCCn1cnc([N+](=O)[O-])n1 860586238 ZVJJHNGNZIKXHB-QMMMGPOBSA-N 285.260 -0.500 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)COC)C1 967948995 COKQDLVFMYLLKK-NXEZZACHSA-N 285.300 -0.643 5 20 CBBD CCOCC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062989658 MEWSDOHWHZHPIY-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD O=C(Cn1cncn1)NCCNc1ncccc1[N+](=O)[O-] 1093621850 UWWZHYJLOGGECM-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1(O)CCOCC1 1321419941 LOZXZXPGEUABPA-UHFFFAOYSA-N 298.299 -0.243 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 1328634329 QJQBKSKRPKGZOQ-SECBINFHSA-N 281.272 -0.472 5 20 CBBD CNC(=O)[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173563629 CZVQRAWAACHZFR-WDEREUQCSA-N 297.315 -0.637 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])cn1)CC(=O)OC 174861499 KXRFFQICZCZIQP-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD C[C@@H](O)CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)CO 248885715 DXRGRXIZCHQSOF-GHMZBOCLSA-N 299.327 -0.180 5 20 CBBD CNC(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 267801651 BAFJZOLDSGKAQO-UHFFFAOYSA-N 282.304 -0.252 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CN2C[C@H](O)[C@H](O)C2)c1 278717484 KMLDZBBXBYPQCP-WCFLWFBJSA-N 298.295 -0.628 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCC(O)(C(N)=O)CC1 315112011 RCEPGEVWOWIIJJ-UHFFFAOYSA-N 297.315 -0.064 5 20 CBBD CCn1cc(S(=O)(=O)NCC(=O)OC)c([N+](=O)[O-])n1 339048207 QMCHCOKLARJDFN-UHFFFAOYSA-N 292.273 -0.738 5 20 CBBD COC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 349834289 NPSWVJXDDRYYIC-UHFFFAOYSA-N 254.202 -0.525 5 20 CBBD Nc1nc(N2CCn3ncnc3C2)ncc1[N+](=O)[O-] 351548701 SYGQLQHSPNIESU-UHFFFAOYSA-N 262.233 -0.421 5 20 CBBD CCN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)CC1=O 352294337 QCUMXPXHIWDGCX-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2CNC[C@@H]2C1 359404065 IWZDZCZCNZPGGN-AOOOYVTPSA-N 279.300 -0.222 5 20 CBBD Nc1nc(N2CC(O)(C3CC3)C2)ncc1[N+](=O)[O-] 364752729 XKYGKVPOWJSCFF-UHFFFAOYSA-N 251.246 -0.072 5 20 CBBD COCCN(CC(=O)O)C(=O)c1c([N+](=O)[O-])cnn1C 431430940 FNOZJPICOHLPAU-UHFFFAOYSA-N 286.244 -0.499 5 20 CBBD CCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1 454359775 KSZRXHBRBFBAAK-UHFFFAOYSA-N 281.272 -0.103 5 20 CBBD CN(C(=O)c1ccnc(N)c1[N+](=O)[O-])[C@H]1CCNC1=O 571819314 VQLHYGMTDYLGPX-ZETCQYMHSA-N 279.256 -0.468 5 20 CBBD NCC(=O)NCC(=O)NCCOc1ccc([N+](=O)[O-])cc1 573114800 QFPVLPQMCCXHKI-UHFFFAOYSA-N 296.283 -0.835 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CNCCN2C)c1[N+](=O)[O-] 575802857 WRMNCWKCQCXPPM-MRVPVSSYSA-N 282.304 -0.740 5 20 CBBD COc1cncc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)n1 577494913 GGHPHJUUGZOYNR-UHFFFAOYSA-N 292.255 0.537 5 20 CBBD COC[C@@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)OC 579976792 PGYFZVXDRXTYEO-SSDOTTSWSA-N 298.255 -0.510 5 20 CBBD O=[N+]([O-])c1cnn(CCn2cnc(-c3nn[nH]n3)n2)c1 738373359 AZJMFTBSNIPCKO-UHFFFAOYSA-N 276.220 -0.737 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](CO)C1CC1 778706212 XJXKFXKTRXRUOL-JTQLQIEISA-N 283.288 -0.139 5 20 CBBD CCOCC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 847892074 QSECPXHJSOMZRN-UHFFFAOYSA-N 289.269 -0.169 5 20 CBBD CC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN(CC(N)=O)CC1 1045436275 OTXDFMZJYTZOTA-RKDXNWHRSA-N 284.316 -0.892 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCN1CCCC1=O 1115857146 OXJIHERTCYOZOK-UHFFFAOYSA-N 296.287 -0.685 5 20 CBBD CNC[C@H](C)CNC(=O)c1c([N+](=O)[O-])cnn1C 1326073025 ABQASNDWDBXKFV-ZETCQYMHSA-N 255.278 -0.086 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCN1 1329118293 MZNJRDQXNOAPLF-SSDOTTSWSA-N 254.250 -0.946 5 20 CBBD N[C@@H](CO)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 1574263094 ULTCBHNQUKBSMF-LBPRGKRZSA-N 294.311 -0.437 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N(CCO)C1CC1 36130492 ZIAGHZQIPDECAM-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD COC(=O)[C@H](CO)NC(=O)COc1cccc([N+](=O)[O-])c1 36816442 NUSNLIZLNPTASW-JTQLQIEISA-N 298.251 -0.376 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1ccnc1 44670273 ASFLSFASGGNRHW-UHFFFAOYSA-N 264.245 -0.196 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)N1CCOCC1 46268420 XMJFGXYDEXKHNY-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603108 ROARUCAERNEADO-LURJTMIESA-N 286.248 -0.953 5 20 CBBD CCCN(CC(=O)NC)C(=O)Cn1ccc([N+](=O)[O-])n1 49034329 IGIQCKNPQNFRGM-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 121203062 XDPWNWQMAQGEBC-QMMMGPOBSA-N 279.256 -0.468 5 20 CBBD COc1cc(OCC(=O)N[C@@H](C)C(N)=O)ccc1[N+](=O)[O-] 147277804 SCOZHKLJMCTXFR-ZETCQYMHSA-N 297.267 -0.028 5 20 CBBD O=C(CO)N1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 179332067 SEYGOTPNEHLROO-UHFFFAOYSA-N 299.308 -0.067 5 20 CBBD C[C@@H](CO)CNC(=O)CCn1cc([N+](=O)[O-])cn1 268834309 LRNOLUJVLALGIF-MRVPVSSYSA-N 256.262 -0.074 5 20 CBBD CNC(=O)C1CN(c2c([N+](=O)[O-])c(C)nn2C)C1 274277889 UEHYKZNSWDAGGW-UHFFFAOYSA-N 253.262 -0.181 5 20 CBBD COC(=O)c1cnc(N2CC(O)C2)c([N+](=O)[O-])c1 276601500 RGVCMUQEIWXYAV-UHFFFAOYSA-N 253.214 -0.043 5 20 CBBD C[C@H]1OCC[C@]1(O)CNc1ncc([N+](=O)[O-])c(N)n1 279165657 UICIZHNWIALGLR-LDWIPMOCSA-N 269.261 -0.081 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 280895831 DXWHRCSMODPDIW-GFCCVEGCSA-N 295.299 -0.224 5 20 CBBD CNC(=O)[C@H](CO)Nc1cc(C)c([N+](=O)[O-])cn1 302148116 KIVXNOYGZZTZMD-ZETCQYMHSA-N 254.246 -0.183 5 20 CBBD Cn1c(C(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)ccc1[N+](=O)[O-] 347391914 PWJDXUPDUPUCJR-CBAPKCEASA-N 296.283 -0.304 5 20 CBBD NC(=O)c1ccc(N2C[C@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 347409862 HHWFMFFKWDFMOC-RKDXNWHRSA-N 281.268 -0.374 5 20 CBBD COC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352959114 UOYLRMMTCFOWIN-SVRRBLITSA-N 298.255 -0.280 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)NCCn1ncnn1 353029069 VLJFCFNUHMBSLD-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD O=C(N[C@@]1(CO)CCOC1)c1cc([N+](=O)[O-])n[nH]1 354767610 FPRGQLIBRBYXLP-SECBINFHSA-N 256.218 -0.801 5 20 CBBD CC(C)(NC(=O)CCn1cc([N+](=O)[O-])cn1)c1nn[nH]n1 354789166 NPODOWDPGSUKJX-UHFFFAOYSA-N 294.275 -0.254 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)N1C 408170980 ZFEMKOOPSFDMHT-DTORHVGOSA-N 282.304 -0.263 5 20 CBBD CCOC(=O)COCCNc1ncc([N+](=O)[O-])cn1 450709609 MBNASWHOQMBWBJ-UHFFFAOYSA-N 270.245 0.376 5 20 CBBD CCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])cn1C 530448949 BJACPXPRAMQZAL-UHFFFAOYSA-N 254.246 -0.119 5 20 CBBD Cn1[nH]c(=N)c2c1CN(c1ncc([N+](=O)[O-])c(=N)[nH]1)C2 596265442 MCHSCPYCBGTALJ-UHFFFAOYSA-N 276.260 -0.536 5 20 CBBD COC(=O)[C@@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 843065197 KEFLGHSKCMDBLI-MNOVXSKESA-N 284.268 -0.248 5 20 CBBD O=C(NCC[C@]1(O)CCCOC1)[C@@H]1C[C@H]1[N+](=O)[O-] 846597015 RBUZYEDLCKHZLB-FXPVBKGRSA-N 258.274 -0.301 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CCOC1 848319541 LMDKIIYSGUTXGD-GFCCVEGCSA-N 294.267 -0.449 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NN1CCOC1=O 862699500 QLMMLEAEIWHBSJ-UHFFFAOYSA-N 269.217 -0.335 5 20 CBBD COc1nn(C)cc1C(=O)NCCn1cc([N+](=O)[O-])cn1 883964984 PNYPBPPPVDYVAD-UHFFFAOYSA-N 294.271 -0.037 5 20 CBBD O=C(NCC1CN(CCn2cccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031660728 QDAZHNNSBZDZKN-VXGBXAGGSA-N 293.327 -0.404 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC1)CN(CCO)C2 1035707591 PEJWCFBQJNIQKI-GHMZBOCLSA-N 283.328 -0.432 5 20 CBBD NC(=O)C1(C(=O)NCCNc2ncccc2[N+](=O)[O-])CC1 1094079335 BJUBYNZXVUPEKJ-UHFFFAOYSA-N 293.283 -0.217 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)[C@H]1COCCO1 1122714869 ZTTBSYXVHZMDPJ-SSDOTTSWSA-N 272.217 -0.855 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](C)CC(N)=O)c1[N+](=O)[O-] 1325193131 HYKKRMPQROJZEQ-RXMQYKEDSA-N 269.261 -0.370 5 20 CBBD O=[N+]([O-])c1cnc(NC2CC(CO)(CO)C2)nc1 1351363096 CYYQSFVYIBJGCQ-UHFFFAOYSA-N 254.246 -0.070 5 20 CBBD CN(Cc1cnn[nH]1)C(=O)c1ccnc(N)c1[N+](=O)[O-] 1576858436 PSXAXTYSQIBQOH-UHFFFAOYSA-N 277.244 -0.038 5 20 CBBD C[C@H](NS(=O)(=O)c1ncccc1[N+](=O)[O-])C(=O)O 1594241735 DQTXVCROHHSFPP-YFKPBYRVSA-N 275.242 -0.259 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCCO1 48320898 KJVYPLUCTWUWHB-SFYZADRCSA-N 269.261 -0.130 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@H]1C(=O)O 88376116 MUNFYFWAFWSDDM-VIFPVBQESA-N 283.240 -0.141 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286309083 XJBJROCMHBMSGN-SSDOTTSWSA-N 284.228 -0.668 5 20 CBBD CO[C@H]1COC[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 290639077 HVKQIACTBCCMGY-FSPLSTOPSA-N 255.234 -0.207 5 20 CBBD COC(=O)[C@@H](CNc1ncc([N+](=O)[O-])cn1)OC 291626039 BCIMQWAQKZCMEG-SSDOTTSWSA-N 256.218 -0.015 5 20 CBBD C[C@@H](O)C[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330386746 BGPUXRLZEFKYFV-BDAKNGLRSA-N 283.288 -0.052 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 330695231 IZXBIKWLRZYKNA-SNVBAGLBSA-N 296.331 -0.847 5 20 CBBD CN(C)C(=O)CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 350079793 VBJHQLYZXGDMRP-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 401912710 MOLCGTMVKWYEOU-POYBYMJQSA-N 283.240 -0.170 5 20 CBBD COC[C@](C)(O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 541907276 MVOIJSZYWZLGCG-LLVKDONJSA-N 284.272 -0.069 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)CC[C@@H]2C1 554871053 PBICAOZZDYDMCA-SSDOTTSWSA-N 279.256 -0.235 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1[C@H]2CC[C@H]1CNC2 595990662 AZQPWILKPQAXGD-YUMQZZPRSA-N 266.261 -0.851 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(c2ccc(N)c([N+](=O)[O-])n2)C1 596289358 OSYSVCNFPWHZPT-HTQZYQBOSA-N 296.283 -0.068 5 20 CBBD O=[N+]([O-])c1cnc(NCCN2CC[C@@H](O)C2)s1 599175420 AUPGIDGRYNBHBA-SSDOTTSWSA-N 258.303 0.530 5 20 CBBD O=C(O)CN1CC[C@@H](n2cnc([N+](=O)[O-])n2)C1=O 694926001 JJVVOMGHDMELPH-RXMQYKEDSA-N 255.190 -0.956 5 20 CBBD O=C(O)[C@H](CO)NS(=O)(=O)c1csc([N+](=O)[O-])c1 776445124 RALQVKYBUPVTOD-YFKPBYRVSA-N 296.282 -0.620 5 20 CBBD C[C@@H](COC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O)[N+](=O)[O-] 813114049 YAPVNDNNFAOJGB-MADCSZMMSA-N 299.283 -0.085 5 20 CBBD CCN(C)C(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1255193674 WXTVVWFIMIJRQZ-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CCO1 267342687 SOJXQSJDJQJPGX-VIFPVBQESA-N 294.267 -0.497 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1C(=O)CN=C1O 330689123 XTBNXFHQZROEEX-UHFFFAOYSA-N 253.218 -0.144 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 330780383 DPDMONDLHOGRTL-VIFPVBQESA-N 282.256 -0.490 5 20 CBBD Cc1nn(CC(=O)N2CCN=C2O)cc1[N+](=O)[O-] 331246407 VCTHKSNTMBZXAH-UHFFFAOYSA-N 253.218 -0.144 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1cc([N+](=O)[O-])nn1C 360637252 QTQSCCQHXJVYGU-UHFFFAOYSA-N 286.288 -0.609 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1 436641076 LHZDAPGJLKOPKS-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CO[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@H]1O 580725231 QEHQVRUAYAWKHN-HTQZYQBOSA-N 282.256 -0.596 5 20 CBBD Nc1nccc(C(=O)NCC(=O)N2CCCC2)c1[N+](=O)[O-] 584061518 NPEDBTDLSCRZDW-UHFFFAOYSA-N 293.283 -0.076 5 20 CBBD CNC(=O)[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590581314 KVKZOEVSAYUXEP-QMMMGPOBSA-N 281.272 -0.477 5 20 CBBD CCN1C[C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 593826003 QNKSRXZOBIMBCQ-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD CN1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 619444716 KKXPLHJFKTUWHR-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)CC[C@H]2C1 1319757510 BXUQIDJNZXMUJH-QMMMGPOBSA-N 293.283 -0.225 5 20 CBBD O=C1NC(=O)N2CCN(c3ccnc(O)c3[N+](=O)[O-])C[C@@H]12 1328012814 LAVRZDNSXCFTSN-ZETCQYMHSA-N 293.239 -0.564 5 20 CBBD O=C(NC[C@H]1CCCS1(=O)=O)c1c[nH]nc1[N+](=O)[O-] 1328618916 NUAONINJWQZHDK-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD C[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)c1nnnn1C 1338258941 YFQDTSVWKFPDES-SSDOTTSWSA-N 294.275 -0.418 5 20 CBBD O=C(Cn1nc2n(c1=O)CCCCC2)OCCC[N+](=O)[O-] 1345066042 GRHZUNBAIDQNQF-UHFFFAOYSA-N 298.299 -0.019 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCNCC1 1580578862 PJOPKKKZAJSNJH-VIFPVBQESA-N 282.304 -0.308 5 20 CBBD C[C@@H](/C=C/C(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1592202263 SXRCBDUCIRTSQV-SGJFDWMWSA-N 295.251 -0.098 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@@H](C)n1cnc(-c2nn[nH]n2)n1 1603571642 IPKMARXQBNPCHD-NTSWFWBYSA-N 296.247 -0.772 5 20 CBBD COCCN(CC(=O)O)c1c([N+](=O)[O-])ncn1C 49607087 DHOHQQCBLDUFKH-UHFFFAOYSA-N 258.234 -0.134 5 20 CBBD C[C@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(N)=O 184144676 DKABGGYHAXATJT-ZETCQYMHSA-N 287.297 -0.112 5 20 CBBD CCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 189682511 IJGRRLQUXWHDLT-UHFFFAOYSA-N 282.256 -0.910 5 20 CBBD O=C1NC[C@@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 267521099 YEKZEQSZOAVDIV-SECBINFHSA-N 291.267 -0.863 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@](C)(CO)C(=O)O 313534724 PKCAWWYURXBZNG-JTQLQIEISA-N 271.229 -0.501 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@@]1(O)CCOC1 339104355 XJOWTLOGEKYIDC-NSHDSACASA-N 299.287 -0.758 5 20 CBBD CCN(C[C@H](C)O)C(=O)Cn1cnc([N+](=O)[O-])n1 341341512 DHTTVHGBYWNHBU-ZETCQYMHSA-N 257.250 -0.584 5 20 CBBD C[C@H](CCS(C)(=O)=O)NC(=O)c1cc([N+](=O)[O-])n[nH]1 354065655 RIZHLSCWAYJQIY-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@H](CO)[C@@H](O)C1 577014330 ZLMHBHWBBXAVLZ-SFYZADRCSA-N 256.262 -0.492 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCOCCN1 597707096 HUNDXGJCVGFONT-UHFFFAOYSA-N 255.234 -0.845 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1C 763700071 VAEVYCOQMNGHPH-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD CN(Cn1cc([N+](=O)[O-])cc(F)c1=O)S(C)(=O)=O 842637150 JCNUGAHCJFBVIO-UHFFFAOYSA-N 279.249 -0.256 5 20 CBBD Cn1cc(C(=O)OCC(C)(C)[N+](=O)[O-])c(O)nc1=O 851124659 GTKOSJOGEATFJX-UHFFFAOYSA-N 271.229 -0.302 5 20 CBBD Cn1nncc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767373 LPRVSSQDOQYQCJ-NXEZZACHSA-N 282.304 -0.924 5 20 CBBD O=C1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 1322708672 FRDLGGSJGPACGG-QMMMGPOBSA-N 267.245 -0.814 5 20 CBBD CN(CCNS(C)(=O)=O)c1cccnc1[N+](=O)[O-] 1331940494 WOGAATHWRBSXMP-UHFFFAOYSA-N 274.302 -0.025 5 20 CBBD COC(=O)[C@H]1CN(c2c([N+](=O)[O-])cnn2C)CCO1 1335423545 FZFYQJVBRIAOSM-MRVPVSSYSA-N 270.245 -0.294 5 20 CBBD C[C@@H]1OCC[C@]12CN(c1nnc(C[N+](=O)[O-])n1C)CCO2 1339667306 SUPKLNRYPAWFBC-CABZTGNLSA-N 297.315 -0.024 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cn1 1601564780 YKXNQCXAFFGGHR-ZETCQYMHSA-N 255.186 -0.835 5 20 CBBD O=C1C[C@H](Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)CN1 1602637545 QVTWIWSWACPOCY-LURJTMIESA-N 281.224 -0.409 5 20 CBBD Cn1cc(CN[C@](C)(CO)C(=O)O)c([N+](=O)[O-])n1 1608115353 SAHNBPZZBCFLPX-SECBINFHSA-N 258.234 -0.747 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 35160442 UZYPXIMOMBYSNJ-MRVPVSSYSA-N 298.251 -0.133 5 20 CBBD CC[C@H](CO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 37888173 OHTZDYFKOQFSTR-SCZZXKLOSA-N 258.278 -0.487 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H]2CO)c1 75716053 XSIBUVVPAZYNGT-KOLCDFICSA-N 270.289 -0.391 5 20 CBBD COCCN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1=O 91813052 KNQHJMPKHHQPHG-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD CCOCCNC(=O)Cn1ncc([N+](=O)[O-])c1N 127507570 XHFAOHSNVSCFHH-UHFFFAOYSA-N 257.250 -0.474 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])n1C 135513713 DLMJWPGJFZSJML-VIFPVBQESA-N 297.267 -0.053 5 20 CBBD Nc1c(C(=O)N2C[C@H](O)[C@@H](O)C2)cc(F)cc1[N+](=O)[O-] 222970319 LBNVKOMZCBHEKA-IUCAKERBSA-N 285.231 -0.506 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 248961602 GPCDSDBSJPYTOJ-KOLCDFICSA-N 270.289 -0.127 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])s1 264868662 AHABDOQBELJIAU-UHFFFAOYSA-N 298.280 -0.062 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc(C)cc([N+](=O)[O-])c1N 273502412 QYSFCHHENKHLMH-QMMMGPOBSA-N 297.267 -0.251 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)[C@H](C)O 274802244 SOVQBBPNVOTBNL-WKEGUHRASA-N 298.251 -0.047 5 20 CBBD CS(=O)(=O)c1ccc(C(=O)NCCO)cc1[N+](=O)[O-] 338337401 JDDBACFFQASKCX-UHFFFAOYSA-N 288.281 -0.280 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC(=O)N1 345498781 BQXHUTZJNDICCS-ZETCQYMHSA-N 281.272 -0.273 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O 351853789 MPSNWCXLUFCQAY-PSASIEDQSA-N 281.268 -0.404 5 20 CBBD Cc1c(C(=O)N[C@@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 540882044 DHWLXKZHUMPVFR-SECBINFHSA-N 278.268 -0.022 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)NCCN(C)C 573837161 OIXHPBNEXKNISP-MRVPVSSYSA-N 297.315 -0.281 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCn3cncc3C2)c1 590599674 KNALSAKRHSPOBJ-GFCCVEGCSA-N 292.299 -0.136 5 20 CBBD O=C1CCC[C@H](CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)N1 591763890 PVKQYONFNAFERJ-KOLCDFICSA-N 297.315 -0.590 5 20 CBBD COC(=O)[C@H]1CNCCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 592551676 KPHDGDDZSPDIIQ-SECBINFHSA-N 296.283 -0.100 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@]1(C)CCNC1 595990714 DAKWXTIRXJIDDP-NSHDSACASA-N 267.289 -0.032 5 20 CBBD CCN1CCN(C(=O)[C@@H](C)OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 840672348 JOVYLRLGJJTDNM-GMTAPVOTSA-N 299.327 -0.253 5 20 CBBD O=C(CO[C@@H]1CCCNC1)NCCn1cc([N+](=O)[O-])cn1 843495347 PMBMTZNQWVSMRI-LLVKDONJSA-N 297.315 -0.324 5 20 CBBD CN[C@@H]1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923284984 YNKQMICAKXOZRF-PWSUYJOCSA-N 283.332 -0.164 5 20 CBBD O=C(c1cocn1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010672888 KNKRZUAMAWSJDV-PSASIEDQSA-N 294.267 -0.376 5 20 CBBD O=C(NC1CN(Cc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293015 DBSCLHMWPLLHJJ-RKDXNWHRSA-N 267.245 -0.965 5 20 CBBD Cc1[nH]nc(C(=O)NC2(C(=O)O)CCOCC2)c1[N+](=O)[O-] 1605065781 JSRXIKKTGFDTJF-UHFFFAOYSA-N 298.255 -0.010 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CCO1 50858432 PKXUONZQEAZSMJ-SNVBAGLBSA-N 294.267 -0.497 5 20 CBBD CC(C)N1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 172119489 NSZZQFDDFGXARI-JTQLQIEISA-N 295.299 -0.083 5 20 CBBD CC(CO)(CO)NC(=O)c1cccc([N+](=O)[O-])c1N 183505513 RPLJELYFJGYWGM-UHFFFAOYSA-N 269.257 -0.350 5 20 CBBD C[C@H](O)CN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 189363237 JNDKXCGIXZOKQX-NSHDSACASA-N 283.332 -0.210 5 20 CBBD C[C@@H](CO)N(CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H](C)O 190836901 DXRGRXIZCHQSOF-WDEREUQCSA-N 299.327 -0.180 5 20 CBBD C[C@H](CS(C)(=O)=O)Nc1ncc([N+](=O)[O-])c(N)n1 264905933 CXXXCEAAMLUPMQ-RXMQYKEDSA-N 275.290 -0.188 5 20 CBBD COCCCN(CCO)C(=O)c1n[nH]cc1[N+](=O)[O-] 276032533 RTWVLHDDZHEPHR-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CNC(=O)O1 495649872 IAKOOPKXHNSAGA-LURJTMIESA-N 282.212 -0.163 5 20 CBBD Cn1ncc(C(=O)NCCn2cc([N+](=O)[O-])cn2)c1N 612616514 JZAPAACVQFJPEJ-UHFFFAOYSA-N 279.260 -0.463 5 20 CBBD CNC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 702047373 YUANCOKQNLMROK-VIFPVBQESA-N 267.289 -0.141 5 20 CBBD Cn1nncc1C(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 803288990 KEQTYGLVXFAMGH-UHFFFAOYSA-N 294.227 -0.654 5 20 CBBD C[C@H]1[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 806060405 DNRYVVYGJFODMS-YUMQZZPRSA-N 282.256 -0.046 5 20 CBBD CC(C)(NC(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 824024677 CJMZZLPWGIEQHQ-UHFFFAOYSA-N 285.260 -0.046 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 1059393978 VEQKJWFAIOISGN-LJGSYFOKSA-N 279.256 -0.466 5 20 CBBD Cc1nc(N(C)CCN(C)C(=O)C(N)=O)ccc1[N+](=O)[O-] 1105543865 RLACLDUGCNVCLX-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD C[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@]2(CCOC2)O1 1121300210 UUVPDJPYHOVAMR-CABZTGNLSA-N 297.315 -0.024 5 20 CBBD COC(=O)NC1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1 1320618462 BNDIXAHAPCQCQS-UHFFFAOYSA-N 297.271 -0.183 5 20 CBBD NC[C@]12CC[C@H]1CCN2C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1580253443 MQUFHILZQSEPEJ-WCFLWFBJSA-N 295.343 -0.035 5 20 CBBD O=C(O)[C@@H]1CSCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1608650745 ZMJVEAHUZJNLEA-LURJTMIESA-N 286.269 -0.040 5 20 CBBD Cn1c(C(=O)NCCOCC(=O)O)ccc1[N+](=O)[O-] 93226516 QHDQASICCASYNJ-UHFFFAOYSA-N 271.229 -0.236 5 20 CBBD CNCCCNC(=O)CCn1cc([N+](=O)[O-])cn1 121288881 KJNYJOKGLZVIEV-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD Cc1nn(CCC(=O)N[C@@H](C)C(N)=O)c(C)c1[N+](=O)[O-] 171425608 XJSPKSVIKAYVEB-ZETCQYMHSA-N 283.288 -0.212 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCCCCO)c1 229127393 GFKRVKWEXIHORN-LLVKDONJSA-N 272.305 -0.096 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 270847395 LLIIPDJNRPUGTG-QMMMGPOBSA-N 280.288 -0.072 5 20 CBBD Cc1nn(C)c(NC[C@@H]2CC(C(N)=O)=NO2)c1[N+](=O)[O-] 276352817 YCUSSLJTBHLZNV-LURJTMIESA-N 282.260 -0.321 5 20 CBBD CCS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 298971620 OCCFDCFSOZJLCM-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD COC(=O)c1cc(NC(=O)CNC(N)=O)cc([N+](=O)[O-])c1 344824829 KLDNITSBJJTXAX-UHFFFAOYSA-N 296.239 -0.012 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](CO)[C@H]1CCCO1 344862687 QDISWLZGYCAZRQ-NXEZZACHSA-N 296.283 -0.158 5 20 CBBD O=C(NC[C@H]1CN(C2CC2)CCO1)c1cc([N+](=O)[O-])n[nH]1 353078694 NAQPJRVDSJXKQZ-VIFPVBQESA-N 295.299 -0.089 5 20 CBBD CCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])nc1C 355825794 DUBBBGFCSZIOHQ-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD CN(CC(N)=O)c1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 428109833 YQUQIZQGVLSYJO-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD C[C@H](O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 536634707 AJTPYJLAEBQNBA-LURJTMIESA-N 261.259 -0.351 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O 582083664 GUHRTNMAYAVGBE-QMMMGPOBSA-N 293.235 -0.213 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])n[nH]3)C[C@@H]21 599992029 OXTUBVKLVMVWEU-MTBHXBHISA-N 265.273 -0.050 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNOC[C@H]2CCOC2)c1 819255686 CWSOKBDHWHPNSU-ONGXEEELSA-N 286.288 -0.290 5 20 CBBD CN1CCC[C@@H](N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 839682805 ISIWMHYSQCINBC-JHJVBQTASA-N 296.371 -0.110 5 20 CBBD O=C(NC1CN(C(=O)c2cc[nH]c2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991291628 WQNVDVUPPQGATR-NXEZZACHSA-N 278.268 -0.380 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(NCc2cnon2)CC1 996430075 ZGVOCHURAUSMJE-GHMZBOCLSA-N 295.299 -0.185 5 20 CBBD CCc1nnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1030292771 UZIGFWHEGRTZGE-RKDXNWHRSA-N 295.299 -0.402 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@H]1CCCN1 1261491752 FEVVIBPLZKWFLD-SECBINFHSA-N 280.284 -0.375 5 20 CBBD CC(=O)N1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 1323221889 BFBJMHXWGBIPAB-UHFFFAOYSA-N 281.272 -0.367 5 20 CBBD O=C(N[C@@H]1CCCS(=O)(=O)C1)c1c[nH]nc1[N+](=O)[O-] 1325254195 FUTJYHGARKMONQ-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD NC(=O)[C@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1326232900 SZESMWMSRUHFMT-UWVGGRQHSA-N 269.257 -0.936 5 20 CBBD NC(=O)c1cc(N2CCC(N)(CO)CC2)ccc1[N+](=O)[O-] 1328009225 HTXSDENREUMCHJ-UHFFFAOYSA-N 294.311 -0.016 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@@]2(C(=O)O)CCOC2)n1 1593666426 WQFWHYCLXZVBGF-NSHDSACASA-N 298.255 -0.215 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1594724344 ONOQTAYDFGHELG-VIFPVBQESA-N 270.201 -0.709 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1599967319 JLWCZGFQLHBUSY-LLVKDONJSA-N 298.255 -0.153 5 20 CBBD Nc1ncc(C(=O)N2CCOC[C@@H]2C(=O)O)cc1[N+](=O)[O-] 1605655530 RGNBXGQFBBWSIH-MRVPVSSYSA-N 296.239 -0.502 5 20 CBBD COCCNC(=O)CNc1ccc(C(N)=O)cc1[N+](=O)[O-] 15142097 UYFPEGZBIATTOU-UHFFFAOYSA-N 296.283 -0.132 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NCCS(N)(=O)=O)c1 88147857 UGWDLMSKZFEMLO-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1ccc([N+](=O)[O-])cc1F 90262381 YFEHFXOMCMXWIL-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD O=[N+]([O-])c1ccc(O)cc1CN1C[C@H](O)[C@H](O)C1 93483461 MBTAUCORRCWMBB-PHIMTYICSA-N 254.242 -0.162 5 20 CBBD CCN(C)C(=O)[C@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 231849565 HVSMZXRAPYCNQJ-GXSJLCMTSA-N 299.331 -0.391 5 20 CBBD CCN(CC(=O)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262422212 NDJMCDFEOAHJOH-UHFFFAOYSA-N 283.240 -0.310 5 20 CBBD CCN[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 262499218 XPXXRRBVHZVBTR-SECBINFHSA-N 282.300 -0.129 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 264752872 LHKQJIPQWCMQEI-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD NC(=O)[C@H]1CCCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 267317206 NVBRCVJPPHGYAD-DTWKUNHWSA-N 295.299 -0.048 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H](C)O 274729570 CLIRSRPYLUEOIM-LHLIQPBNSA-N 298.251 -0.047 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 343251625 NUCYMNANNRQISZ-ZCFIWIBFSA-N 252.230 -0.130 5 20 CBBD NC(=O)NCC(=O)Nc1cc([N+](=O)[O-])ccc1O 345006140 XKNLANWSSUCARN-UHFFFAOYSA-N 254.202 -0.093 5 20 CBBD NC(=O)CCNC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 351579477 GOMOPPAMFBLOHG-UHFFFAOYSA-N 298.230 -0.336 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCc1nc(O)n[nH]1 774912831 GAGXNZOEOLWSIA-UHFFFAOYSA-N 268.189 -0.642 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])c(N)c1F 808047855 BEBQVSRGPQTYLI-SSDOTTSWSA-N 272.236 -0.165 5 20 CBBD C[C@@H](COC(=O)C1CCC2(CC1)NC(=O)NC2=O)[N+](=O)[O-] 813103052 MKDMZIHNWILANP-ZOTTZIKWSA-N 299.283 -0.037 5 20 CBBD CC[C@H](OC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 833644521 BGVZIAGCVMPZMG-YFKPBYRVSA-N 258.190 -0.407 5 20 CBBD Cc1noc(COC(=O)CN2CC(=O)NC2=O)c1[N+](=O)[O-] 853897794 RYHCRHLXUOBRBE-UHFFFAOYSA-N 298.211 -0.514 5 20 CBBD Nc1nccc(C(=O)N[C@@H]2COC(=O)C2)c1[N+](=O)[O-] 854554183 NFAJMOKQENPXFU-YFKPBYRVSA-N 266.213 -0.383 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cncn2C)C1 1042705426 QCUKJWRBWUXRLA-VXGBXAGGSA-N 293.327 -0.272 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)CC(N)=O)n1 1099970877 NYUFTTPRTDHMBU-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD Cn1nnc(CNC(=O)CCn2cc([N+](=O)[O-])cn2)n1 1116834485 NFAKXUCUTZAIDX-UHFFFAOYSA-N 280.248 -0.979 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1 1117682794 ICGRWMCOYHNZMN-NNYUYHANSA-N 282.300 -0.678 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 1340661243 BEWJVANSLGJNSZ-ZETCQYMHSA-N 290.301 -0.659 5 20 CBBD O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@H](O)C(=O)O 1601362727 WLFBWAIKNHOFQF-VIFPVBQESA-N 286.215 -0.162 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 71270204 NGKPITBMUGVQEK-SECBINFHSA-N 290.297 -0.120 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1cc([N+](=O)[O-])c[nH]1 229620963 AVAJBTBCENWDQU-JTQLQIEISA-N 255.230 -0.196 5 20 CBBD CNCCN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 237280090 NRLVBZHXRWUROL-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD C[C@H](O)CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H](C)CO 279150730 ZKWXOESKWDSAOT-SFYZADRCSA-N 299.283 -0.101 5 20 CBBD CCN1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1=O 290909986 GRZQFPDZGXQZPK-UHFFFAOYSA-N 293.283 -0.243 5 20 CBBD Nc1nc(NCCn2ccnn2)ncc1[N+](=O)[O-] 302143385 GAWBZGSBDBVEHQ-UHFFFAOYSA-N 250.222 -0.329 5 20 CBBD CC(C)[C@H](CO)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 343750157 APGNMQNEMMBOGC-ZETCQYMHSA-N 255.278 0.065 5 20 CBBD CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 344185663 QUUFANNQVPVDQP-SFYZADRCSA-N 298.303 -0.394 5 20 CBBD Cc1nnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1C 345396200 MLLZFQQDITYWPN-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD C[C@@H](O)CN(CCO)CCn1ccc([N+](=O)[O-])n1 351936887 MWCBIPFMQDILCL-SECBINFHSA-N 258.278 -0.534 5 20 CBBD COC[C@@H](C(N)=O)N(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 354548770 IIEHWLVADPLTGD-QMMMGPOBSA-N 298.255 -0.732 5 20 CBBD Nc1noc(CCN=c2ccc([N+](=O)[O-])c[nH]2)n1 360240969 XSKBOEGPFWEWNY-UHFFFAOYSA-N 250.218 0.032 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H](C)C1=O 426397608 URRXLJKYBGAMFF-SECBINFHSA-N 295.299 -0.130 5 20 CBBD COC(=O)c1cn(CCn2cc([N+](=O)[O-])cn2)nn1 428948552 WGFUNVOQSIOOST-UHFFFAOYSA-N 266.217 -0.130 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)C1 436919592 OPGKUWCLMKMXKE-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN(CC(N)=O)CC1 531846792 SHJMYQNDEUDTOH-UHFFFAOYSA-N 295.299 -0.824 5 20 CBBD C[C@@H]1CN(CCNC(=O)c2cc([N+](=O)[O-])nn2C)CCO1 547840758 QYQLVSWYBLFCDO-SECBINFHSA-N 297.315 -0.221 5 20 CBBD CC(CO)(CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 583698543 GKYUQDLWNBHEQX-UHFFFAOYSA-N 284.272 -0.707 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 592942057 YMSPZILFLVINJG-BQBZGAKWSA-N 298.255 -0.686 5 20 CBBD Nc1ccc(NCCCn2cc(CO)nn2)nc1[N+](=O)[O-] 596237204 RFMGYDCSABMSKB-UHFFFAOYSA-N 293.287 0.158 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC(NS(C)(=O)=O)C1 599147685 MNTABQWSIAMQCN-UHFFFAOYSA-N 275.290 -0.934 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 618923937 MOJQDTDGBVGNHP-JTQLQIEISA-N 292.251 -0.348 5 20 CBBD COC(=O)[C@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 843065198 KEFLGHSKCMDBLI-QWRGUYRKSA-N 284.268 -0.248 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nc(=O)o[nH]1 1254032786 BSERGSUKSAMWPX-UHFFFAOYSA-N 267.201 -0.460 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)NC[C@H]2C1 1326786180 BUMMSCWTFSBNFS-LURJTMIESA-N 280.244 -0.833 5 20 CBBD Cn1c(-c2nc[nH]c2[N+](=O)[O-])nnc1N1CCOCC1 1525323685 HXLCOXWYZWAMIU-UHFFFAOYSA-N 279.260 -0.050 5 20 CBBD O=C(O)CNC(=O)Cn1cc([N+](=O)[O-])cc(F)c1=O 1595100762 NHWYZXJDKPMLJS-UHFFFAOYSA-N 273.176 -0.904 5 20 CBBD COC[C@@](C)(CC(=O)O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1599150160 VJCYVPUOQJXQKY-SNVBAGLBSA-N 286.244 -0.073 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@@H](C)n1cnc(-c2nn[nH]n2)n1 1603571650 IPKMARXQBNPCHD-PHDIDXHHSA-N 296.247 -0.772 5 20 CBBD NS(=O)(=O)c1ccc(OCC(=O)O)c([N+](=O)[O-])c1 131202887 BWWJLMFNSWLGSZ-UHFFFAOYSA-N 276.226 -0.294 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCS(N)(=O)=O)n1 162598168 IFFZUMCCFFUTKP-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD COC(=O)C1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 187962246 VSVUKMRVXFIBIA-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCS(=O)CC1 230695935 ZIEQOLGTIZXGHY-UHFFFAOYSA-N 284.297 -0.224 5 20 CBBD CNC(=O)C1CN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C1 286759948 HKTGIFLGMLALPW-UHFFFAOYSA-N 294.267 -0.041 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 299723579 OLPRMXLFIYBUOT-ZCFIWIBFSA-N 252.230 -0.117 5 20 CBBD C[C@H]1C(=O)NCCN1c1ccc(N)c([N+](=O)[O-])n1 310903904 BNNNBCYAYVOMAM-LURJTMIESA-N 251.246 -0.103 5 20 CBBD CC(C)(C(=O)NCCn1cncn1)n1cc([N+](=O)[O-])cn1 337854636 UNDPOOVMKUMDOF-UHFFFAOYSA-N 293.287 -0.066 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1CCNC1=O 340492829 KUSAKROLOUDBPL-MRVPVSSYSA-N 281.272 -0.553 5 20 CBBD COC(=O)c1cnc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 357700349 SVLYAVGWMXUVKY-SSDOTTSWSA-N 271.229 -0.459 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H](O)COCC1CC1 360746174 OMNMGVMFRMLWEL-VIFPVBQESA-N 298.299 -0.154 5 20 CBBD CNc1nccc(C(=O)N[C@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 553091189 NIDUFMBXVDYZFH-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD O=C1C[C@H](N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)N1 584239482 BSNJSKKVDHFTNZ-VIFPVBQESA-N 293.283 -0.157 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)CN(C)C 588863811 VLDRCNDQHPKCTO-SECBINFHSA-N 285.304 -0.862 5 20 CBBD CNC(=O)[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590581309 KVKZOEVSAYUXEP-MRVPVSSYSA-N 281.272 -0.477 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)C1 600835080 LFSBYXWKQQRNCX-IZLXSQMJSA-N 280.240 -0.311 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CN1C1CC1 610654048 FROMOJQYFFCYCV-BDAKNGLRSA-N 294.315 -0.072 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N 839801276 WRDOAWYTAYVBQF-SVGQVSJJSA-N 287.247 -0.212 5 20 CBBD O=C1CC[C@H](n2cc([N+](=O)[O-])cc(F)c2=O)C(=O)N1 842638228 XWFVOLOARVXWEP-ZETCQYMHSA-N 269.188 -0.127 5 20 CBBD NC(=O)[C@]1(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCOC1 847052747 GHNBIEDINLSPDI-AAEUAGOBSA-N 295.295 -0.138 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@]3(CCCN3)C2)c1 923380116 MNIHFTXBEOJMFV-STQMWFEESA-N 295.343 -0.020 5 20 CBBD CCn1ncc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1157767521 PSZUUDNDJTYGBI-GHMZBOCLSA-N 296.331 -0.441 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCc1nnc(S)o1 1255243095 LWYGSQNPYCOUKM-UHFFFAOYSA-N 298.284 -0.178 5 20 CBBD C[C@@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)N(C)C 1320011431 AHECGBCOICLIPS-MRVPVSSYSA-N 297.267 -0.224 5 20 CBBD C[C@H]1CO[C@H](CO)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1323961119 XYPSVZTZTGDXEH-YUMQZZPRSA-N 296.283 -0.325 5 20 CBBD O=C(O)c1ccnc(N[C@H]2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 1602483541 NUGHAWCERUNGCO-YDNVCLBTSA-N 283.240 -0.016 5 20 CBBD CNC(=O)[C@@H]1CCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 33213441 FCXPISMSGQVHTD-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 342382009 QAXZXPMZXOCSAX-NXEZZACHSA-N 284.272 -0.601 5 20 CBBD COCC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O 436958325 GODVHCPDSVISGF-VIFPVBQESA-N 297.267 -0.079 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)Nc1cnn(CC(N)=O)c1 518230160 XPKJQHBLVXUIKB-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H]1O 558434691 ZOXXRMGXHYSBCV-QWRGUYRKSA-N 294.311 -0.076 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](N2CCNCC2)C1 563087524 UGWMQIVKCUAHBO-VIFPVBQESA-N 294.315 -0.562 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 567248484 FBAYHFZOZDTAFG-UHFFFAOYSA-N 266.213 -0.636 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@@H]1O 594334605 DEYSARYADLQBBS-XPUUQOCRSA-N 266.257 0.025 5 20 CBBD Cc1[nH]nc(C(=O)N2CCOC[C@H]2C(=O)O)c1[N+](=O)[O-] 595985420 JMQABLOMDIRKOP-LURJTMIESA-N 284.228 -0.448 5 20 CBBD COCCN1CN(c2ccnc(O)c2[N+](=O)[O-])CC1=O 596225391 CRWBSXQPYQYXFT-UHFFFAOYSA-N 282.256 -0.052 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CO)[C@H](CO)C1 704459677 PGDJBIKGHMGCHA-IUCAKERBSA-N 283.284 -0.394 5 20 CBBD CCNC(=O)COC(=O)c1cc([N+](=O)[O-])cnc1N 779104289 MHWCCAKOSIEOJQ-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD CCn1ncn(NC(=O)c2ccc([N+](=O)[O-])n2C)c1=O 816735608 ONMPKRNLPLJHSG-UHFFFAOYSA-N 280.244 -0.305 5 20 CBBD O=C(O)[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CCO1 821513220 SOLJTRDUKQUASY-JTQLQIEISA-N 297.267 -0.458 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 862682679 DINNDASKEYBYOV-XCBNKYQSSA-N 294.267 -0.762 5 20 CBBD C[C@@H]1NCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1C 923344761 IIYNARTXNAMHSO-NHCYSSNCSA-N 283.332 -0.166 5 20 CBBD O=C(Cc1ccco1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 998242892 QMFSBQDIIOZHKQ-GHMZBOCLSA-N 293.279 -0.186 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)[C@@H]1COCCO1 1122714872 ZTTBSYXVHZMDPJ-ZETCQYMHSA-N 272.217 -0.855 5 20 CBBD C[C@@H](CO)N(C[C@@H](C)O)C(=O)c1c([N+](=O)[O-])cnn1C 1320923816 VRZRMYJCWXTFIM-JGVFFNPUSA-N 286.288 -0.468 5 20 CBBD N[C@@H](Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1)C(=O)O 1608248579 KUSYLZLGHCBOHP-QMMMGPOBSA-N 278.228 -0.475 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1cc([N+](=O)[O-])c[nH]1 71149475 CGHNHWXUYKIWLX-UHFFFAOYSA-N 281.316 -0.100 5 20 CBBD NS(=O)(=O)CCn1cc(Br)c([N+](=O)[O-])n1 119220418 CVNBOORYLGMHMV-UHFFFAOYSA-N 299.106 -0.158 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)O 167373253 SWHDZKAPQLFTJP-SSDOTTSWSA-N 271.229 -0.237 5 20 CBBD CCS(=O)(=O)NCCn1cccc([N+](=O)[O-])c1=O 264594833 ZJBBJGJQZWPMSY-UHFFFAOYSA-N 275.286 -0.304 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC1=O 338667991 QZVPIUCQYCWCTG-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD CCC[C@H]1CNCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 359218773 PBKVPARJDZFXRN-VIFPVBQESA-N 282.304 -0.213 5 20 CBBD COCCn1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)n1 360805061 YULGIQQGUBYPAA-UHFFFAOYSA-N 294.271 0.424 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2C(N)=O)n1 427470045 FDRSWMINWBNJHZ-SSDOTTSWSA-N 281.272 -0.099 5 20 CBBD Nc1ccnc(CNC(=O)c2cc([N+](=O)[O-])cnc2O)n1 433053517 POWHHTOZAWBKBJ-UHFFFAOYSA-N 290.239 -0.002 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 445174158 QSVDRBJCZFKRBL-ZCFIWIBFSA-N 280.240 -0.357 5 20 CBBD Nc1nccc(C(=O)NCCCOCCO)c1[N+](=O)[O-] 580904025 ZUCMAMDUSUOYOT-UHFFFAOYSA-N 284.272 -0.299 5 20 CBBD Nc1cc(N2C[C@@H](O)C[C@H]2CO)cc(CO)c1[N+](=O)[O-] 588008411 RNOBPNXODHKSAC-UWVGGRQHSA-N 283.284 -0.399 5 20 CBBD CN(C)C(=O)COC1CN(c2ccnc(O)c2[N+](=O)[O-])C1 596151527 RGHJZKALKWDASZ-UHFFFAOYSA-N 296.283 -0.011 5 20 CBBD O=C(CN1CCCC1=O)OCCn1ccc([N+](=O)[O-])n1 748109139 OJAKEAJPQMJQEY-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD CNC(=O)NC(=O)[C@@H](C)OC(=O)c1nn(C)cc1[N+](=O)[O-] 772056292 GEANZNLZQNKGEE-RXMQYKEDSA-N 299.243 -0.671 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1=O 773659904 DUFWDBNHUYIXRW-SECBINFHSA-N 292.251 -0.336 5 20 CBBD O=C(NN1CCCNC1=O)c1c[nH]nc1[N+](=O)[O-] 801641561 GPUWGXAZBKKQMI-UHFFFAOYSA-N 254.206 -0.622 5 20 CBBD O=C(CCN1C(=O)CCC1=O)OCCC[N+](=O)[O-] 860912944 ICDYLHWUXBUQKZ-UHFFFAOYSA-N 258.230 -0.265 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@H]2COCO2)c1[N+](=O)[O-] 861969076 KRJXPRCSXQPDFQ-ZCFIWIBFSA-N 270.245 -0.017 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 1059804101 VEQKJWFAIOISGN-KNVOCYPGSA-N 279.256 -0.466 5 20 CBBD C[C@@H](c1nnc(N2CCN(C)C(=O)C2)n1C)[N+](=O)[O-] 1121296278 HABLNJRCGHFMPY-ZETCQYMHSA-N 268.277 -0.569 5 20 CBBD CCCNC(=O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319268890 VOVNWGIJCKRMDM-UHFFFAOYSA-N 282.256 -0.008 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCC(O)(CO)CC1 1328480970 PRCQDDLVADCHKB-UHFFFAOYSA-N 297.267 -0.345 5 20 CBBD CC(=O)N1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC1 1355418140 YUGZXMBOKSFMOK-QMMMGPOBSA-N 282.304 -0.179 5 20 CBBD O=C(NC[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 1757309642 FWRFJGUCDAMZJI-ULAWRXDQSA-N 291.254 -0.072 5 20 CBBD Cc1cc(=O)n(CC(=O)N2CCNC2=O)cc1[N+](=O)[O-] 128598107 AQAKMCPOGFLJPN-UHFFFAOYSA-N 280.240 -0.383 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC(=O)N1CCCC1 192653962 BGIQHADJNPTWBA-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD C[C@@H]1C[C@H](CN)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 261691226 INVLLAOXZOCQJC-RKDXNWHRSA-N 267.289 -0.013 5 20 CBBD C[C@H](O)CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H](C)CO 279150733 ZKWXOESKWDSAOT-YUMQZZPRSA-N 299.283 -0.101 5 20 CBBD COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)OC 298835505 CFYIXWRRUIJGHS-SSDOTTSWSA-N 299.239 -0.243 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1cc([N+](=O)[O-])n[nH]1 353663176 CEAQYUWXVBSTRR-UHFFFAOYSA-N 253.178 -0.928 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 355616566 IFMSYXRWTFXOLM-UHFFFAOYSA-N 298.303 -0.479 5 20 CBBD CCOC[C@@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 355738559 BSJPQXMZSLLPIP-QMMMGPOBSA-N 284.272 -0.102 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1[C@H]1CCN(CC(=O)O)C1=O 596014169 RVXSDCXBRDGEST-VIFPVBQESA-N 295.251 -0.077 5 20 CBBD Cn1c(C(=O)NCCn2ccnn2)ccc1[N+](=O)[O-] 611794712 WNNJBFGJNGDTFK-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD Cn1nnnc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 614712688 SPZIRVSGPAYCOZ-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD CO[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 616029388 BKHXARPTAHNHIW-SSDOTTSWSA-N 256.218 -0.237 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 619566069 ZOBUGXGPJLRZCA-YFKPBYRVSA-N 259.243 -0.768 5 20 CBBD O=C1CC(C(=O)OCCn2cc([N+](=O)[O-])cn2)CC(=O)N1 748122264 XXAADIMMPSYGKH-UHFFFAOYSA-N 296.239 -0.613 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@@]2(CO)C1 782977334 NMXQJXIGOJTWRS-CABZTGNLSA-N 295.299 -0.185 5 20 CBBD COC(=O)CSCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839658482 NRYZTAFALVWDQM-RNFRBKRXSA-N 262.287 -0.326 5 20 CBBD COCCN1[C@H]2CC[C@H]1CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1029304644 DLNAAEVKMKOYID-NNYUYHANSA-N 283.328 -0.027 5 20 CBBD CCN(CC)C(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936675 QGDDQZPVQOKNPX-NXEZZACHSA-N 286.332 -0.774 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@H](CC(=O)O)C1 1255839970 QRLBIMKSHMZRQF-SSDOTTSWSA-N 298.255 -0.356 5 20 CBBD CNC(=O)CCCNC(=O)c1c([N+](=O)[O-])cnn1C 1323233751 LAXQBTHGJMKWQY-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD COc1ccc(CC(=O)N[C@@H](CO)C(=O)O)cc1[N+](=O)[O-] 1607241995 SWDHZYVDQNYRRO-QMMMGPOBSA-N 298.251 -0.292 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCN1CCCC1=O 32645460 CYKGGEOSKRFNBA-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD CC[C@@H](CO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 37888172 OHTZDYFKOQFSTR-WPRPVWTQSA-N 258.278 -0.487 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC(=O)NCC(F)(F)F 48603196 SMCOOGMLLZAJGM-UHFFFAOYSA-N 296.165 -0.426 5 20 CBBD NC(=O)[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75618502 JOPJPZIPFSHDCK-VHSXEESVSA-N 283.288 -0.898 5 20 CBBD COCCCN(CCO)C(=O)Cn1cc([N+](=O)[O-])cn1 189046006 OOALJVFTUGLKMA-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1ccc([N+](=O)[O-])[nH]1 229687542 WGSKZIQRGKPTPZ-SNVBAGLBSA-N 255.230 -0.196 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 230682099 LFTULQIIKQBISZ-UHFFFAOYSA-N 297.271 -0.936 5 20 CBBD C[C@H](N)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 237543925 FCNMLGJHISJGRW-DTWKUNHWSA-N 282.304 -0.085 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)CCO)c([N+](=O)[O-])n1 339049818 XBZRXAGENVTTHK-SSDOTTSWSA-N 292.317 -0.140 5 20 CBBD CCCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 346911544 VWRHTZOQTALBSC-UHFFFAOYSA-N 296.283 -0.520 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356498321 QOJMZBOYCVXRKZ-YFKPBYRVSA-N 256.218 -0.380 5 20 CBBD CN(C)C1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 360724223 ZPZGDNVHOYQOSC-UHFFFAOYSA-N 253.262 -0.286 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@H](O)C1 361894629 XKVMFRJESAQEIA-ZETCQYMHSA-N 253.214 -0.098 5 20 CBBD O=[N+]([O-])c1ccc(CNS(=O)(=O)C2CNC2)cc1 405151161 OWCLNQCCIZANRB-UHFFFAOYSA-N 271.298 -0.014 5 20 CBBD CO[C@@H]1COCC[C@@H]1CN=c1nc(N)c([N+](=O)[O-])c[nH]1 450694060 NQVXCUKKSYRHRE-VXNVDRBHSA-N 283.288 -0.148 5 20 CBBD Cn1nc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1O 597410857 RNKIZLKZYRIKID-UHFFFAOYSA-N 280.244 -0.340 5 20 CBBD NC[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 702049326 KWMSQKOFGMEIFZ-QMMMGPOBSA-N 253.262 -0.402 5 20 CBBD COC[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C(N)=O 760043903 IYSOPJLBJVREBI-SNVBAGLBSA-N 297.267 -0.410 5 20 CBBD CCN1CC[C@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)C1=O 849704836 PQTFCHVGPGWABK-ZETCQYMHSA-N 283.244 -0.650 5 20 CBBD CN(CCO)CCNC(=O)CCC(C)(C)[N+](=O)[O-] 899738569 HBLGTCMRFKWWSE-UHFFFAOYSA-N 261.322 -0.138 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cnon2)C1 954239845 SEINKIHZAUWETD-VXNVDRBHSA-N 295.255 -0.982 5 20 CBBD O=C(NCC1CN(Cc2cnsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031662218 XMUWUWZCTNPEML-NXEZZACHSA-N 297.340 -0.249 5 20 CBBD CN(CCCNC(=O)C(N)=O)c1ncc([N+](=O)[O-])cc1F 1095718786 ARXDAXLTTADDNO-UHFFFAOYSA-N 299.262 -0.443 5 20 CBBD CN(CCN(C)c1ncccc1[N+](=O)[O-])C(=O)C(N)=O 1105543064 IKEZCZWAOQOMAL-UHFFFAOYSA-N 281.272 -0.630 5 20 CBBD Cn1ncnc1CCOC(=O)Cn1cc([N+](=O)[O-])cn1 1122868931 RIXJJLBPMSHVQX-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2CC(CO)(CO)C2)n1 1600104864 BSPXYDSJEZOWLP-UHFFFAOYSA-N 297.267 -0.213 5 20 CBBD Cn1cc(C(=O)O)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1608100414 RPKGSXBLIKIBDT-INEUFUBQSA-N 254.202 -0.278 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 49225430 BBACXSUCSCKJHW-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD CN(CC(N)=O)C(=O)COc1cccc([N+](=O)[O-])c1 49248672 ZJIHYQOCAFQOCZ-UHFFFAOYSA-N 267.241 -0.083 5 20 CBBD CCNC(=O)CN(CC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75598042 KZJSVSZXWWWBNB-LLVKDONJSA-N 299.331 -0.390 5 20 CBBD CCCN(CCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 130599079 BAIRKMPXRXGGSP-UHFFFAOYSA-N 283.284 -0.013 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@H](O)C2)c2nonc12 236554629 GTUUKRYPQMPYQI-OCAPTIKFSA-N 266.213 -0.327 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN(CCO)C2CC2)c1 266543053 QWHIJIVGYOCZKV-LLVKDONJSA-N 270.289 -0.391 5 20 CBBD COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@@H](C)O 274547074 WXUBQUVXAPFRGW-HZGVNTEJSA-N 298.251 -0.047 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 340973311 PKHWYFCBFFOZFG-FBIMIBRVSA-N 270.289 -0.393 5 20 CBBD C[C@@H]1CN(C)CCN1c1ncc([N+](=O)[O-])c(N)n1 344420236 GDPHXJUPQRMLNM-SSDOTTSWSA-N 252.278 0.107 5 20 CBBD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCC(N)=O 345792608 VBPRXQZXIPSUHZ-ZETCQYMHSA-N 298.303 -0.571 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[C@@H](CO)O1 349625536 FDTLIARCIKQEDT-ZJUUUORDSA-N 298.299 -0.244 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)OC 538706172 LONALWFRNQNQNG-QMMMGPOBSA-N 285.256 -0.149 5 20 CBBD COc1ccc(CC(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 597582401 BVIZWZXTXOPZKR-SECBINFHSA-N 297.267 -0.892 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)Cn1cc([N+](=O)[O-])cn1 610498484 JJFSIZAGFCJXSS-BDAKNGLRSA-N 293.283 -0.329 5 20 CBBD CCO[C@@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839726182 NVWOYOOQTUVLPR-ZYUZMQFOSA-N 258.274 -0.038 5 20 CBBD CCCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CC(=O)N(C)C1=O 839759672 PQHHJCZTDWXSLL-HLTSFMKQSA-N 283.284 -0.353 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H]3CNC[C@H]32)c1 923360882 BMUZJTVFHBEEEO-CYZMBNFOSA-N 295.343 -0.164 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnccn1 990097894 DDFDGBMZBYMLNO-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD C[C@H](CS(C)(=O)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 1318448085 FDRXCBIWYGLRKD-SSDOTTSWSA-N 290.301 -0.659 5 20 CBBD O=C(O)[C@@H]1COCCN1CCn1cc([N+](=O)[O-])ccc1=O 1594958764 VSTPTUHAGRTTKU-JTQLQIEISA-N 297.267 -0.458 5 20 CBBD CC[C@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 90550029 VHBHBSYGAHKPCG-NSHDSACASA-N 294.311 -0.033 5 20 CBBD CN(C)CCCNC(=O)Cn1cnc([N+](=O)[O-])c1 179751294 JUPIAYNTHSYAIF-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD COC(=O)CNC(=O)Cn1cccc([N+](=O)[O-])c1=O 263640397 AJOHQOUJOSBDJP-UHFFFAOYSA-N 269.213 -0.954 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 271248370 GTWFDPYAHBRRGL-JTQLQIEISA-N 299.239 -0.072 5 20 CBBD CCNC(=O)NCCNC(=O)Cn1ccc([N+](=O)[O-])n1 294245959 ZVHLOAZLXNAIKE-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD CN(C[C@@H](O)C1CC1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 304788102 QBJUAQXSWKBRAO-VXGBXAGGSA-N 284.316 -0.145 5 20 CBBD O=C(NCCn1cncn1)c1cc([N+](=O)[O-])c[nH]1 337658072 JMWKZBLWKAMLNA-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD Nc1nc(N2CCSC[C@H]2CO)ncc1[N+](=O)[O-] 345191213 QEUICLQATWUANK-ZCFIWIBFSA-N 271.302 -0.119 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CNC(=O)C1 354049589 UWLZWBHSBKASDO-YFKPBYRVSA-N 265.229 -0.611 5 20 CBBD CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 356478660 LUXZYKPJDWNINP-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC1[C@@H]2COC[C@@H]12 357900445 CCWLDDWFUSBYLO-PHDIDXHHSA-N 252.230 -0.297 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCn1cncn1 359013393 ANQZIMSWSFOREP-UHFFFAOYSA-N 277.244 -0.175 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@H]1COCCO1 359023377 YCLOBLUNHKGKIF-QMMMGPOBSA-N 282.256 -0.051 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCOC1 359785991 BLAKIIXDUPFHID-LLVKDONJSA-N 282.256 -0.547 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 371047859 FRFNVXMUFHMERJ-SECBINFHSA-N 295.299 -0.082 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1CCNCC1 575915643 GCVSOMMHYAVADX-UHFFFAOYSA-N 294.311 -0.128 5 20 CBBD O=C(NC[C@@H]1CNCCO1)c1cc([N+](=O)[O-])n[nH]1 582419754 FVRJPUOVYYTURX-LURJTMIESA-N 255.234 -0.964 5 20 CBBD C[C@@H](N)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 598914564 HJWDXSVKUMJHCB-SSDOTTSWSA-N 266.257 -0.003 5 20 CBBD CN1CC[C@@](O)(CNc2c([N+](=O)[O-])cnn2C)C1 893186784 FCBRFNPWAPTIEK-SNVBAGLBSA-N 255.278 -0.193 5 20 CBBD O=C(NC1CN(C(=O)C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991299438 VPCDGUKTRSCSIW-RKDXNWHRSA-N 253.258 -0.611 5 20 CBBD CN1CCC[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1118883868 LOMPGJIJBCDULQ-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD CNC(=O)CCNC(=O)CCn1cc([N+](=O)[O-])nc1C 1318497518 BHMQYTVFGZSHQY-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1CCNC1=O 1320148563 DFRFKZRXWPULBM-QMMMGPOBSA-N 279.256 -0.468 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1326087733 WBJWYRVYXDTEPM-BRPSZJMVSA-N 299.308 -0.151 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 45302385 ZSWOPBZJGMWIAP-ZCFIWIBFSA-N 272.213 -0.158 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)Cn1cc([N+](=O)[O-])cn1 46884488 FYRFFJUVKSIKCL-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD NC(=O)C1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 48544158 DJKJSRMCEMPGFF-UHFFFAOYSA-N 266.261 -0.331 5 20 CBBD CC(C)NC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 79011370 GHGOHPWBDHBHPE-UHFFFAOYSA-N 296.283 -0.603 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H](O)C(F)(F)F)c1 236541774 NMUANVMADOYGAB-SFYZADRCSA-N 298.221 -0.335 5 20 CBBD CN(C)CCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 267084480 HFVHLHBBMZMOCO-UHFFFAOYSA-N 255.278 -0.189 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 275420390 INJQVYKKTAUNGK-SNVBAGLBSA-N 297.315 -0.684 5 20 CBBD NC(=O)NC[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285554330 IQCTZWLYWJBZKX-ZETCQYMHSA-N 296.287 -0.019 5 20 CBBD Nc1nc(NCCC(=O)N2CCOCC2)ncc1[N+](=O)[O-] 298702571 HXGQSTXYHIDEHQ-UHFFFAOYSA-N 296.287 -0.372 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCO1 343877173 NKSVVJBRGHTJKM-ZETCQYMHSA-N 298.255 -0.360 5 20 CBBD CN1CCC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 344057710 LMZHDZOVMWHXDL-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD CNC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(C)C 353440939 RATYRRRXAUSUOF-SECBINFHSA-N 283.288 -0.171 5 20 CBBD COC(=O)[C@H]1CC[C@H](C(=O)Nc2c([N+](=O)[O-])cnn2C)O1 362165406 FGHMYELFNZXZQJ-HTQZYQBOSA-N 298.255 -0.013 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H](n2cncn2)C1 372482925 RTPMTQPQQHVSDL-VIFPVBQESA-N 291.271 -0.144 5 20 CBBD CCN1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H](C)C1=O 426343974 RWDXDWADTSVHFZ-QMMMGPOBSA-N 296.287 -0.735 5 20 CBBD O=C1C[C@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])CN1 429613157 SQIQGYWOUYJDRJ-LURJTMIESA-N 265.229 -0.578 5 20 CBBD CCc1[nH]nc(C(=O)NC(C)(C)C(N)=O)c1[N+](=O)[O-] 444029761 ISTKLBWFTHEKEU-UHFFFAOYSA-N 269.261 -0.126 5 20 CBBD N[C@@H]1CCC[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 446400409 JXPVBOZMARJSMW-SFYZADRCSA-N 268.277 -0.428 5 20 CBBD CC(C)N(CC(N)=O)C(=O)c1c[nH]nc1[N+](=O)[O-] 548079639 ZGHJPUKHEIFKPP-UHFFFAOYSA-N 255.234 -0.346 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)OC 554014058 SCZWHTLWVJDNDH-SECBINFHSA-N 285.256 -0.149 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@H](CO)O1 566805363 HMMZANSHNZMHSO-HTQZYQBOSA-N 296.283 -0.206 5 20 CBBD Cn1nnnc1CNC(=O)c1ccc([N+](=O)[O-])o1 614712407 ALIBBTWGHBXVOZ-UHFFFAOYSA-N 252.190 -0.359 5 20 CBBD O=C(NS(=O)(=O)[C@H]1CCOC1)c1ccc([N+](=O)[O-])[nH]1 733721382 QWYNKCQQAMLKEW-LURJTMIESA-N 289.269 -0.229 5 20 CBBD NC(=O)CONC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 772948094 FDTSXRYYRGHFGN-UHFFFAOYSA-N 284.184 -0.350 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CC(C)(C)OC1=O 817069938 LFXPBZIIIPJHIN-ZETCQYMHSA-N 297.271 -0.261 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@H]2CCC[C@@H]2O)CC1 839666825 UHYLEGFYOBBUKV-KXNHARMFSA-N 283.328 -0.291 5 20 CBBD C[C@@H](CO[C@@H]1CCOC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839701653 YONXEMAVWRAOQB-SGIHWFKDSA-N 258.274 -0.038 5 20 CBBD CCONC(=O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 846490628 IHTZZYPYSYMBFO-LLVKDONJSA-N 297.267 -0.188 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NOC(C)(C)CO 857284632 PIAZFOLESHWMRE-UHFFFAOYSA-N 258.234 -0.239 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCNCC1 1261459805 CGMMLLFHFMXXHP-UHFFFAOYSA-N 253.262 -0.236 5 20 CBBD Cn1cnnc1CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1318440139 ZRMKDXSDEBENCN-UHFFFAOYSA-N 293.287 -0.331 5 20 CBBD Cn1ncc(CCCNC(=O)c2c([N+](=O)[O-])cnn2C)n1 1324600594 JTVAIRCSNONNHK-UHFFFAOYSA-N 293.287 -0.181 5 20 CBBD C[C@@H](O)C1(NC(=O)c2c([N+](=O)[O-])cnn2C)CC1 1328433994 XNSVKKJEBPITNZ-ZCFIWIBFSA-N 254.246 -0.029 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCS(=O)(=O)CC1 1338604704 LGIQMCLKLZAJJW-UHFFFAOYSA-N 288.285 -0.952 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CC[C@H](OC)C1 1342293575 DFJNFGTXSBPQDK-VIFPVBQESA-N 285.304 -0.074 5 20 CBBD CC[C@](COC)(NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)O 1605049636 OQKZJMXWUNRSSH-SNVBAGLBSA-N 286.244 -0.073 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1c[nH]cn1 88753491 OUNKKPTWSGADEQ-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD CCCc1[nH]nc(C(=O)N2CCNC(=O)C2)c1[N+](=O)[O-] 109336718 PJPBSSXFEGJZNU-UHFFFAOYSA-N 281.272 -0.158 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCC(=O)NCCO)n1 287952826 SGZKZFQEDAQPOP-UHFFFAOYSA-N 298.255 -0.703 5 20 CBBD CC(C)(C(=O)NC[C@]1(O)CCOC1)n1cc([N+](=O)[O-])cn1 330464847 WAJYMGRADFMBGM-GFCCVEGCSA-N 298.299 -0.206 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1C=C[C@@H](CO)C1 341732775 IOWDFSPMCLEFCT-RKDXNWHRSA-N 266.257 -0.156 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342469794 QUPHYVJWVWKJOG-BQBZGAKWSA-N 270.245 -0.542 5 20 CBBD Cc1nn(C)c(NCC(=O)NCCO)c1[N+](=O)[O-] 347058453 WJTZRUQUJKCLAZ-UHFFFAOYSA-N 257.250 -0.843 5 20 CBBD C[C@@H](CN)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 347682940 PDZWCWLRYUUELU-ZETCQYMHSA-N 255.278 -0.010 5 20 CBBD Cc1nc2n(n1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)CC2 352655393 QZZQIOBXPLFWJU-ZETCQYMHSA-N 291.271 -0.037 5 20 CBBD Nc1nnc(CCNC(=O)c2cccc([N+](=O)[O-])c2N)o1 356731756 VMLWOMNQSJPUJY-UHFFFAOYSA-N 292.255 0.115 5 20 CBBD NC(=O)c1nn[nH]c1NC(=O)Cc1cccc([N+](=O)[O-])c1 362413211 WYSVQGOCYCKAIH-UHFFFAOYSA-N 290.239 -0.007 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC[C@H]1CCCN1 444269343 UEIFSJJRFVZPEC-MRVPVSSYSA-N 268.277 -0.555 5 20 CBBD COC(=O)[C@H](C)OC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748915065 BBTMCKNTSDNTCZ-ZETCQYMHSA-N 284.224 -0.139 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 863625341 KGLBCTZSDSMPLO-LURJTMIESA-N 285.260 -0.236 5 20 CBBD CN(C(=O)C(C)(F)F)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953520898 FFVNXNXAPLZXFP-HTQZYQBOSA-N 291.254 -0.024 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CC(=O)N2CCC2)C1 1042705247 OGFSJRZERNHGHE-GHMZBOCLSA-N 296.327 -0.974 5 20 CBBD NC(=O)C(=O)N[C@H]1[C@@H]2CN(c3ccc([N+](=O)[O-])cc3)C[C@@H]21 1060468511 TWFRYDQVUKFPBG-URLYPYJESA-N 290.279 -0.369 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCOC1 1116793748 OIJRIGPJXVIPMM-MRVPVSSYSA-N 269.261 -0.271 5 20 CBBD CN1CCN(C2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)CC1 1119568321 DNIRQHMQTHSEIO-UHFFFAOYSA-N 293.327 -0.005 5 20 CBBD NC(=O)C[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1323419343 PELVHHJSYUFTEA-ONGXEEELSA-N 297.315 -0.651 5 20 CBBD CCOC(=O)[C@@H]1CNCCN1CCn1ccc([N+](=O)[O-])n1 1328490930 ZTILFUKPFFBGOQ-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD O=C(CN1C(=O)CCC1=O)NCCn1cc([N+](=O)[O-])cn1 1346287349 MGUCCZYPCPLDEK-UHFFFAOYSA-N 295.255 -0.944 5 20 CBBD COC[C@@H]1CNCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1578993149 ADMBTNGSFFNHSJ-QMMMGPOBSA-N 283.288 -0.313 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2CCNC(=O)C2)n1 1600105303 PQOHTTFZPKTTHF-UHFFFAOYSA-N 280.240 -0.067 5 20 CBBD NC(=O)NC(=O)Cn1cc(Br)c([N+](=O)[O-])n1 40445652 BPQKRWSFAKKARO-UHFFFAOYSA-N 292.049 -0.251 5 20 CBBD NCC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40835076 XVKYKOYNMOTVFF-UHFFFAOYSA-N 265.273 -0.403 5 20 CBBD C[C@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 51818949 REOLLYNUCRJKAU-LURJTMIESA-N 255.230 -0.264 5 20 CBBD CC[C@H](O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 124699496 CAURWXJAHKHDRF-VHSXEESVSA-N 258.278 -0.487 5 20 CBBD CCOCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 126348031 AEAXXNCXRRWACB-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD C[C@@H](NS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C(N)=O 184144694 DKABGGYHAXATJT-SSDOTTSWSA-N 287.297 -0.112 5 20 CBBD C[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 191860038 FUXKQFXWZKXNME-GXSJLCMTSA-N 298.299 -0.210 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCN1CCNCC1 238090355 PGVREVKVYPZXCC-UHFFFAOYSA-N 296.331 -0.797 5 20 CBBD C[C@@H]1C(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C(=O)[C@H]1C 246204385 XMANCOFWGLSFCC-NRPADANISA-N 296.283 -0.207 5 20 CBBD C[C@]1(C(N)=O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 280260367 NWXZZNNAGHPUJK-JTQLQIEISA-N 266.261 -0.331 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1cc([N+](=O)[O-])[nH]n1 285785024 OJZDCPCMRDFBLZ-UHFFFAOYSA-N 272.261 -0.619 5 20 CBBD COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286869503 YQROQAGDXVWGJD-LURJTMIESA-N 258.234 -0.555 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 288239055 FNWYXCRPXZBYTM-RKDXNWHRSA-N 270.245 -0.991 5 20 CBBD COCC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(N)=O 357471388 OMBZXVBKFHSYKG-SECBINFHSA-N 296.283 -0.004 5 20 CBBD COc1cccc(C(=O)NC(CO)CO)c1[N+](=O)[O-] 444340667 JTKQIETVRBRBQM-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD COc1c(N)ncnc1NCCn1cc([N+](=O)[O-])cn1 563428722 YWRDULQODTZYFS-UHFFFAOYSA-N 279.260 0.284 5 20 CBBD O=C1C[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2)NC(=O)N1 596971820 PETFLVFYXIEHHQ-VIFPVBQESA-N 292.251 -0.191 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC2(C(=O)O)CC2)n1 600654110 SUTYGIIJYHEONM-UHFFFAOYSA-N 290.257 -0.776 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 844778921 BSISPBPEYGDVMH-UHFFFAOYSA-N 256.218 -0.280 5 20 CBBD CN(CC(N)=O)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 985424884 BYFRKCAQWMUOST-NXEZZACHSA-N 284.316 -0.940 5 20 CBBD Cn1nccc1NC(=O)Cn1cnc([N+](=O)[O-])n1 1318096595 BDHCCXYOZRLYLJ-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC(N)=O 1318124304 WTWADQTZPWWART-UHFFFAOYSA-N 255.234 -0.957 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2c([N+](=O)[O-])cnn2C)CCOC1 1323234075 NYECFECGIBYQAM-LLVKDONJSA-N 298.255 -0.610 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CNCCO1 1326141227 HLHGWVHTKNUZOY-SECBINFHSA-N 283.288 -0.796 5 20 CBBD Cn1c(S)nnc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1326697474 MBXGBYWFUYDPOM-UHFFFAOYSA-N 283.273 -0.335 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@H](CO)CC1 1327914566 YBNCIRPRDKFRMI-SECBINFHSA-N 283.288 -0.193 5 20 CBBD CNC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329300460 SLAZLLGPIAUOPN-ZETCQYMHSA-N 253.262 -0.001 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nncn1C 1338469146 VFSGZZQCXWWQEY-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@](O)(C(=O)O)C1 1602622931 QRPXCYYSZOXGHH-GFCCVEGCSA-N 296.235 -0.038 5 20 CBBD CCN(CCO)C(=O)Cn1cc([N+](=O)[O-])nc1C 129927084 DRZRADNCANIMGH-UHFFFAOYSA-N 256.262 -0.059 5 20 CBBD O=C(CN1CCCCC1=O)NCCn1cc([N+](=O)[O-])cn1 164456757 OQAKIGHBVGJGMU-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCCOCC1 189436548 GYFVGJBFBQKUQP-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD CCOC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274978942 LGRVTZJONHSSDQ-UHFFFAOYSA-N 269.213 -0.012 5 20 CBBD COC(=O)CSCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285359904 LVJBKMYAEVPJQW-UHFFFAOYSA-N 288.285 -0.046 5 20 CBBD C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)N1CCOCC1 330560712 JNMWSORDYAOPQR-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD O=C1NC2(CC2)C(=O)N1CCn1cc([N+](=O)[O-])cn1 348851612 WYPUKMAYNUHTLF-UHFFFAOYSA-N 265.229 -0.124 5 20 CBBD CN1CC[C@@H](N(C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 352657296 GCMHBXPWGNENKT-GHMZBOCLSA-N 297.315 -0.685 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354056209 FLGMBFJYABJPJH-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD Cc1[nH]nc(C(=O)NCCNC(=O)C2CC2)c1[N+](=O)[O-] 354064654 NRHQVOJBEWQHJQ-UHFFFAOYSA-N 281.272 -0.118 5 20 CBBD CNC(=O)[C@H](C)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 357490974 SVPOZCXRLQPVJT-SSDOTTSWSA-N 295.299 -0.093 5 20 CBBD CC(C)(O)CN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 548091805 BWZSOBLKJATUTH-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD CO[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@H]1OC 549758701 PDPNKCVXBSHTAN-OCAPTIKFSA-N 270.245 -0.196 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)NCCN(C)C 565208099 ZBCAZTCUNWWOAE-QMMMGPOBSA-N 297.315 -0.281 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc(O)c([N+](=O)[O-])c2)n1 590550987 JLYXNDUEYWIJMP-UHFFFAOYSA-N 292.255 -0.027 5 20 CBBD O=C1NC[C@H]2CN(c3ccsc3[N+](=O)[O-])CCN2C1=O 610864613 NFPQKKFGEULCHF-ZETCQYMHSA-N 296.308 -0.197 5 20 CBBD CC1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])OCCO1 791389309 JKLLJNVDJNPGRP-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 863708244 YKFPHPSSOBGZNI-ZCFIWIBFSA-N 298.255 -0.167 5 20 CBBD CCc1noc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030294093 XOAXYMWZCWGEHV-RKDXNWHRSA-N 295.299 -0.402 5 20 CBBD NC(=O)C(=O)N1CCCN(c2ncccc2[N+](=O)[O-])CC1 1057222229 IHGKJZBPONUKFZ-UHFFFAOYSA-N 293.283 -0.486 5 20 CBBD NC(=O)[C@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 1261648060 QRKDTPPLGPNZOP-SSDOTTSWSA-N 268.229 -0.614 5 20 CBBD C[C@@H](C[C@@H](C)N)NC(=O)Cn1cnc([N+](=O)[O-])n1 1329518842 CMJGZYGSHIBLSG-RQJHMYQMSA-N 256.266 -0.572 5 20 CBBD Cn1cc([C@H]2C[S@@](=O)CCN2CC[N+](=O)[O-])cn1 1333461048 KBZJWTIMIUCCLI-MGNBDDOMSA-N 272.330 -0.198 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1338619713 ZGODGNKWCVSUTO-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD CN(C)C(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1346300864 OCQWDQITSPMPEJ-UHFFFAOYSA-N 297.319 -0.605 5 20 CBBD O=C1CN(NC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1 29018419 OUFQPFQTSLQABK-UHFFFAOYSA-N 294.223 -0.443 5 20 CBBD COCCCN(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 152525036 NJTKBDFLUCLILP-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD COC[C@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 230158141 LLQGATAJPXOIDY-MNOVXSKESA-N 288.304 -0.861 5 20 CBBD CCc1nn(C)c(NCCN2C(=O)CNC2=O)c1[N+](=O)[O-] 288993550 VZTGHQSTTLBUDR-UHFFFAOYSA-N 296.287 -0.146 5 20 CBBD COCCNC(=O)CNc1ccc(N)c([N+](=O)[O-])n1 311594897 BIOIQYWTERBZAY-UHFFFAOYSA-N 269.261 -0.254 5 20 CBBD O=C1CN(CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1 357964122 ALHLINKLSNCERI-UHFFFAOYSA-N 281.272 -0.916 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@H](O)[C@H]1CCOC1 359017444 JOQYCTAAZPSJEZ-KWQFWETISA-N 296.283 -0.069 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@H]3CNC[C@@H]3C2)c1 359276040 LRPYBUMXQAPDBD-NXEZZACHSA-N 251.290 -0.058 5 20 CBBD CC(=O)N1CC(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 361905871 IQDYLDLHLFHKDI-UHFFFAOYSA-N 280.240 -0.344 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCN1 446439208 VWKIWXDUOPALAB-ZETCQYMHSA-N 253.262 -0.238 5 20 CBBD CC(=O)N1CC(NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 548092028 ZUPTWUVFMDRUQL-UHFFFAOYSA-N 253.218 -0.722 5 20 CBBD C[C@H](CCO)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 593107864 PFUUHQFJONCYSC-KOLCDFICSA-N 272.305 -0.145 5 20 CBBD CCn1cc(S(=O)(=O)NC/C=C/CO)c([N+](=O)[O-])n1 594819363 JARWKDYYJDFDCY-ONEGZZNKSA-N 290.301 -0.362 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])c1)N[C@@H]1CCSC1=O 760310661 HLXMMLPNMKTSCB-ZCFIWIBFSA-N 270.270 -0.060 5 20 CBBD CCOCCONC(=O)Cn1cc([N+](=O)[O-])ccc1=O 773916793 AZNBXCUJKNAHNA-UHFFFAOYSA-N 285.256 -0.159 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@]2(CO)C1 782977335 NMXQJXIGOJTWRS-JOYOIKCWSA-N 295.299 -0.185 5 20 CBBD C[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCOC1=O 813294591 KUUALNVHIQPSIT-GFCCVEGCSA-N 295.251 -0.422 5 20 CBBD Cc1nc[nH]c1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 995241525 ZFMVXEFYUMCCDL-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(Cc3cnon3)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] 1025775984 SMQNQZGUNOYNLW-NZFPMDFQSA-N 293.283 -0.719 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1c([N+](=O)[O-])cnn1C 1319757026 SNOPHOGPXLVWMV-UHFFFAOYSA-N 283.288 -0.170 5 20 CBBD C[C@@]1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CCS(=O)(=O)C1 1320983134 XTFYXHGYKKMCCF-SECBINFHSA-N 288.285 -0.375 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CCOCC1 1338797438 MNQXQSIIHHCVNP-UHFFFAOYSA-N 255.278 -0.139 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@](C)(CO)C(=O)O 1607985609 YVEBXVOXDRQBKW-NSHDSACASA-N 283.240 -0.136 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)NC1CC1 43285160 XQNDYZXQIIALQB-UHFFFAOYSA-N 267.245 -0.814 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 48812295 JBIJZSYMRZWVTF-ZCFIWIBFSA-N 255.234 -0.958 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 167585154 SCCMMDMIIGTYHG-BDAKNGLRSA-N 284.272 -0.601 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1Cn1nccc1[N+](=O)[O-] 172611547 OFASIGMKOOJVMX-MRVPVSSYSA-N 274.302 -0.132 5 20 CBBD C[C@@H]1C(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C(=O)[C@@H]1C 246204389 XMANCOFWGLSFCC-XKSSXDPKSA-N 296.283 -0.207 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 274422758 ONYCTBKOVZOXNH-VHSXEESVSA-N 298.299 -0.210 5 20 CBBD Nc1nc(NCCCCS(N)(=O)=O)ncc1[N+](=O)[O-] 292918834 YGCCEBKCHUGLBK-UHFFFAOYSA-N 290.305 -0.552 5 20 CBBD C[C@@H](NS(=O)(=O)c1cncc([N+](=O)[O-])c1)C(=O)O 311072331 ZGKIBSFSTFMTPR-RXMQYKEDSA-N 275.242 -0.259 5 20 CBBD CCn1cc(S(=O)(=O)N2CC(OC)C2)c([N+](=O)[O-])n1 331527441 MTAPRNAUZFKFHO-UHFFFAOYSA-N 290.301 -0.170 5 20 CBBD CCNC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 338087792 GQMPZSBJWGQPRJ-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD COC(=O)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 347880441 UMGQXBKKSXZFGE-UHFFFAOYSA-N 282.256 -0.045 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1C 434672741 ZLVFBTOWZHVGEA-JGVFFNPUSA-N 268.277 -0.605 5 20 CBBD CCc1[nH]nc(C(=O)NC(C)(CO)CO)c1[N+](=O)[O-] 444365972 PVQWNLVTNDACDH-UHFFFAOYSA-N 272.261 -0.647 5 20 CBBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCC(=O)NCCO 492118689 ZPABHFKPWDWRKD-UTCJRWHESA-N 293.279 -0.167 5 20 CBBD O=C(N[C@H]1CCCCNC1=O)c1c[nH]nc1[N+](=O)[O-] 549187058 FULTWLDOHFKZPQ-ZETCQYMHSA-N 267.245 -0.284 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)NCCN(C)C 563732604 MOUDWOZWOFEDCN-SSDOTTSWSA-N 298.303 -0.886 5 20 CBBD CC(=O)NCCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 565952685 CWNUIRNFAZXMFY-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD C[C@H]1NCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 592224678 OFGSFAVQKKEIRM-PSASIEDQSA-N 267.289 -0.095 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 619565843 GZDLZJMAOULATI-VIFPVBQESA-N 292.251 -0.348 5 20 CBBD NC(=O)NCCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 737755148 JDLAULMGQOIVAM-UHFFFAOYSA-N 292.259 -0.145 5 20 CBBD Cc1ccnc(NC2(CNC(=O)C(N)=O)CC2)c1[N+](=O)[O-] 1110324710 WVSWHXINAYBZSC-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD COC(=O)[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116343154 ZKPMUJANZLFNGZ-SSDOTTSWSA-N 283.240 -0.566 5 20 CBBD CCN(C)C(=O)CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157761046 LAHKHWJNJDGERY-NXEZZACHSA-N 286.332 -0.774 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 1257449769 MONBRWGJRPWONK-UHFFFAOYSA-N 285.260 -0.848 5 20 CBBD O=C(NCC1CNC1)C(=O)Nc1cccc([N+](=O)[O-])c1 1261781990 QUEPSEBARBTQHA-UHFFFAOYSA-N 278.268 -0.131 5 20 CBBD CCS(=O)(=O)NCCn1ccc(=O)c([N+](=O)[O-])c1 1319268158 JMYDQSOLXXJQRJ-UHFFFAOYSA-N 275.286 -0.304 5 20 CBBD O=C(O)[C@@H](O)C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1610723662 XIOSHZPODCYSDT-VIFPVBQESA-N 298.255 -0.384 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1csc([N+](=O)[O-])c1 40507769 MVDGYZQJBFSWKU-UHFFFAOYSA-N 298.324 -0.182 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1F 43570384 CFWYQBJAQSLDOA-MRVPVSSYSA-N 272.188 -0.091 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C(=O)O)C1 43700691 PVOWAVQHNZMPSC-VIFPVBQESA-N 283.240 -0.141 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1cc([N+](=O)[O-])cn1C 71149477 HVIIPYCVUBYCCW-UHFFFAOYSA-N 295.343 -0.090 5 20 CBBD COCCNC(=O)CNc1c([N+](=O)[O-])c(C)nn1C 76548410 RWDCLAMDUBAWIC-UHFFFAOYSA-N 271.277 -0.189 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1ccc([N+](=O)[O-])s1 90261420 CHRIOVJLCQPAPL-BYPYZUCNSA-N 260.227 -0.168 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(N)=O 228509095 JRXCNANPERGSRV-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD C[C@H](N)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 237430552 FCNMLGJHISJGRW-IUCAKERBSA-N 282.304 -0.085 5 20 CBBD C[C@@H]1COCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266505586 XMDMDWYNVNZPEV-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 270647713 QHXZULBIEBVQLX-KOLCDFICSA-N 295.295 -0.014 5 20 CBBD CCOC(=O)CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])[nH]1 299672739 NYLJCVNKQJYCTE-UHFFFAOYSA-N 298.255 -0.587 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)COCC1CC1 359587283 GWRLFNKBIUYHSH-LLVKDONJSA-N 298.299 -0.305 5 20 CBBD C[C@@H](NS(=O)(=O)c1cccnc1[N+](=O)[O-])C(N)=O 547329834 LNWZSTNSCCFRHS-RXMQYKEDSA-N 274.258 -0.858 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400547 NXNGAUOZXKICSI-POYBYMJQSA-N 293.283 -0.174 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H]1CCNC1 579025440 CPAZHEYSVFXBEJ-ZETCQYMHSA-N 272.286 -0.370 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 592306044 AETYQTSJRNNJKM-OIBJUYFYSA-N 296.283 -0.116 5 20 CBBD Nc1nccc(C(=O)NC[C@@H](O)[C@H]2CCCO2)c1[N+](=O)[O-] 600242759 QOYOUDGOQYRKCP-RKDXNWHRSA-N 296.283 -0.158 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@@H]3CNC[C@@H]3C2)c1 610336113 KHAMQPCWBTWWGP-UMNHJUIQSA-N 281.316 -0.697 5 20 CBBD Nc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)NCC(=O)O 821369664 YZVLQNAZRXBDLY-UHFFFAOYSA-N 297.223 -0.465 5 20 CBBD Cc1nn(C)c(C(=O)NCC(=O)NC2CC2)c1[N+](=O)[O-] 1115887773 GPCYJYPDUKHACN-UHFFFAOYSA-N 281.272 -0.355 5 20 CBBD NC(=O)c1ccnc(N2C[C@@H]3C[C@]3(CO)C2)c1[N+](=O)[O-] 1327601136 LLYPHKBZSKGMQL-JVXZTZIISA-N 278.268 -0.093 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1C[C@H]1C(=O)O 1608377368 UOUHMKBWRSCSRS-VXNVDRBHSA-N 295.251 -0.407 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCNC(=O)C1CC1 65718878 RESVMIWRPQOKSU-UHFFFAOYSA-N 295.299 -0.258 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@]1(C(=O)O)CCOC1 85853270 IETJKTGCTBQROL-JTQLQIEISA-N 284.228 -0.849 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H]1C 120865610 WACHDGSPHCGNIB-RKDXNWHRSA-N 297.315 -0.155 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)[C@H]1CCOC1 351561693 XXDRRDBTFCFTCH-OIBJUYFYSA-N 296.283 -0.301 5 20 CBBD CCC[C@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 412549240 PXFJHOZGEQOQGF-YUMQZZPRSA-N 272.261 -0.430 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[C@H]1N 429186844 VNAYICGDEIVECD-DTWKUNHWSA-N 267.289 -0.013 5 20 CBBD Cn1cnc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 579510258 DGWYKNJSZUEJAY-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@H](O)C1 600699055 IAALENBUQMWFGC-JTQLQIEISA-N 282.300 -0.270 5 20 CBBD CCNC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 619247953 KBLQDXJYXBJBTR-UHFFFAOYSA-N 267.245 -0.562 5 20 CBBD COC[C@H](NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])C(N)=O 760076744 BJQQQRQQMOPSCS-LURJTMIESA-N 299.287 -0.329 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)NCCn1cnnn1 807920749 MWRJTRXGYCGMOU-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD CNC(=O)[C@@H](O)CNc1cc(N)c([N+](=O)[O-])c(CO)c1 808047586 QCIZGCPGHXFPNO-VIFPVBQESA-N 284.272 -0.812 5 20 CBBD O=CN1CCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 830577505 UTNAIWJLKXVAAY-SNVBAGLBSA-N 281.272 -0.472 5 20 CBBD O=C(O)CN1CC[C@@H](n2cc([N+](=O)[O-])cc(F)c2=O)C1=O 853002696 SNEZZEJKCPOOSS-MRVPVSSYSA-N 299.214 -0.246 5 20 CBBD O=C1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2N1 855676972 MQPQOIZAKIGRHC-DOLQZWNJSA-N 267.285 -0.221 5 20 CBBD O=C(NCC1CN(Cc2nncs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031662340 CCUHYIUFNGUAIH-RKDXNWHRSA-N 297.340 -0.249 5 20 CBBD COC(=O)NC1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1255045658 FWJVRVHHTPINOE-UHFFFAOYSA-N 297.271 -0.252 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1cnc[nH]1 1320432299 SZTNZGNCBBCCNQ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CCNCCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1327073012 MEXKSDNURORULO-UHFFFAOYSA-N 282.300 -0.128 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CCCC1=O 1328842735 VQRVEZAHFKVFTI-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD CN1CCN(C2CN(C(=O)c3cc([N+](=O)[O-])n[nH]3)C2)CC1 1332563925 NNHMSXZSAWSPIV-UHFFFAOYSA-N 294.315 -0.610 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 1344391401 HEXACHOOAYDLPA-SECBINFHSA-N 298.251 -0.046 5 20 CBBD Nc1ncc(C(=O)N2CC[C@@H]2C(=O)O)cc1[N+](=O)[O-] 1608276906 PRZDKPYNYFAWRJ-ZCFIWIBFSA-N 266.213 -0.129 5 20 CBBD O=C1CN(NC(=O)Cc2ccccc2[N+](=O)[O-])C(=O)N1 29018708 JTSZZCLBDILIHR-UHFFFAOYSA-N 278.224 -0.280 5 20 CBBD COCCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 122836109 QFGPIANVYBMDQC-UHFFFAOYSA-N 269.257 -0.139 5 20 CBBD O=C(Cn1cccn1)NCCn1cc([N+](=O)[O-])cn1 164467853 YBBWRIFDILPTNG-UHFFFAOYSA-N 264.245 -0.196 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 227871912 VATOCYLXAHDEDM-SCSAIBSYSA-N 259.243 -0.768 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCN[C@H](C(N)=O)C2)n1 269065768 YUBCCFPPUIGIDE-QMMMGPOBSA-N 265.273 -0.438 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)N1CCOCC1 285218466 QAKLVEKQRKVLQS-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@H]1CCNC1=O 286012740 RFMDXNBWMSQDSV-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 350462773 QPURYVZORDGYSV-LURJTMIESA-N 279.256 -0.468 5 20 CBBD Cn1cnc(NC(=O)c2ccc([N+](=O)[O-])n2C)n1 356423456 NXWFJESIKKOHBI-UHFFFAOYSA-N 250.218 0.314 5 20 CBBD CN(CC(N)=O)C(=O)CCn1cc([N+](=O)[O-])cn1 357896289 DRMOFIJEAVICTH-UHFFFAOYSA-N 255.234 -0.875 5 20 CBBD C[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC(=O)N1 456194712 RIBJVPCWRALEPB-MRVPVSSYSA-N 295.299 -0.127 5 20 CBBD C[C@H]1OC(=O)N[C@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 496988702 YSUDCFBOZCSIPK-HTRCEHHLSA-N 284.228 -0.169 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C1=O 549764888 XFULTGVAACCIAP-YFKPBYRVSA-N 267.197 -0.325 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CC[C@H](O)C1 600809061 RFGRBSQGWFZEQY-JTQLQIEISA-N 297.315 -0.717 5 20 CBBD Cc1nn(CCC(=O)NCCNC(N)=O)c(C)c1[N+](=O)[O-] 735812718 PSBZUZXXUCEOFX-UHFFFAOYSA-N 298.303 -0.417 5 20 CBBD CNc1c(C(=O)NOCC(N)=O)cccc1[N+](=O)[O-] 765640401 RWRNDLDUNOBYAL-UHFFFAOYSA-N 268.229 -0.217 5 20 CBBD CCN1CCN(C(=O)[C@H](C)OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 840672350 JOVYLRLGJJTDNM-HBNTYKKESA-N 299.327 -0.253 5 20 CBBD Cn1cc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1020139095 QHMJOYUWBLQVGJ-DDHJBXDOSA-N 293.327 -0.178 5 20 CBBD Cc1cnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nc1 1030292684 RYTUEZJQPRHFIN-GHMZBOCLSA-N 291.311 -0.249 5 20 CBBD CCN(C)C(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 1318064415 GYWZDEVSQCZWJT-UHFFFAOYSA-N 271.233 -0.792 5 20 CBBD CN(C)CC1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1331204498 CAJQVLPOXNEYNL-UHFFFAOYSA-N 267.289 -0.038 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)[C@H](CO)C1 1333040293 XCAHIHXAFXXVQH-JTQLQIEISA-N 269.305 -0.600 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 1349796370 KSUCAVSTLPPAMM-RITPCOANSA-N 269.217 -0.994 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](Cc2cnn[nH]2)C1 1578030043 NIHHTAXRWNPBIS-FXBDTBDDSA-N 265.273 -0.139 5 20 CBBD CCN(CC)C(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590684198 UKRRBOFQDDVMIF-UHFFFAOYSA-N 294.275 -0.160 5 20 CBBD CC(C)(Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O)C(=O)O 1590827526 ZPANSRGRWFUSTF-UHFFFAOYSA-N 283.240 -0.034 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](C(=O)O)C1CC1 54504185 XYXZYWUJJTWAJU-VIFPVBQESA-N 268.229 -0.229 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)C1CC1 71303943 WYVIBZPMFLGFLR-MRVPVSSYSA-N 254.246 -0.322 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 236574925 KMXUAWIVQXMTFC-UWVGGRQHSA-N 252.226 -0.228 5 20 CBBD CC(CO)(CO)NC(=O)c1cccc([N+](=O)[O-])c1O 274984617 XUVIWVXVEHCLFS-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCC(O)(C(N)=O)CC1 313810409 IKXBLLCQHOKWCR-UHFFFAOYSA-N 297.315 -0.064 5 20 CBBD O=C(O)[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 337677770 YZLJKVZHRSHPCO-SSDOTTSWSA-N 283.244 -0.491 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[S@]1=O 343730769 XYEUCVAORKHODK-AHGSNSTDSA-N 272.286 -0.089 5 20 CBBD CCCN(CC(N)=O)C(=O)CCn1cc([N+](=O)[O-])cn1 346888411 WNTWDSJJDJKFRM-UHFFFAOYSA-N 283.288 -0.095 5 20 CBBD C[C@H](CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1)C(=O)O 347399866 GGEMNMNMOXSKPF-SSDOTTSWSA-N 297.271 -0.102 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)c1cc([N+](=O)[O-])nn1C 356164078 ZDBBYAGZUFIZEU-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CN(Cc1nnc(O)o1)c1ncc([N+](=O)[O-])c(N)n1 425286857 VBUJTEYPAWROAP-UHFFFAOYSA-N 267.205 -0.308 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])cn2C)C1 531298338 LORHAFZJTLMYOQ-UHFFFAOYSA-N 266.257 -0.106 5 20 CBBD COCCCNC(=O)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 554877093 GFRKTVNSGVSYEA-UHFFFAOYSA-N 299.287 -0.457 5 20 CBBD O=C(NCCCN1CCNCC1)c1n[nH]cc1[N+](=O)[O-] 572481096 PVPBGPLTIDIYJH-UHFFFAOYSA-N 282.304 -0.657 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(c2ncc([N+](=O)[O-])cn2)C1 592001715 BLNBPLOZHCKBAY-CBAPKCEASA-N 282.256 -0.255 5 20 CBBD O=C(NCCn1cnnc1)c1cc([N+](=O)[O-])n[nH]1 597717141 ZTXUSCRIFLMTJO-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD Cn1nnnc1CCNC(=O)c1cc([N+](=O)[O-])cnc1O 611335330 IBJVNDPZKDZCGA-UHFFFAOYSA-N 293.243 -0.809 5 20 CBBD CNC[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 702053076 UWFGETJLMVBOAN-SECBINFHSA-N 267.289 -0.141 5 20 CBBD O=C(NS(=O)(=O)N1CCCC1)c1ccc([N+](=O)[O-])[nH]1 919670229 SWMFFEXDDXVVGR-UHFFFAOYSA-N 288.285 -0.007 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](CO)[C@H](O)C1 1320788535 OQOGTDNAPDCTDW-VHSXEESVSA-N 298.299 -0.699 5 20 CBBD CC(=O)N1CC[C@@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)C1 1346361827 KIJKKNWTYUKAMG-MRVPVSSYSA-N 283.244 -0.650 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC(=O)NC1=O 90020987 GFUCBKOHWPRCRT-VIFPVBQESA-N 292.251 -0.288 5 20 CBBD CCNC(=O)C1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 178126044 DMNPNKTZTPQQQD-UHFFFAOYSA-N 295.299 -0.306 5 20 CBBD NC(=O)[C@@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CCO1 192786571 PHIFPKPMVJQZNQ-JTQLQIEISA-N 266.257 -0.133 5 20 CBBD COCCN(CC(=O)N(C)C)c1ncc([N+](=O)[O-])c(N)n1 267110336 YPWQPDNAWJPKOY-UHFFFAOYSA-N 298.303 -0.492 5 20 CBBD O=C1CCC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 331266234 IIHOUPMUYPCYRK-SECBINFHSA-N 281.272 -0.424 5 20 CBBD C[C@@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C(=O)N(C)C 338636879 LCCXPBRVHVTXDI-MRVPVSSYSA-N 296.283 -0.651 5 20 CBBD O=C(NCCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])[nH]1 341868359 HUFGDUFZNBUZKW-UHFFFAOYSA-N 295.255 -0.405 5 20 CBBD CCC[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 343926678 ZHKFDVXWZPKHLD-RXMQYKEDSA-N 254.250 0.033 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)c1nncn1C 349792194 UJAGCUXZOFXCRM-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD CCCNC(=O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 356464211 XGBIXFKOINGENT-UHFFFAOYSA-N 283.288 -0.026 5 20 CBBD O=[N+]([O-])c1ccn(CCNC2(CO)CCOCC2)n1 357940435 FZJWDZPBSAOUPS-UHFFFAOYSA-N 270.289 -0.078 5 20 CBBD CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H]1OC 362767609 ZJTKVSODMDHICL-IUCAKERBSA-N 284.272 -0.186 5 20 CBBD Cn1nnc(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)n1 428847550 VLRSMMMXZXHFHR-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CNc1nccc(C(=O)N[C@]2(CO)CCOC2)c1[N+](=O)[O-] 578203840 AGCLDMLSZWCKTM-LBPRGKRZSA-N 296.283 -0.087 5 20 CBBD COCC[C@@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(N)=O 596184369 GDYZLPPJWGUMAY-SSDOTTSWSA-N 269.261 -0.126 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C(=O)O1 808207844 KIWMQHJJTQHCJA-CBAPKCEASA-N 295.251 -0.423 5 20 CBBD CO[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1O 836962388 MXDJPEVFIWNPPX-UTUOFQBUSA-N 296.279 -0.154 5 20 CBBD CC(C)OCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1124424957 KUIWUFYGLHHNOQ-UHFFFAOYSA-N 299.331 -0.041 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCN1CC=CC1 1319376779 ANICBYSYFIUZBE-UHFFFAOYSA-N 292.295 -0.256 5 20 CBBD NC(=O)CCCCNC(=O)Cn1ccc([N+](=O)[O-])n1 1320570710 BYUPUKIJKOXLQQ-UHFFFAOYSA-N 269.261 -0.437 5 20 CBBD C[C@@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(=O)O1 1329065850 KPXUWAOSFWQOLO-RITPCOANSA-N 268.229 -0.238 5 20 CBBD CCOC(=O)C[C@H](O)Cn1ncc([N+](=O)[O-])c1N 1348436965 RPEMNDSDVCSEQB-LURJTMIESA-N 258.234 -0.312 5 20 CBBD CN(C[C@H](O)CO)c1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 1591125548 TYODDEWGVKIHNI-QMMMGPOBSA-N 294.271 -0.436 5 20 CBBD C[C@@H](/C=C\C(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1592202261 SXRCBDUCIRTSQV-KZUAUGPASA-N 295.251 -0.098 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 1601909411 FCXFQSOAGLBKKJ-MRVPVSSYSA-N 286.244 -0.867 5 20 CBBD O=C(N[C@H]1C[C@@H](C(=O)O)C1)c1c[nH]nc1[N+](=O)[O-] 1605833795 QNQUZJSRPDQPPW-SYDPRGILSA-N 254.202 -0.089 5 20 CBBD C[C@](O)(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)O 1609784122 AFDWPMFRELLOOT-NSHDSACASA-N 284.224 -0.134 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H]2COCCO2)c1 38061313 FPJPITMCHCIKGL-QWRGUYRKSA-N 286.288 -0.843 5 20 CBBD O=C(O)COCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 93226843 JEFKNUYBUGNXDM-UHFFFAOYSA-N 257.202 -0.246 5 20 CBBD C[S@@](=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 158093205 KARDUUPJHDACBC-LZVRBXCZSA-N 276.318 -0.880 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCO1 173350250 HOWBULVLVDOTTN-NSHDSACASA-N 293.279 -0.150 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)Cn1cc([N+](=O)[O-])cn1 188516979 YMVWQZSXCIXVEN-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD C[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 191860064 FUXKQFXWZKXNME-ONGXEEELSA-N 298.299 -0.210 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)C(F)(F)F 225104891 JVQCECCZDYRXRS-RXMQYKEDSA-N 282.178 -0.169 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCSCC1 264786852 JSNWKJVMAJZTQI-UHFFFAOYSA-N 299.356 -0.044 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2O)C1=O 265659051 ALTBLDRZIVRTRO-VIFPVBQESA-N 294.267 -0.002 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1ncc([N+](=O)[O-])c(N)n1 302419717 MVORXCDQUZRFAM-ZCFIWIBFSA-N 266.261 -0.366 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1cccn1 344231421 ZIUADIVNAWIRTM-UHFFFAOYSA-N 264.245 -0.196 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)[C@@H]1CCCO1 344923212 PSCXYZWZEZVMPZ-UWVGGRQHSA-N 298.299 -0.244 5 20 CBBD NCC[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 357366464 RXGBYPYSXXQNMX-SECBINFHSA-N 282.304 -0.084 5 20 CBBD COCC(COC)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 388482235 VWRODZOQIVHWLO-LLVKDONJSA-N 288.304 -0.597 5 20 CBBD COc1ccc(CC(=O)N(C)C[C@H](O)CO)cc1[N+](=O)[O-] 545418362 XZJFICFGEMGMGN-JTQLQIEISA-N 298.295 -0.043 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1c[nH]nc1[N+](=O)[O-] 548745950 ZSEKHXDAJJDIDA-UHFFFAOYSA-N 272.261 -0.619 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1(CN)CCC1 567673320 PQIWHKQPAASKFR-UHFFFAOYSA-N 268.277 -0.474 5 20 CBBD CNc1nccc(C(=O)N2CC(O)(COC)C2)c1[N+](=O)[O-] 572134197 XIYHCJHMIDCJAL-UHFFFAOYSA-N 296.283 -0.135 5 20 CBBD C[C@@H](CCO)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 593107868 PFUUHQFJONCYSC-ONGXEEELSA-N 272.305 -0.145 5 20 CBBD Nc1nccc(C(=O)NC[C@@H](O)[C@@H]2CCCO2)c1[N+](=O)[O-] 600242754 QOYOUDGOQYRKCP-BDAKNGLRSA-N 296.283 -0.158 5 20 CBBD Cc1nn(CCC(=O)NCc2nn[nH]n2)c(C)c1[N+](=O)[O-] 609532667 NXHGMXYMGDFBCT-UHFFFAOYSA-N 294.275 -0.372 5 20 CBBD O=C1C[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CCN1 761211240 JBPXZXBZDGCWAF-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD O=C(CN1CCOCC1)OCCn1cc([N+](=O)[O-])cn1 778845266 RSCJBNFQXPEJFA-UHFFFAOYSA-N 284.272 -0.333 5 20 CBBD O=C(NOCCO)C(=O)Nc1cccc([N+](=O)[O-])c1 799631912 FJOYPFFBFGOUQJ-UHFFFAOYSA-N 269.213 -0.427 5 20 CBBD C[C@@H](C(=O)O)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 817772430 ZEFAGJXHXAYJSU-IONNQARKSA-N 272.261 -0.443 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccc([N+](=O)[O-])o1 820288660 NLYYJBZJEJKXEI-UHFFFAOYSA-N 255.146 -0.426 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@H](O)[C@@H](O)C2)c1 859455743 OOPSMFZSQKKHHL-SRVKXCTJSA-N 268.269 -0.334 5 20 CBBD Cn1cnnc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031662064 SKOKHZUAMNLQJR-NXEZZACHSA-N 294.315 -0.972 5 20 CBBD Cc1nc(N(C)CCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1100294773 NTHCFFBEKMVRSP-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NC/C=C/CNC(=O)C(N)=O)n1 1107480934 YEDRUGGCWCUGJG-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD Cc1[nH]nc(C(=O)NCCNC(=O)N(C)C)c1[N+](=O)[O-] 1319997202 PZRGMDXYKRDOEK-UHFFFAOYSA-N 284.276 -0.373 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)N(C)C)c1 41744406 WZLHNHNKMASWCA-UHFFFAOYSA-N 283.240 -0.369 5 20 CBBD CNC(=O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C 48958781 RWHAQBHUKZJSQT-UHFFFAOYSA-N 294.267 -0.296 5 20 CBBD C[C@H](CCCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 94943786 BGOOTWCJJHRNEH-MWLCHTKSSA-N 272.305 -0.097 5 20 CBBD COc1cc(C(=O)NOCC(N)=O)ccc1[N+](=O)[O-] 163245872 IVVPSPCGQUMDOV-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD CN(C(=O)CN1C[C@H](O)[C@H](O)C1)c1ccc([N+](=O)[O-])cc1 278693867 JJASNJAWWIWECK-TXEJJXNPSA-N 295.295 -0.405 5 20 CBBD CN(CCC(N)=O)C(=O)c1ccc([N+](=O)[O-])n1C 343492379 IASJGMOWPHURBF-UHFFFAOYSA-N 254.246 -0.119 5 20 CBBD C[S@@](=O)CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 352689148 KJJKJGWTFNXENY-QGZVFWFLSA-N 260.275 -0.184 5 20 CBBD COC(=O)CN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 355242571 QQIZDILZIUXHQW-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CCNC(=O)N(C)C)c1[N+](=O)[O-] 355863927 MWNJNNJXGCAOME-UHFFFAOYSA-N 298.303 -0.030 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 360590331 CMQLHUFMFNYWRR-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@H]2CCOC2)CC1 366052573 LSOIRLLVSICKNZ-HBNTYKKESA-N 269.301 -0.415 5 20 CBBD CCC[C@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 412516369 FVMMEQPNFNTVPK-ZJUUUORDSA-N 298.299 -0.176 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN([C@@H]2CCNC2)CC1 578745977 QVFCGBMFPQDUFA-SECBINFHSA-N 294.315 -0.562 5 20 CBBD Nc1nccc(C(=O)NC[C@H](O)[C@@H]2CCCO2)c1[N+](=O)[O-] 600242758 QOYOUDGOQYRKCP-IUCAKERBSA-N 296.283 -0.158 5 20 CBBD O=C(CNC(=O)C1CC1)OCCn1ccc([N+](=O)[O-])n1 748121104 ZAIJQMXFLZNEKP-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD C[C@@H](COC(=O)c1cn(C)c(=O)nc1O)[N+](=O)[O-] 813108441 FXCQCBCWXSARAF-YFKPBYRVSA-N 257.202 -0.692 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)Cn1nc2n(c1=O)CCCC2 845577093 JUGBNNNXKKGBBO-MRVPVSSYSA-N 284.272 -0.411 5 20 CBBD O=C1NC(=O)C2(CCC(C(=O)OCCC[N+](=O)[O-])CC2)N1 860914691 CODKGMGXFDMAFF-UHFFFAOYSA-N 299.283 -0.035 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1ccc([N+](=O)[O-])o1 862739547 PZBWBJASGJVUDC-UHFFFAOYSA-N 289.269 -0.437 5 20 CBBD CCNCc1cn(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1093318246 FAEHHNLYNKJTQT-GHMZBOCLSA-N 294.315 -0.564 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1(CO)CC1 1329385098 ZEGLINAMBHRJQC-SSDOTTSWSA-N 269.261 -0.537 5 20 CBBD COC[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)CCO1 1355419254 FVIASLUEFODCER-QMMMGPOBSA-N 271.277 -0.557 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCO 1610842095 SUESFUJSKFIYLD-UHFFFAOYSA-N 290.253 -0.436 5 20 CBBD CN(C)C(=O)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 8516407 LNXLHSAZKKTOHG-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD CC(C)N(C)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 43794782 UGJXDKJMDLIOQW-UHFFFAOYSA-N 296.283 -0.278 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603110 ROARUCAERNEADO-ZCFIWIBFSA-N 286.248 -0.953 5 20 CBBD CS(=O)(=O)c1ccc(NC(CO)CO)c([N+](=O)[O-])c1 87753101 QUWGVORWDXRTAX-UHFFFAOYSA-N 290.297 -0.237 5 20 CBBD CC(C)(C)[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 173343319 KQGGEECLPNTXGR-ZJUUUORDSA-N 299.331 -0.358 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](N2CCNCC2)C1 262051359 MOJFMIJUBDDAMY-SECBINFHSA-N 294.315 -0.562 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 284908531 HRNWAFOVEFKSCQ-RXMQYKEDSA-N 255.234 -0.428 5 20 CBBD COc1n[nH]c(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 355605647 LXIZIYRHPDUVLZ-UHFFFAOYSA-N 294.227 -0.478 5 20 CBBD COC[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])nc1C)OC 357913091 BJABRTYKXGBSFT-SECBINFHSA-N 286.288 -0.123 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1OC 362784163 AHBLUEXOZYMHMJ-NXEZZACHSA-N 298.299 -0.028 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 394068329 NDHULTHMVXEKQF-MRVPVSSYSA-N 267.289 -0.444 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1COC1 451289429 WDGSRGJFHBFCJQ-LLVKDONJSA-N 270.289 -0.127 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1[N+](=O)[O-] 594363652 AXDOQAMDHXZNLD-MYJAWHEDSA-N 292.295 0.342 5 20 CBBD C[C@H](CNC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 594529642 SRLOYFKKFLTFSP-SSDOTTSWSA-N 285.260 -0.189 5 20 CBBD CCOc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 597586010 JQFNUYVTAKQLKP-SECBINFHSA-N 297.267 -0.431 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 598523405 WIGOOKAVENPAKU-ZKCHVHJHSA-N 282.256 -0.141 5 20 CBBD Cc1nn(C)c(C(=O)OCCOCCO)c1[N+](=O)[O-] 740232292 OMOBWVOJYQHITB-UHFFFAOYSA-N 273.245 -0.198 5 20 CBBD Nc1ccc(C(=O)N2CC[C@H](CO)[C@H](O)C2)cc1[N+](=O)[O-] 763269599 OTZNAZLKIPBCNB-BXKDBHETSA-N 295.295 -0.008 5 20 CBBD CC(C)(O)CONC(=O)Cn1cc([N+](=O)[O-])ccc1=O 791265282 YTBJMSHGIKIDCE-UHFFFAOYSA-N 285.256 -0.425 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])ccc2N)CCOC1 848317808 JBWFGGWNPSIPCE-LBPRGKRZSA-N 294.267 -0.449 5 20 CBBD O=C(NC1CN(CCN2CCCC2=O)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293237 IHQHTJYRZSTFTD-GHMZBOCLSA-N 296.327 -0.926 5 20 CBBD CC(=O)N1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1 1116497161 CWLWRFGYVVXTSW-UHFFFAOYSA-N 295.299 -0.059 5 20 CBBD CC(C)c1n[nH]c(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936406 GGYIAVSXIXPOCU-RKDXNWHRSA-N 296.331 -0.201 5 20 CBBD CCN(C(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 1126943700 UQMLLNGGCPGCFC-GHMZBOCLSA-N 298.343 -0.632 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CN)C1CC1 1326260815 QYUDHKMAJGEDFL-ZETCQYMHSA-N 253.262 -0.205 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601759024 WZLIJCWYNPNLBO-HTRCEHHLSA-N 284.228 -0.632 5 20 CBBD O=C(O)c1cc(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)[nH]n1 1602253843 SVDYIDHEYXHDIC-HZGVNTEJSA-N 280.240 -0.301 5 20 CBBD CS(=O)(=O)N1CCN(Cn2cc([N+](=O)[O-])cn2)CC1 14217661 JUURBGVSVUNPDK-UHFFFAOYSA-N 289.317 -0.674 5 20 CBBD O=C(O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 36973374 OFRHLPGXKKMBBO-UHFFFAOYSA-N 255.186 -0.512 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])s1 36977497 HZIGGLWSRCVKLR-SCSAIBSYSA-N 260.227 -0.168 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 80524274 BTDGTROYVUELRA-UHFFFAOYSA-N 278.228 -0.327 5 20 CBBD Cn1c(C(=O)N[C@]2(C(=O)O)CCOC2)ccc1[N+](=O)[O-] 85846724 SSLYAEIZYPDAAH-LLVKDONJSA-N 283.240 -0.093 5 20 CBBD O=C1CCCN1C(=O)Cn1cccc([N+](=O)[O-])c1=O 102204861 MNQHCMPJHZWWAZ-UHFFFAOYSA-N 265.225 -0.095 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)CC(=O)N(C)C 176196555 BFJFDZOAOLQOPF-UHFFFAOYSA-N 255.278 -0.189 5 20 CBBD Cc1cnc(N2CCO[C@H](C(N)=O)C2)c([N+](=O)[O-])c1 266186050 FARZMXAIOUVGRJ-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD CC1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)CCN1CCO 302530364 LFNVMDXHHMGBLI-UHFFFAOYSA-N 296.331 -0.140 5 20 CBBD Nc1noc(CCNC(=O)c2cccc([N+](=O)[O-])c2N)n1 345044155 MKBHTDFGSAZUIT-UHFFFAOYSA-N 292.255 0.115 5 20 CBBD NC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])s2)CCN1 443441629 XENWEXVEURZBRG-RXMQYKEDSA-N 257.275 -0.685 5 20 CBBD CCN1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 452992191 NWMSYTFVZZUHFY-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1(C(=O)O)CCC1 531751223 DSQBTQVVIVIISZ-UHFFFAOYSA-N 283.244 -0.443 5 20 CBBD Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 539781125 OTFIHLRCQBFEQJ-SECBINFHSA-N 278.268 -0.022 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O 582083663 GUHRTNMAYAVGBE-MRVPVSSYSA-N 293.235 -0.213 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839646040 HAFVGYFCKKVAHJ-HLTSFMKQSA-N 255.274 -0.365 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H](C)N1CCOCC1 839658991 WCBZAJMQVTZUJH-UKKRHICBSA-N 271.317 -0.123 5 20 CBBD O=C1N[C@H]2CN(C(=O)c3cc([N+](=O)[O-])n[nH]3)CC[C@@H]2CO1 844121930 PQGJTPASFLDOND-SVRRBLITSA-N 295.255 -0.112 5 20 CBBD COCCN1C[C@@H](C(=O)OCCC[N+](=O)[O-])CC1=O 860913928 LQSCDUFOXFQCGO-VIFPVBQESA-N 274.273 -0.309 5 20 CBBD Cn1cc(C(=O)OCC(C)(C)[N+](=O)[O-])n(C)c1=O 893160149 UKZRZKBCOKFERK-UHFFFAOYSA-N 257.246 -0.064 5 20 CBBD CNC(=O)CC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-] 1093568234 TYCRBUDPBYJKAP-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD Cc1ccnc(N(C)CCNC(=O)CC(N)=O)c1[N+](=O)[O-] 1099971042 XRBVJOOPBFCING-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCC1(O)CCOCC1 1328505580 XZBVORNCEVZHJF-UHFFFAOYSA-N 298.299 -0.161 5 20 CBBD CNc1nccc(C(=O)NCC2(CO)COC2)c1[N+](=O)[O-] 1332890044 USQORKYGHHISOW-UHFFFAOYSA-N 296.283 -0.230 5 20 CBBD Cn1cc([C@@H]2C[S@](=O)CCN2CC[N+](=O)[O-])cn1 1333461054 KBZJWTIMIUCCLI-XTZNXHDOSA-N 272.330 -0.198 5 20 CBBD O=C(N[C@@H]1CCCS(=O)(=O)C1)c1n[nH]cc1[N+](=O)[O-] 1341368549 BOVYTVRFGJRUPR-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD CC[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1576655170 SRPDKVBBWTWPTG-ZCFIWIBFSA-N 294.275 -0.114 5 20 CBBD COCCN(CC(=O)O)C(=O)c1cnc(N)c([N+](=O)[O-])c1 1604592463 AHJOVKYIFSYKPO-UHFFFAOYSA-N 298.255 -0.255 5 20 CBBD Cn1cc(Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)nn1 1610604642 MPZZLIJSEASKQB-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD COCC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 52785129 FDPRGEBVZMJKNQ-SSDOTTSWSA-N 286.244 -0.603 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 110517072 JSXIKKBJYODLDS-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD CC(=O)N1CC(NC(=O)CCn2cc([N+](=O)[O-])nc2C)C1 173034261 LXGXLBYXBCUYDA-UHFFFAOYSA-N 295.299 -0.163 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N(CCO)CC(F)F 231333925 YIYWIFXDNVMZJF-UHFFFAOYSA-N 278.215 -0.123 5 20 CBBD COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H](C)O 274445658 ICNZBPVPOMUUIK-LHLIQPBNSA-N 297.267 -0.171 5 20 CBBD CCN(C)C(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 274881512 ZKEPBZOUYWGQOF-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CN1C[C@H](O)[C@H](O)C1 278659509 HTICRBQHTSHOIZ-JLLWLGSASA-N 298.295 -0.628 5 20 CBBD CN(C)CCN(C)CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 290668261 PBVCVFMXMOGATI-UHFFFAOYSA-N 298.347 -0.069 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CCC(=O)NC2)c1[N+](=O)[O-] 345862562 LBUMBLWSCNDMEV-LURJTMIESA-N 281.272 -0.111 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCSC1 360752064 DIZLXEMQJVGYSJ-SNVBAGLBSA-N 286.313 -0.074 5 20 CBBD O=C(O)C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 396716161 RLNZPBCAMCQNQU-UHFFFAOYSA-N 280.240 -0.277 5 20 CBBD CNc1nc(C(=O)N[C@H]2CC(=O)N(C)C2)ccc1[N+](=O)[O-] 455277472 DQOOZIYBGQFWSV-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD C[C@H](N)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 592985015 ZXYQPJFOASHJDQ-ONGXEEELSA-N 269.305 -0.161 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)CCF 593860850 AHKPTMNUAJUHPA-SSDOTTSWSA-N 260.225 -0.372 5 20 CBBD Nc1nccc(C(=O)N2[C@@H]3CO[C@H]4[C@@H]3OC[C@H]42)c1[N+](=O)[O-] 594328283 PPMNTHYFLJMFHR-KHUVANEUSA-N 292.251 -0.437 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2cccnc2[N+](=O)[O-])C1 609564213 WOMRCRJAHAPQSR-SSDOTTSWSA-N 272.286 -0.143 5 20 CBBD O=C1NC(=O)C(C(=O)Nc2cccc([N+](=O)[O-])c2)C(=O)N1 750671737 IILBUQZGGUIJFT-UHFFFAOYSA-N 292.207 -0.485 5 20 CBBD CC(=O)NC[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 978484569 KNZHACAHHUFVDJ-UTINFBMNSA-N 255.274 -0.318 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](Nc2ccnc(O)c2[N+](=O)[O-])C1 1059803972 NOPBFISNSLIQBG-OLQVQODUSA-N 295.255 -0.760 5 20 CBBD O=C(O)[C@]12COC[C@H]1CN(CCn1ccc([N+](=O)[O-])n1)C2 1118505633 FMXPKDSSFUFMQV-BXKDBHETSA-N 296.283 -0.176 5 20 CBBD CNC(=O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1347394798 JOUMHQCUVYPNHU-UHFFFAOYSA-N 267.245 -0.729 5 20 CBBD NC(=O)c1ccnc(N2CCOCC2)c1[N+](=O)[O-] 1347396846 UIUWIYXUNSURCG-UHFFFAOYSA-N 252.230 -0.075 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2C[C@@H](O)C2)c1[N+](=O)[O-] 1347708225 BHWVFEBPJJGFBD-KNVOCYPGSA-N 254.246 -0.110 5 20 CBBD CC[C@@H](CO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 37888174 OHTZDYFKOQFSTR-WCBMZHEXSA-N 258.278 -0.487 5 20 CBBD CN(C)CCN(CCN(C)C)C(=O)c1n[nH]cc1[N+](=O)[O-] 120221733 KHMPIEFPRLTCGI-UHFFFAOYSA-N 298.347 -0.117 5 20 CBBD CCCS(=O)(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 172663617 IRWBLISEIRCTJD-UHFFFAOYSA-N 276.274 -0.353 5 20 CBBD Cc1ccnc(N2CCO[C@H](C(N)=O)C2)c1[N+](=O)[O-] 265150074 BENLIGKKEHWQEV-QMMMGPOBSA-N 266.257 -0.011 5 20 CBBD CCN(CCO)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 274489676 BPQHJYVPCDOTQV-UHFFFAOYSA-N 299.331 -0.470 5 20 CBBD O=C(NCCN1CCOCC1)c1cnc(O)c([N+](=O)[O-])c1 274903170 QKWWPRUULAUWCT-UHFFFAOYSA-N 296.283 -0.243 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 285814476 DYOGMAGYMQIUAG-XNCJUZBTSA-N 267.245 -0.428 5 20 CBBD O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])[nH]n1 286033060 JHKYERRFFOEKJL-LURJTMIESA-N 279.256 -0.189 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1O)NCCO 295408360 LCMNOGNVKBEZNV-UHFFFAOYSA-N 283.240 -0.861 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCO[C@H](CO)C2)c1 331123113 CAPKIBOKQNXXSO-JTQLQIEISA-N 256.262 -0.516 5 20 CBBD Cn1cc([C@@H](CO)Nc2ncc([N+](=O)[O-])c(N)n2)cn1 339701625 RIHFBQJODLBOBV-SSDOTTSWSA-N 279.260 -0.154 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H]1CO 357648623 FCBWKJRIHJQEHL-NKWVEPMBSA-N 253.262 0.032 5 20 CBBD COCC[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400472 LPYLKYCNMBVNNC-ZETCQYMHSA-N 284.272 -0.301 5 20 CBBD N[C@H]1C[C@H]2CN(c3ncc([N+](=O)[O-])cc3F)CCN2C1=O 569139742 SSYXZIPCOVKQMS-WPRPVWTQSA-N 295.274 -0.123 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)c1[N+](=O)[O-] 577887145 GKIIIQGYLOHIGA-BDAKNGLRSA-N 294.315 -0.615 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1CC[C@H](O)C1 599202948 SIINGAOTSNATMO-QMMMGPOBSA-N 255.278 -0.193 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCNC(=O)C1 610782702 MUOMJLOTMPMHJM-UHFFFAOYSA-N 253.262 -0.468 5 20 CBBD CC[C@@]1(C)NC(=O)N(NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 806309281 PZRQBLYSXDATQF-SNVBAGLBSA-N 296.243 -0.317 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)c3c([N+](=O)[O-])cnn3C)C[C@H]21 816967813 ZCRYVWAUCDIKCE-QMSLJYSESA-N 294.267 -0.181 5 20 CBBD CNC(=O)[C@@H]1CN(Cc2cccnc2[N+](=O)[O-])CCO1 886122639 FUDRXEUIPLCEES-JTQLQIEISA-N 280.284 -0.063 5 20 CBBD Cc1noc(CN2CCO[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 1118494134 AKHIQCBQVCMNMV-MRVPVSSYSA-N 270.245 -0.423 5 20 CBBD CCn1ccnc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1327112437 JJWRHAVVTJVVAZ-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD C[C@H]1CCN1C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1332157189 QWWOHNCRBHPQNJ-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CN(CCO)c1ccc([N+](=O)[O-])c(N)c1-c1nn[nH]n1 1579227121 RRRVGYULGCTCIB-UHFFFAOYSA-N 279.260 -0.214 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](O)CN1 37668502 POHDPCZDTWUIJU-GHMZBOCLSA-N 265.269 -0.066 5 20 CBBD C[C@@H]1CNCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 124504632 XFWDKEFPGLIUNT-SECBINFHSA-N 280.284 -0.423 5 20 CBBD CC[C@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 161502159 FZFJBYNYCSQJDT-MRVPVSSYSA-N 271.277 -0.139 5 20 CBBD CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)C(N)=O 228492403 WAQULCGMQVEPNC-MRVPVSSYSA-N 297.267 -0.431 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@](F)(C(=O)O)C1 262211332 SDCMEZGKMSHLPV-JTQLQIEISA-N 286.219 -0.184 5 20 CBBD CN1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 264560499 OCULPWALRNYFJW-RXMQYKEDSA-N 252.234 -0.390 5 20 CBBD NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 267298702 JNIWCJDNZRITMI-ZJUUUORDSA-N 295.299 -0.048 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1O 330505500 KCMUTRGROXJNSI-JGVFFNPUSA-N 269.261 -0.584 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 352057194 ITDHNJRGAWGHIO-SSDOTTSWSA-N 280.240 -0.215 5 20 CBBD Cc1[nH]nc(C(=O)NCC(C)(C)C(N)=O)c1[N+](=O)[O-] 354591819 ABVNESNOVGNHBC-UHFFFAOYSA-N 269.261 -0.132 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CC(=O)NC1=O 355322199 QTAOUWOIIZKXMD-MRVPVSSYSA-N 280.240 -0.200 5 20 CBBD C[C@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)CC(=O)O 573687271 ADVHLDSGLZKQIH-YFKPBYRVSA-N 255.234 -0.088 5 20 CBBD O=C(NC[C@@]1(O)CN2CCC1CC2)c1c[nH]nc1[N+](=O)[O-] 574530771 GNUBCPKARJLDTQ-GFCCVEGCSA-N 295.299 -0.496 5 20 CBBD CNS(=O)(=O)CCn1cc([N+](=O)[O-])cc(Cl)c1=O 598708915 HFASJYNQKUXTGY-UHFFFAOYSA-N 295.704 -0.041 5 20 CBBD Cc1nonc1CC(=O)NCCn1cc([N+](=O)[O-])cn1 845835717 CZPHRJQBVYULME-UHFFFAOYSA-N 280.244 -0.158 5 20 CBBD CCNS(=O)(=O)[C@H]1CCN(CC[N+](=O)[O-])C1 930177800 PGISZSRJOIWHRL-QMMMGPOBSA-N 251.308 -0.723 5 20 CBBD Cc1nc[nH]c1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991287350 IZJAHBMTKHUGGT-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD Cn1cnc(C(=O)NCCNc2ncccc2[N+](=O)[O-])n1 1093589957 KBPPXMZWIHEJPV-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD C[C@H](CN1CCN(C)CC1)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1253825831 RGOZDGNWLPTURZ-SECBINFHSA-N 296.331 -0.316 5 20 CBBD Cc1nn(C)c(C(=O)N(CC(N)=O)C(C)C)c1[N+](=O)[O-] 1318319951 BDQSDUUUDDZIEK-UHFFFAOYSA-N 283.288 -0.027 5 20 CBBD CN(C)S(=O)(=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 1319046359 LILROFQOUMMFMN-UHFFFAOYSA-N 291.289 -0.896 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](COC)C(N)=O 1319543340 SIQLJRXYDANYIK-JTQLQIEISA-N 296.283 -0.133 5 20 CBBD O=C(Cn1cncn1)NCCn1cc([N+](=O)[O-])cn1 1324093574 FEVXUWUQYBNDJW-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCn1ccnn1 1333412796 BDQLDARTNPDEAH-UHFFFAOYSA-N 279.260 -0.492 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC(C(=O)O)C1 1600748601 XEEBLPQMNUPGCQ-UHFFFAOYSA-N 268.229 -0.357 5 20 CBBD CCN(C)C(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 184488185 IDIRMCWESGUERP-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD CCN(CCn1cc([N+](=O)[O-])ccc1=O)CC(N)=O 191731439 YLZDJMKLWXOHSI-UHFFFAOYSA-N 268.273 -0.436 5 20 CBBD Cc1cnc(N2CCO[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 266186049 FARZMXAIOUVGRJ-SECBINFHSA-N 266.257 -0.011 5 20 CBBD C[C@H](CO)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 285834297 YXCMWJJWJVYHKE-MRVPVSSYSA-N 269.257 -0.404 5 20 CBBD NC(=O)[C@H](CO)Nc1nc2sccn2c1[N+](=O)[O-] 286288421 IOMKCTZHCXLSPM-BYPYZUCNSA-N 271.258 -0.438 5 20 CBBD CCNC(=O)NC(=O)Cn1c(C)c([N+](=O)[O-])ccc1=O 294355916 ZOGVDEZSCWMILD-UHFFFAOYSA-N 282.256 -0.089 5 20 CBBD NS(=O)(=O)c1ccc(OCCO)c([N+](=O)[O-])c1 298104732 WGAGISBLSSXNOO-UHFFFAOYSA-N 262.243 -0.387 5 20 CBBD COC[C@@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 345926018 ASCKSAGWIRSCOP-JTQLQIEISA-N 299.283 -0.730 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 346843029 CJQHSINQVPHSMB-SSDOTTSWSA-N 283.288 -0.223 5 20 CBBD CCNC(=O)NCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 351772148 YERWCAPJMIGXDT-UHFFFAOYSA-N 270.249 -0.633 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCn1ccccc1=O 356477925 LSYJBCQIBNFHBT-UHFFFAOYSA-N 291.267 -0.080 5 20 CBBD CO[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H](CN)C1 359210686 BJQGAFSNUKPFLG-KOLCDFICSA-N 297.315 -0.244 5 20 CBBD CS(=O)(=O)N1CCC[C@H](Cn2cnc([N+](=O)[O-])n2)C1 360709131 YTZKJPISBSUCLV-MRVPVSSYSA-N 289.317 -0.142 5 20 CBBD Cc1cnc(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)cn1 413344397 CMUDNIIJGYIVON-UHFFFAOYSA-N 275.272 0.142 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N(C1CC1)[C@@H]1CCNC1 435244918 JBOPYMBEZUPRMZ-SECBINFHSA-N 280.288 -0.461 5 20 CBBD O=C(NC[C@@H]1CNCCCO1)c1cc([N+](=O)[O-])n[nH]1 571679945 XYQSJOGQVOQOSD-ZETCQYMHSA-N 269.261 -0.574 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1=O 773659907 DUFWDBNHUYIXRW-VIFPVBQESA-N 292.251 -0.336 5 20 CBBD CC(=O)OCCNC(=O)CCn1cc([N+](=O)[O-])cn1 798137701 YSXFSVXMUSEYPS-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD C[S@](=O)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821943925 YFGSHEGFAPSEAP-FQEVSTJZSA-N 297.300 -0.040 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC(S(C)(=O)=O)C1 893681847 LEJMOQMHOOGMFW-UHFFFAOYSA-N 260.275 -0.439 5 20 CBBD O=C(NC1CN(C(=O)c2cn[nH]c2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282196 YFNCEZRRXHKXCX-RKDXNWHRSA-N 279.256 -0.985 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1256261709 CFTHOWRNKQYGMH-QUBYGPBYSA-N 270.245 -0.412 5 20 CBBD CCS(=O)(=O)C[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1324934192 SIMIPPSYTHGBGX-LURJTMIESA-N 290.301 -0.129 5 20 CBBD NCC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(F)F 1346055725 DEFSMFDMTWLHMB-RXMQYKEDSA-N 278.219 -0.715 5 20 CBBD Cn1nncc1COC(=O)Cn1cnc([N+](=O)[O-])n1 1525397653 REGPSLNHYTTYAG-UHFFFAOYSA-N 267.205 -0.942 5 20 CBBD O=C(O)C(=O)N1CCN(Cc2cccnc2[N+](=O)[O-])CC1 1574616573 RELXOTOCFJCVGF-UHFFFAOYSA-N 294.267 -0.281 5 20 CBBD O=C(O)c1nsc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1602586656 IWGTYKSJUPSBEU-PWNYCUMCSA-N 258.215 -0.160 5 20 CBBD NC(=O)[C@H]1CN(c2ncccc2[N+](=O)[O-])CCO1 50955659 AVNCGELSECQODW-MRVPVSSYSA-N 252.230 -0.320 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H](CO)O1 163571945 PXBHJVNUPSKXPF-VIFPVBQESA-N 298.299 -0.210 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 185940683 YIDWWUAYLZWQMB-NXEZZACHSA-N 298.299 -0.210 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H](C(N)=O)C1 186971019 CGSNJUHBVYALTK-RKDXNWHRSA-N 295.299 -0.096 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(C[C@@H](C)O)c1=O 193085828 KVWABZSHPJEPIR-ZCFIWIBFSA-N 256.214 -0.076 5 20 CBBD COC[C@@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 228343490 KTFIQUQYNPVMEK-KOLCDFICSA-N 288.304 -0.861 5 20 CBBD CN1CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 269168516 WOUYFBGPKJLCMA-UHFFFAOYSA-N 282.304 -0.252 5 20 CBBD CCN(CCOCCO)C(=O)c1n[nH]cc1[N+](=O)[O-] 282658029 YFEYYVLSURKPNB-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2OCCN[C@@H]2C1 572167426 FKQVVJJNULWEMU-KOLCDFICSA-N 281.316 -0.109 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC(CO)CO 770434831 RZONDFVQNIKPQI-UHFFFAOYSA-N 283.284 -0.256 5 20 CBBD O=C(O)NCC(=O)OCCn1cc([N+](=O)[O-])cn1 832403264 PZFMLJUASQUEKZ-UHFFFAOYSA-N 258.190 -0.398 5 20 CBBD CC(=O)N1CC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1 860937278 SZSGULZOGKQAEJ-SECBINFHSA-N 282.256 -0.045 5 20 CBBD COCCN1CN(c2c([N+](=O)[O-])cnn2C)CC1=O 893721630 VDSLTVRCFVVPAL-UHFFFAOYSA-N 269.261 -0.419 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](COC)C(N)=O 1319543341 SIQLJRXYDANYIK-SNVBAGLBSA-N 296.283 -0.133 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCSCC(=O)O 1339060479 IPKBBXWKZJNEMS-UHFFFAOYSA-N 288.285 -0.124 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCc1nncs1 1345127361 QJLRWNKHYVAVFH-UHFFFAOYSA-N 270.230 -0.219 5 20 CBBD NC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 54482138 QZBQUJVEDOJRHW-UHFFFAOYSA-N 298.324 -0.101 5 20 CBBD CO[C@H](C)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 224205432 BATXTIORLAMSPX-SCZZXKLOSA-N 258.278 -0.223 5 20 CBBD COCC[C@@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 281791472 VQKTVCJZCVVKHN-VIFPVBQESA-N 286.288 -0.305 5 20 CBBD CNC(=O)[C@@H](CO)Nc1cc(C)c([N+](=O)[O-])cn1 302148114 KIVXNOYGZZTZMD-SSDOTTSWSA-N 254.246 -0.183 5 20 CBBD CCn1cc(S(=O)(=O)N(C)[C@H](C)CO)c([N+](=O)[O-])n1 330511209 JTONDQUWPCYKRM-SSDOTTSWSA-N 292.317 -0.188 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@@H](O)C1 330964181 KTFPCPOLPFUIIM-SECBINFHSA-N 254.246 -0.225 5 20 CBBD O=C1C[C@@H](Nc2nc(O)c3cc([N+](=O)[O-])ccc3n2)CN1 342934613 QPTXLLJSXPOXGY-ZCFIWIBFSA-N 289.251 0.544 5 20 CBBD C[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 343171495 CBWVZPFVGWKRRP-ZETCQYMHSA-N 255.230 -0.747 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 351825064 GEPLPEUTNHKZGH-MIMYLULJSA-N 270.289 -0.535 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCc1nc[nH]n1 354243654 PLCYJIROGOHJSS-UHFFFAOYSA-N 263.217 -0.181 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354765515 FWUDSVKRJCXQSO-LURJTMIESA-N 282.260 -0.539 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 376410343 GWISJGMSRKCERT-BGZDPUMWSA-N 272.257 -0.824 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H]1OC 487134394 HGJSNVXEYPXRBC-YUMQZZPRSA-N 269.261 -0.183 5 20 CBBD CNS(=O)(=O)CC(=O)NCc1cccc([N+](=O)[O-])c1 531202200 VZHCMUUPQIMJRT-UHFFFAOYSA-N 287.297 -0.240 5 20 CBBD CNc1nccc(C(=O)NCCNC(C)=O)c1[N+](=O)[O-] 584787884 HGJHGVVIUWIUCJ-UHFFFAOYSA-N 281.272 -0.103 5 20 CBBD C[C@@H](N)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 592475519 LWIYOCAHBALZFA-NXEZZACHSA-N 269.305 -0.161 5 20 CBBD CC(C)(C(=O)NC[C@@H](O)C(N)=O)c1ccccc1[N+](=O)[O-] 597586363 LSACQLABGVDGRV-SNVBAGLBSA-N 295.295 -0.165 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 597654137 OVJXADGDMFGAII-MRVPVSSYSA-N 270.289 -0.414 5 20 CBBD C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@@H](O)C1 599532151 BFKUKUQKNZCIGM-UWJYBYFXSA-N 295.295 -0.041 5 20 CBBD CC(C)c1[nH]nc(C(=O)N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 600216728 CPVJLZIXRVIVKY-BQBZGAKWSA-N 284.272 -0.381 5 20 CBBD Nc1nc(N2CCN(CC(=O)O)CC2)ncc1[N+](=O)[O-] 739204067 VRXWAFOVNACMRC-UHFFFAOYSA-N 282.260 -0.826 5 20 CBBD CCN(C)C(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748917648 OATPQZFPRFUTAJ-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 787196964 CBOWOXCFWMHFLK-SNVBAGLBSA-N 297.267 -0.169 5 20 CBBD C[C@]1(C(=O)O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 828024251 KHLLJHFWIJTWMN-PWSUYJOCSA-N 298.299 -0.051 5 20 CBBD CNC(=O)CN1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891563014 VTFLVUNLVMTMIZ-UHFFFAOYSA-N 282.304 -0.804 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)N1CCC1 1319757134 WJVKHBWFMDLTRT-UHFFFAOYSA-N 268.229 -0.283 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](CO)c2cnn(C)c2)c1[N+](=O)[O-] 1319886962 BFHAYSHLRLFYCO-MRVPVSSYSA-N 294.271 -0.177 5 20 CBBD Cn1cnnc1COC(=O)Cn1ccc([N+](=O)[O-])n1 1324808839 JXVUFDLELHCQLE-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD C[C@@H]1[C@@H](C(=O)O)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1594166605 YOASSKKSCBJOTA-MIMYLULJSA-N 298.299 -0.053 5 20 CBBD C[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 191860052 FUXKQFXWZKXNME-KOLCDFICSA-N 298.299 -0.210 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cnc1N 230697486 ILCCPLHGWVRGBL-YFKPBYRVSA-N 267.245 -0.434 5 20 CBBD CC(C)(C)OC(=O)CNC(=O)Cn1cnc([N+](=O)[O-])n1 265332524 SSDNJPKTXSSZML-UHFFFAOYSA-N 285.260 -0.356 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)C1CCOCC1 330846642 OWWBZJPPMWVTOA-SNVBAGLBSA-N 298.299 -0.305 5 20 CBBD C[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 338601935 GLFJXSJEJPEZRF-ZCFIWIBFSA-N 269.261 -0.484 5 20 CBBD COC[C@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 338685798 VBPYQWHHAMRJAY-SSDOTTSWSA-N 269.257 -0.086 5 20 CBBD COC[C@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340549370 AIZQTYNCYCCOPP-VIFPVBQESA-N 299.283 -0.730 5 20 CBBD CNC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(C)C 353440940 RATYRRRXAUSUOF-VIFPVBQESA-N 283.288 -0.171 5 20 CBBD C[C@@]1(C(N)=O)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 360258111 NYSXUECOQRSISB-GFCCVEGCSA-N 293.283 -0.210 5 20 CBBD O=C(CNC(=O)Cn1cc([N+](=O)[O-])cn1)NCC(F)F 361367979 FMESIHPVJORKPT-UHFFFAOYSA-N 291.214 -0.711 5 20 CBBD Cn1nnc(CNC(=O)COc2cccc([N+](=O)[O-])c2)n1 362941259 NWJBNKJKNVLWGZ-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 566686821 GZDORAWAFXCCNJ-HTQZYQBOSA-N 296.283 -0.206 5 20 CBBD CNC[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 595984921 XYRBWGXZASMMPL-QMMMGPOBSA-N 268.273 -0.519 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCOCCN1 597707524 MTZWJCBNBITJNA-UHFFFAOYSA-N 269.261 -0.537 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O 773515624 UBOTVQKSZVCCBQ-QMMMGPOBSA-N 283.240 -0.470 5 20 CBBD CCOC(=O)[C@@H]1CNCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1326308831 FGYAIPCRLRIQBD-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD CNC[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350908267 CAIRCBPLKBETHL-ZYHUDNBSSA-N 283.332 -0.307 5 20 CBBD CNC[C@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N 1578647957 WVBSGXPBFPCLSC-VIFPVBQESA-N 282.300 -0.171 5 20 CBBD O=C(O)[C@@H](Cn1ccnc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601663230 QXMUHWWVNMQCNT-BWZBUEFSSA-N 268.229 -0.882 5 20 CBBD CCN(CC(=O)O)C(=O)Cn1ccc([N+](=O)[O-])n1 50469732 PDNPZMNIJVNLBE-UHFFFAOYSA-N 256.218 -0.276 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H](O)C(=O)O 90261016 ILRICBDGOFYFKD-VIFPVBQESA-N 284.224 -0.465 5 20 CBBD COC(=O)Cn1cc(CNc2ncc([N+](=O)[O-])s2)nn1 337012132 HMYZLOYKAVJJNR-UHFFFAOYSA-N 298.284 0.428 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342299772 BVDGXMHVXYQBSK-SFYZADRCSA-N 284.272 -0.288 5 20 CBBD COC(=O)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 349543005 PATYOHGDSSEBTQ-QMMMGPOBSA-N 285.260 -0.500 5 20 CBBD O=C(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)NCCO 356515686 MSNVUHKWWAGUTF-UHFFFAOYSA-N 281.268 -0.638 5 20 CBBD C[C@@](O)(CNc1ccc(N)c([N+](=O)[O-])n1)C(=O)O 595968075 DRHQCOKDNXZIKU-SECBINFHSA-N 256.218 -0.181 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCN1CCNC1=O 726388746 GLIHYTCGVPAGRY-UHFFFAOYSA-N 283.244 -0.640 5 20 CBBD CN1CC[C@@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@@H]2C1 793933816 VNGOIGOOSOOLTF-ZJUUUORDSA-N 294.315 -0.404 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839654576 MPPNBZZEPRRTFV-OPRDCNLKSA-N 257.290 -0.512 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCCNCC2)c1 923277378 GJOOYGYUZJYXRK-LLVKDONJSA-N 269.305 -0.553 5 20 CBBD Cc1ccnc(NCCN(C)C(=O)C(N)=O)c1[N+](=O)[O-] 1101935249 IQWLLLAUIMAJKD-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCNC1 1261464696 WXMVNVAHCNJOSB-SSDOTTSWSA-N 253.262 -0.190 5 20 CBBD CN[C@@H]1CCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1332414173 TYHYVZQDZGRXNZ-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD C[S@@](=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1338672679 VSOTXSJACJVXJD-QGZVFWFLSA-N 260.275 -0.714 5 20 CBBD C[C@H](CCCCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1349417966 LARFHLZEZSQOAM-MRVPVSSYSA-N 270.293 -0.180 5 20 CBBD COC[C@](C)(NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1610244515 SIBTTZFMLKXWEO-JTQLQIEISA-N 272.261 -0.129 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1C[C@H](O)CN1 50015952 IJQDMLSHAVVODG-VHSXEESVSA-N 265.269 -0.066 5 20 CBBD CCc1nn(C)c(N2CCO[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 92829387 TVBWGRDVUJNPBA-MRVPVSSYSA-N 283.288 -0.419 5 20 CBBD COCCN(CCO)C(=O)Cn1cc([N+](=O)[O-])cn1 164164420 VWXZDJJXHNFEDX-UHFFFAOYSA-N 272.261 -0.741 5 20 CBBD CNC(=O)C(C)(C)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 230396129 DQFLBSRNRQGPAP-SNVBAGLBSA-N 299.331 -0.486 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCC(=O)N1CCOCC1 271853211 HRIQEKZOTHDHHT-UHFFFAOYSA-N 269.261 -0.401 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2COC[C@H]2O)c1 295294384 JPXJGPDGYVIVST-NXEZZACHSA-N 288.281 -0.367 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 316934346 XBCXAQPOUHZQBR-HTRCEHHLSA-N 283.240 -0.523 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 330465374 VRSRIBGDPQYPGT-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD COCCCN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 341843596 NSYQTYDYUBUCEI-UHFFFAOYSA-N 257.250 -0.319 5 20 CBBD CCOC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354360963 ZXKRDOITWITXSE-LURJTMIESA-N 258.234 -0.555 5 20 CBBD CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 408053819 ZUSOCZUFXBETEO-UHFFFAOYSA-N 253.262 -0.284 5 20 CBBD O=[N+]([O-])c1ccn(CCN[C@@H](CO)[C@H]2CCCO2)n1 447921928 NBGJUSNCGNQWIC-VHSXEESVSA-N 270.289 -0.079 5 20 CBBD CN1CC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 594343352 PDOHNXDBZUVVFF-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD Cc1nn(C)c(C(=O)N2CCOCCN2)c1[N+](=O)[O-] 597706904 DHHZBMGNKJOEEY-UHFFFAOYSA-N 269.261 -0.386 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1C[C@H]2CNC[C@@H]2C1 611185728 VVBXUHYJWPPJDA-GHMZBOCLSA-N 278.312 -0.092 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCCNC(=O)C1 726779461 ZFIFBFHTEZWQSF-UHFFFAOYSA-N 295.299 -0.162 5 20 CBBD COCCONC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748767533 GGGPYPWYDQUYAX-UHFFFAOYSA-N 271.229 -0.549 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@@H](C)OC1=O 808202538 NYYAQSIBQGGBFW-SVRRBLITSA-N 282.256 -0.080 5 20 CBBD Nc1nc(N2CC(n3cncn3)C2)ncc1[N+](=O)[O-] 812474630 OVDJCGQNZBTLTC-UHFFFAOYSA-N 262.233 -0.380 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCC(=O)O 821315588 YUDSXLSBTQDUCF-UHFFFAOYSA-N 256.218 -0.077 5 20 CBBD CCC(=O)N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21 976000676 JOSQXNNMAKHYHE-DZEUPHNYSA-N 267.285 -0.365 5 20 CBBD CC(C)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991282157 XIPUGKRQCHJPQJ-RKDXNWHRSA-N 255.274 -0.365 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)N1CCNC1=O 1116426371 DTRYYTPYYRWJDL-UHFFFAOYSA-N 297.227 -0.963 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@H](O)C1 1118334194 USEWSLRHIHQIPR-SSDOTTSWSA-N 255.234 -0.830 5 20 CBBD Cn1nncc1C(=O)Nc1c([N+](=O)[O-])cnn1C 1256505554 SSCYOCYAIMHYQW-UHFFFAOYSA-N 251.206 -0.291 5 20 CBBD C[S@@](=O)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1321219414 ABYWINUCBSTYGG-GOSISDBHSA-N 272.286 -0.041 5 20 CBBD Cc1nc(NC[C@H](O)CC(=O)O)ncc1[N+](=O)[O-] 1600716061 VJMNCAYDLAUWHC-ZCFIWIBFSA-N 256.218 -0.059 5 20 CBBD O=C(NC1(C(=O)O)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1601431140 YKDIHKXUYDOSCO-UHFFFAOYSA-N 284.228 -0.319 5 20 CBBD CNC(=O)CNC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C 48958663 XFLJZOMQZOLXII-UHFFFAOYSA-N 294.267 -0.296 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCS(C)(=O)=O 49448474 RWVJKGXSHWUHMQ-UHFFFAOYSA-N 290.301 -0.739 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN(CC2CC2)CC1 147556543 WOVWDLRQDMFUCQ-UHFFFAOYSA-N 294.315 -0.260 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 231849562 HVSMZXRAPYCNQJ-MWLCHTKSSA-N 299.331 -0.391 5 20 CBBD CNS(=O)(=O)CC(=O)NCc1ccc([N+](=O)[O-])cc1 267542696 ALDMRCLMBCNFBI-UHFFFAOYSA-N 287.297 -0.240 5 20 CBBD COCCN1CN(c2ncc([N+](=O)[O-])cn2)CC1=O 282272782 OYMAHPKOBDHWPQ-UHFFFAOYSA-N 267.245 -0.363 5 20 CBBD COC(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285081445 ICMSDVBVGOSJNW-UHFFFAOYSA-N 256.218 -0.001 5 20 CBBD O=C(NCCN1CCOCC1)c1ccc([N+](=O)[O-])[nH]1 298852228 MSRICJCKEUYUDL-UHFFFAOYSA-N 268.273 -0.015 5 20 CBBD COC[C@@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 338455317 VFUSKYDJOPGTNI-VIFPVBQESA-N 287.276 -0.902 5 20 CBBD CN1CCC(CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1 341815130 WJNCODYJEKUQOI-UHFFFAOYSA-N 266.305 0.143 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1 352991040 PJEJILRDVGQRGR-QMMMGPOBSA-N 253.214 -0.829 5 20 CBBD Cn1[nH]cnc1=NC(=O)CCn1cc([N+](=O)[O-])cn1 355234870 FGDZPIQFSQNBHP-UHFFFAOYSA-N 265.233 -0.630 5 20 CBBD CCN(CC(N)=O)C(=O)CCn1cc([N+](=O)[O-])nc1C 355837573 VMUURQXQKOHSKX-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@H]1CC(=O)NC1=O 360804705 XUKDCOMJJKYFLK-LURJTMIESA-N 295.255 -0.795 5 20 CBBD NS(=O)(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 376117330 RZDHMMQLXUZOPU-UHFFFAOYSA-N 275.290 -0.368 5 20 CBBD Cc1cnc(OCC(=O)Nc2nn[nH]n2)c([N+](=O)[O-])c1 439287118 VILPYAAVUZWHNF-UHFFFAOYSA-N 279.216 -0.171 5 20 CBBD COC[C@@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 524716298 ZTGFLIMEVVJVPC-LBPRGKRZSA-N 299.283 -0.730 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 572403585 SAQGLZKPSNYDCN-RXMQYKEDSA-N 254.202 -0.135 5 20 CBBD O=C1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CCN1 602423568 GJEBHHCJBCSKAO-UHFFFAOYSA-N 293.235 -0.105 5 20 CBBD Cc1nn(C)c(NC[C@@H](O)CN(C)C)c1[N+](=O)[O-] 717391822 HKDFBXQALRBQKN-MRVPVSSYSA-N 257.294 -0.029 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(N2CCOCC2)C1 829034528 VVKHCMMTCDBUBR-NXEZZACHSA-N 255.274 -0.805 5 20 CBBD O=C(N[C@H]1C[C@H]2CCCCN2C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839793584 UYYZHSQFUZUIRL-DOLQZWNJSA-N 267.285 -0.079 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CN(C)CCN1C 896536099 VGPCPSHTCSGTNA-GWOFURMSSA-N 270.333 -0.598 5 20 CBBD CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 928867080 KNOPHERFFONDJY-IWSPIJDZSA-N 255.274 -0.221 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1 1110324767 ZQKCSXYXXJSUTG-UHFFFAOYSA-N 279.256 -0.464 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC[C@@]1(O)CCCOC1 1261526712 SJMCEQPFFIIABS-LBPRGKRZSA-N 298.299 -0.010 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H](C)C(N)=O 1323742908 BSMQFUYFWOHCGW-RXMQYKEDSA-N 256.218 -0.483 5 20 CBBD CC(C)OC[C@@H](C(=O)O)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1591710185 SMLPCIYVCWWMAS-HLTSFMKQSA-N 274.273 -0.012 5 20 CBBD O=C(O)Cn1cc(CCCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1602159122 AEYXGOXFKFIOMK-RKDXNWHRSA-N 298.255 -0.496 5 20 CBBD CC(=O)N[C@@H]1CCCN(C(=O)Cn2nccc2[N+](=O)[O-])C1 119701241 KMUZFDZZAWVYCH-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CCCN1 178740740 WSATXCZYPZRISC-VIFPVBQESA-N 267.289 -0.032 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262487366 FPQZMSRUAOICEJ-LURJTMIESA-N 269.213 -0.654 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NN1CCCNC1=O 272444668 URUYMPRGSJEDNZ-UHFFFAOYSA-N 268.233 -0.762 5 20 CBBD CNC(=O)CCCN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 344658283 PNZGCGMODYQLKE-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD C[C@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)c1nn[nH]n1 358413580 NTMGVEAPJYEFQF-SSDOTTSWSA-N 294.275 -0.434 5 20 CBBD Cc1[nH]nc(C(=O)N2CCn3c(O)nnc3C2)c1[N+](=O)[O-] 358527005 GBNJYTWHPCJACH-UHFFFAOYSA-N 293.243 -0.421 5 20 CBBD C[C@H]1OCC[C@H]1N(CCO)c1ncc([N+](=O)[O-])c(N)n1 360256606 HBIOOIDXMIOULD-HTQZYQBOSA-N 283.288 -0.057 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 362357373 FKLIRLYUOQEISJ-CBAPKCEASA-N 297.267 -0.083 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)CC[C@@H]2C1 408046506 LMRNIGTYSXFLJA-SSDOTTSWSA-N 279.256 -0.235 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)NCCn1cc([N+](=O)[O-])cn1 514669983 JNLUXNKMVZCNIU-NXEZZACHSA-N 299.287 -0.496 5 20 CBBD CN1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1=O 562912680 VWZWIIVPGVADJG-UHFFFAOYSA-N 279.256 -0.633 5 20 CBBD C[C@H](N)[C@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 562978115 WVNOVWIAHJUKJF-YUMQZZPRSA-N 255.278 -0.109 5 20 CBBD NC(=O)CN1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 590587196 XHVKYTJSLBMMDR-UHFFFAOYSA-N 280.288 -0.821 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 592306048 AETYQTSJRNNJKM-XVKPBYJWSA-N 296.283 -0.116 5 20 CBBD O=C(O)[C@H]1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 833188899 JTBLLPQIBMAMPA-ONGXEEELSA-N 298.299 -0.051 5 20 CBBD CCS(=O)(=O)N1CCC(CNCC[N+](=O)[O-])CC1 905212639 LPPHDTQAKSPIEV-UHFFFAOYSA-N 279.362 -0.086 5 20 CBBD CC(C)(O)CC(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001809637 YJQZPQCOTVJRRL-NXEZZACHSA-N 299.327 -0.613 5 20 CBBD Cn1c(S)nnc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319702383 VTJOFLLPGVDDAG-UHFFFAOYSA-N 283.273 -0.335 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 1321590506 UBEOXCGVNNGXPY-ZCFIWIBFSA-N 267.245 -0.426 5 20 CBBD CNC(=O)C[S@](=O)CCn1cc([N+](=O)[O-])cn1 1321679007 AJPPKXFKKDMELQ-QGZVFWFLSA-N 260.275 -0.714 5 20 CBBD CN(CCS(C)(=O)=O)c1nnc(C[N+](=O)[O-])n1C 1346177066 LJERFCGXAVGBGK-UHFFFAOYSA-N 277.306 -0.927 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 1610735129 DYPKJBGOTXZVHZ-WCBMZHEXSA-N 284.272 -0.441 5 20 CBBD Cn1c(C(=O)NC[C@](C)(O)C(=O)O)ccc1[N+](=O)[O-] 90274770 SSUACEMUFRBCHW-JTQLQIEISA-N 271.229 -0.501 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@]1(O)CCO[C@H]1C 331320634 BVFRGUCBMIFABZ-QPUJVOFHSA-N 298.299 -0.244 5 20 CBBD C[C@H]1CN(C[C@@H](O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)O1 339303360 MBYDSYOLJDXSKZ-KXUCPTDWSA-N 285.304 -0.344 5 20 CBBD COC(=O)[C@](C)(O)CNc1ncc([N+](=O)[O-])cn1 361668028 UFPIMOXRSMFUQL-SECBINFHSA-N 256.218 -0.279 5 20 CBBD O=C(CNC(CO)CO)Nc1ccccc1[N+](=O)[O-] 583761377 PBNTWWORLNFTDB-UHFFFAOYSA-N 269.257 -0.524 5 20 CBBD NCCN(CCOc1cccc([N+](=O)[O-])c1)C[C@@H](O)CO 595901128 ARICZJFJUJWFAX-GFCCVEGCSA-N 299.327 -0.413 5 20 CBBD O=C(N[C@H]1CCCN(CCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 839781346 MYJFJLGAZUVRCW-HBNTYKKESA-N 271.317 -0.385 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1318294741 FAMCCERKTGSGNU-QMMMGPOBSA-N 294.267 -0.910 5 20 CBBD O=C(NCCN1C(=O)CCC1=O)c1c[nH]nc1[N+](=O)[O-] 1325304470 VQPDPGKEFVSRRM-UHFFFAOYSA-N 281.228 -0.803 5 20 CBBD C[C@@H]1CNCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1334337803 LKLQTMOIKKCTTR-MWLCHTKSSA-N 269.305 -0.554 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 1347018960 PCAZMHUQDIORMP-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNC(=O)CN 37629004 QSPWXDXZVZLNDB-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2CCO[C@H](C(=O)O)C2)n1C 235963562 GNMZHJKLWPRDRV-ZETCQYMHSA-N 270.245 -0.073 5 20 CBBD CC(C)[C@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 288103621 XAUPXIPKGIERAT-NSHDSACASA-N 283.288 -0.193 5 20 CBBD CN1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C(=O)N1 354498542 YSEDJDYYUNVVSE-ZETCQYMHSA-N 279.256 -0.748 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 356724156 BTQQPGCWJREYRA-HTQZYQBOSA-N 295.299 -0.027 5 20 CBBD CCC[C@@H]1CNCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 359218763 PBKVPARJDZFXRN-SECBINFHSA-N 282.304 -0.213 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 371055769 QQWXNEVGCCLJAA-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CCOC[C@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 433357383 XHKIRBLYCYNSNP-SNVBAGLBSA-N 286.288 -0.305 5 20 CBBD O=C(NC[C@H](O)[C@@H]1CCOC1)c1cnc(O)c([N+](=O)[O-])c1 445008149 PWPUSMRMQVVOFH-XCBNKYQSSA-N 297.267 -0.177 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@@H](C(N)=O)O1 531594757 HSZKKTNROREHIB-SCZZXKLOSA-N 296.283 -0.304 5 20 CBBD C[C@@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)N(C)C 579491771 MIAYKKZKOSVAGT-ZCFIWIBFSA-N 281.272 -0.222 5 20 CBBD COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 600406415 OJMIWVAKOLDCIT-UHFFFAOYSA-N 271.229 -0.158 5 20 CBBD O=C(NC(CO)CO)c1cc([N+](=O)[O-])c2nsnc2c1 755694991 SNQQEPVZERKEPK-UHFFFAOYSA-N 298.280 -0.318 5 20 CBBD C[C@H](COC(=O)Cc1nc2ncccn2n1)[N+](=O)[O-] 813108714 KZENEOVZRYNUKA-SSDOTTSWSA-N 265.229 -0.125 5 20 CBBD CON(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])o1 834849162 RLEVKIHHEOSYDU-UHFFFAOYSA-N 257.202 -0.063 5 20 CBBD Cn1nccc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157760328 BZVFNGCGTVZQQR-GHMZBOCLSA-N 281.316 -0.319 5 20 CBBD COCCS(=O)(=O)CCCn1ncc([N+](=O)[O-])c1N 1254294131 GVGMIZUWXSHVIG-UHFFFAOYSA-N 292.317 -0.175 5 20 CBBD COCCS(=O)(=O)CCCn1cnc([N+](=O)[O-])n1 1318213370 BBPNDRKWICIVCV-UHFFFAOYSA-N 278.290 -0.362 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1=CCCOC1 1324225130 JMBUQHSTQFYWKW-UHFFFAOYSA-N 267.245 -0.351 5 20 CBBD CC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCNCC1 1325825883 JRQOOOYNANALRR-UHFFFAOYSA-N 268.277 -0.555 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN2CCOC[C@@H]2C1 1339666222 LPBYVTVDUZYENQ-VIFPVBQESA-N 282.304 -0.887 5 20 CBBD O=C1CCC(=O)N1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1347177920 KOVAKBCBTRVPLZ-MRVPVSSYSA-N 268.229 -0.699 5 20 CBBD C[C@@](O)(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C(F)F 1589993415 VMSNUSIJNHVIHG-MRVPVSSYSA-N 289.202 -0.013 5 20 CBBD O=[N+]([O-])c1cn(CCc2cnn[nH]2)nc1-c1nn[nH]n1 1593486837 PZOQJJCFXDPPJZ-UHFFFAOYSA-N 276.220 -0.668 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1599923231 FRYLCTMTKRAONP-OSMVPFSASA-N 258.230 -0.648 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1n[nH]c(=O)[nH]1 156442359 BUYGXPUXHYIKEI-UHFFFAOYSA-N 292.255 -0.022 5 20 CBBD C[C@@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 159795078 JAEYZJXYWWOETL-SECBINFHSA-N 280.284 -0.423 5 20 CBBD CCC(=O)N1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 178330516 HMMUBZZHDUECIG-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD NCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 237950444 RGRWFGZPJPEGHB-UHFFFAOYSA-N 298.324 -0.101 5 20 CBBD COC[C@H](O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 338912015 IWTYOJDYIWEMJX-SNVBAGLBSA-N 297.267 -0.343 5 20 CBBD NC(=O)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1 344218166 LHVVXCSKVNVINL-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)NC(C)(C)C 344450964 AUTFTSRSYAXGMT-SSDOTTSWSA-N 298.303 -0.394 5 20 CBBD Nc1nc(N[C@H]2CC[S@](=O)C2)ncc1[N+](=O)[O-] 348745918 XFYAVAKXWFAHFC-IEMIWKFJSA-N 257.275 -0.100 5 20 CBBD COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])cnc1N 351726357 DHWHUXMQRMQVIG-SSDOTTSWSA-N 284.272 -0.301 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)Cn1cnc([N+](=O)[O-])n1 357904352 CNLZXFHMAFVZPE-VIFPVBQESA-N 298.303 -0.977 5 20 CBBD NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CNC(=O)C1 420616695 SSPJNMHADFAFSU-LURJTMIESA-N 264.241 -0.006 5 20 CBBD CCC[C@H](NC(=O)c1ccnc(NC)c1[N+](=O)[O-])C(N)=O 567060335 VWCSEWROMHWYGI-QMMMGPOBSA-N 295.299 0.415 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC(=O)N1 574100748 YYVXSFLYRJIRQF-LURJTMIESA-N 279.256 -0.468 5 20 CBBD CC(=O)NCCN(C)Cc1c([N+](=O)[O-])ncn1C 577846568 KBHJRYQUEGFWPT-UHFFFAOYSA-N 255.278 -0.104 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 588866123 AHXYJRDJERFGMX-SECBINFHSA-N 283.284 -0.047 5 20 CBBD NCCN(CCOc1ccc([N+](=O)[O-])cc1)C[C@H](O)CO 595902238 OHYUHPOGEWZOIY-LBPRGKRZSA-N 299.327 -0.413 5 20 CBBD O=C1CN(Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CCN1 794616108 IHQDDKUDOCYMOB-UHFFFAOYSA-N 292.251 -0.108 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)NCC(=O)O 827862149 VZRDUGOEMZWUAN-ZCFIWIBFSA-N 297.223 -0.264 5 20 CBBD Cn1nnc(C(=O)NCCNc2ccccc2[N+](=O)[O-])n1 1094043074 VVNWVPUOIZFLBK-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD C[S@@](=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1251903208 XEBMGVVQAQGMTH-QGZVFWFLSA-N 260.275 -0.714 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@H](S(N)(=O)=O)C1 1318420347 FQQZEHKLSIQQIN-LURJTMIESA-N 275.290 -0.805 5 20 CBBD CN(C[C@@H](O)CN)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 1328711729 HFWJZTLBZKMAAV-JTQLQIEISA-N 296.283 -0.689 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CCO1 50855927 FZWXNUCIRVPOQY-JTQLQIEISA-N 279.252 -0.079 5 20 CBBD Cn1ccnc1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 71273620 VAQNIMZTBRDWOV-SNVBAGLBSA-N 280.288 -0.325 5 20 CBBD COCCN(CCO)CCn1cc([N+](=O)[O-])ccc1=O 90525270 IKDDYOSCTAFGJU-UHFFFAOYSA-N 285.300 -0.303 5 20 CBBD O=C(O)COCCNC(=O)Cn1cc([N+](=O)[O-])cn1 93228024 NKAJDYWCMLXCOA-UHFFFAOYSA-N 272.217 -0.991 5 20 CBBD CC[C@@H](O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 124699734 CAURWXJAHKHDRF-NXEZZACHSA-N 258.278 -0.487 5 20 CBBD O=C(NCCN1CCOCC1)c1cc([N+](=O)[O-])n[nH]1 140290309 DXEZALRUJDBGOP-UHFFFAOYSA-N 269.261 -0.620 5 20 CBBD COc1cc(S(=O)(=O)NC2CNC2)ccc1[N+](=O)[O-] 237228903 OJMKBXQFULTKRW-UHFFFAOYSA-N 287.297 -0.147 5 20 CBBD C[C@@]1(O)CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 245880912 ICPORKCTRWXGMI-VXGBXAGGSA-N 284.316 -0.001 5 20 CBBD Cc1c(NC(=O)C(=O)NC[C@@H](O)CO)cccc1[N+](=O)[O-] 275723807 OTAZRSFNUCGIGM-MRVPVSSYSA-N 297.267 -0.689 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1(CO)CC1 285667056 ZKWFLLDQFRPBMZ-JTQLQIEISA-N 270.289 -0.391 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1O 295694963 XBWDFBSRESNAPE-UHFFFAOYSA-N 297.271 -0.256 5 20 CBBD COCCCNC(=O)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 343362324 ZDGOULBVLKOLRT-UHFFFAOYSA-N 299.287 -0.457 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 344007419 CSGQERHRDYEQNA-SNVBAGLBSA-N 272.261 -0.165 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[S@@]1=O 352258659 ZGIMARYTQFPCQY-FWCARGHBSA-N 271.302 -0.076 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 355071937 RJTBCQAGPWRWCH-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356463496 SGIPJAZEQDDQRW-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD Cc1c(CC(=O)N[C@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 450609887 LXUYZOSIEUSGGW-JTQLQIEISA-N 292.295 -0.093 5 20 CBBD O=C(NCCCN1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 548735447 VAUFFHFDBDGMRP-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD C[C@@H](O)CN(CCO)c1ccc([N+](=O)[O-])c(C(N)=O)c1 596236710 LPPPZGBDBASTQL-MRVPVSSYSA-N 283.284 -0.127 5 20 CBBD C[C@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)[C@@H](C)CO1 596428115 HELCUQLGQFQLPS-IUCAKERBSA-N 296.331 -0.090 5 20 CBBD O=C(O)CCCOC(=O)Cn1cnc([N+](=O)[O-])n1 738581695 XOVHBLZGJYNUHS-UHFFFAOYSA-N 258.190 -0.406 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1[C@H]2CC[C@H]1CN(CCCO)C2 1017543453 CMPGJGHAUGQWFJ-NNYUYHANSA-N 283.328 -0.291 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN2CCOC[C@H]2C1 1339666221 LPBYVTVDUZYENQ-SECBINFHSA-N 282.304 -0.887 5 20 CBBD CN1C[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 1525388181 SVSRKDOHOPEJGP-MRVPVSSYSA-N 282.256 -0.045 5 20 CBBD C[C@H](CN1CCCC1=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 55815322 MJOYACDNNLYXCC-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CC(C)(C)[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 173343310 KQGGEECLPNTXGR-NXEZZACHSA-N 299.331 -0.358 5 20 CBBD CN(C)CCCNC(=O)Cn1nccc1[N+](=O)[O-] 179798219 IPYLUUHPHCJNFM-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD COC[C@H](O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 230158131 LLQGATAJPXOIDY-GHMZBOCLSA-N 288.304 -0.861 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@]1(O)CCOC1 269932371 DBCMYOZZWMOINJ-NSHDSACASA-N 282.256 -0.348 5 20 CBBD CNC(=O)C(=O)NCc1cc([N+](=O)[O-])ccc1OC 283737933 ADRWTEHBGLANSB-UHFFFAOYSA-N 267.241 -0.034 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 298843199 IZAOEAPSQXIZSX-UHFFFAOYSA-N 270.245 -0.585 5 20 CBBD C[C@H]1CO[C@H](CO)CN1CCn1cc([N+](=O)[O-])cn1 305129917 MMWMSGRCCFTIIA-ONGXEEELSA-N 270.289 -0.127 5 20 CBBD CN1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 330865556 RLPCHRNMWXTNMB-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD COCCCNC(=O)CN(C)c1ncc([N+](=O)[O-])c(N)n1 338969645 ZUZDCMLHXKOUAQ-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD Nc1nc(N2CCC(OCCO)CC2)ncc1[N+](=O)[O-] 339697482 JULYPWXMMNHKIL-UHFFFAOYSA-N 283.288 -0.055 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)CC[C@H]2C1 346071337 PHILRNWLHIGIBC-VIFPVBQESA-N 293.283 -0.376 5 20 CBBD CCNC(=O)CN(CC)C(=O)c1cc([N+](=O)[O-])nn1C 356499168 STBUJDGOEHOHSL-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC(O)(C(F)F)C2)c1 424135930 NBLIGHJPODXQHL-MRVPVSSYSA-N 292.242 -0.536 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 545988160 KHROUQXRYMUPRE-IONNQARKSA-N 298.299 -0.304 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590575945 ZKACELHQKNCKIB-ZETCQYMHSA-N 267.245 -0.738 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCOC[C@H]2CO)n1 595716033 KMWSHCUVVSAZRQ-SECBINFHSA-N 256.262 -0.516 5 20 CBBD CNC(=O)[C@H](O)CNc1ncc(C(=O)OC)cc1[N+](=O)[O-] 758112048 ADFNMCVXPKIVJI-MRVPVSSYSA-N 298.255 -0.705 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)NC(N)=O 761052182 BMOVUECCWDUSBU-RXMQYKEDSA-N 284.228 -0.327 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 763695927 FFOXXJYSZBLUOT-MRVPVSSYSA-N 283.240 -0.863 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc([N+](=O)[O-])cnc2O)C1=O 776240154 BCKZTDJQZRVZBD-UHFFFAOYSA-N 295.211 -0.766 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccc([N+](=O)[O-])cc1O 816731808 GEQLHYIEUJBYEJ-UHFFFAOYSA-N 281.184 -0.313 5 20 CBBD O=C(NCC1CC2(C1)OCCO2)[C@@H]1C[C@H]1[N+](=O)[O-] 832176610 BJRZBIOGXSEWJL-RKDXNWHRSA-N 256.258 -0.079 5 20 CBBD O=C(NCC[C@@]1(O)CCCOC1)[C@@H]1C[C@H]1[N+](=O)[O-] 846597016 RBUZYEDLCKHZLB-KKZNHRDASA-N 258.274 -0.301 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)CCn1cc([N+](=O)[O-])cn1)C2 861871354 LFKYBIVMTYHDOV-DTWKUNHWSA-N 280.240 -0.292 5 20 CBBD C[C@@H]1COC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 928893089 KIZUOEDDEOCMOD-HTQZYQBOSA-N 254.246 -0.058 5 20 CBBD Cc1nnc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1022063952 QNBYDDWWJJLBMV-UTINFBMNSA-N 295.299 -0.220 5 20 CBBD CN[C@H](C)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1118260757 HXQKIWGPYLEXOE-SECBINFHSA-N 282.300 -0.129 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NS(=O)(=O)C(F)F 1319067241 DTBGFGKKWYQJLT-UHFFFAOYSA-N 284.200 -0.540 5 20 CBBD Cc1nn(C)c(C(=O)NCC(=O)NCC2CC2)c1[N+](=O)[O-] 1325005395 DOOJABBPGHXPCO-UHFFFAOYSA-N 295.299 -0.107 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCn2ncnc2C1 1325710240 MKXVCQALEWYVAW-UHFFFAOYSA-N 277.244 -0.424 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1342689707 BADGAGMGPADZQJ-SSDOTTSWSA-N 281.272 -0.369 5 20 CBBD O=C(CN1CCN(CC[N+](=O)[O-])CC1)NC1CC1 1351066282 XTDKXRNYOXAJON-UHFFFAOYSA-N 256.306 -0.841 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CN2CCC1CC2 1514747960 KXBVOQCTYIRAOC-SECBINFHSA-N 280.288 -0.603 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1599843517 IJPCQVIACWYLKQ-LHLIQPBNSA-N 298.251 -0.236 5 20 CBBD Nc1ccc(C(=O)N2CCNC(=O)C2)cc1[N+](=O)[O-] 17818397 MCOZODOASBLHSD-UHFFFAOYSA-N 264.241 -0.251 5 20 CBBD Cc1nnc(NC(=O)Cn2cnc([N+](=O)[O-])n2)s1 48941779 JWBFRQHOOKKGID-UHFFFAOYSA-N 269.246 -0.015 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1 50858788 VGNHYGHZTXCPLL-NSHDSACASA-N 293.279 -0.150 5 20 CBBD O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])c[nH]1 52603283 BQUBXJGRHRSHTQ-ZCFIWIBFSA-N 273.270 -0.160 5 20 CBBD Cn1c(C(=O)N2CCNC(=O)C2)ccc1[N+](=O)[O-] 59436751 AIDZITXNJKIGRE-UHFFFAOYSA-N 252.230 -0.495 5 20 CBBD CN1C(=O)C[C@H](Nc2c([N+](=O)[O-])ncn2C)C1=O 88779007 RVFYEORSOMPKIZ-YFKPBYRVSA-N 253.218 -0.503 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCOC[C@@]12CCOC2 194373030 CGUBBUIWOAAGJP-LBPRGKRZSA-N 296.283 -0.191 5 20 CBBD C[C@@H]1CNCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 262055706 XFZHQKXDUMTESF-SSDOTTSWSA-N 254.250 -0.993 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCN(CCO)CC1 285014951 DNMUVVJIKPWMLV-UHFFFAOYSA-N 269.261 -0.932 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CCOCCO)c1[N+](=O)[O-] 337600680 JEVBZDDGIWXBBP-UHFFFAOYSA-N 272.261 -0.293 5 20 CBBD NC(=O)N[C@@H](CO)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 352184697 UZERECOEAJJWSN-QMMMGPOBSA-N 286.219 -0.298 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)NC2CC2)c1 356488567 ZNCCSLOALKGIKP-UHFFFAOYSA-N 275.290 -0.622 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cccc([N+](=O)[O-])c2N)C1 358038637 BMJZJJNSRBVGFI-ZDUSSCGKSA-N 294.311 -0.027 5 20 CBBD CC(=O)N[C@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 491038613 RLWBUTXVCGVJSP-SSDOTTSWSA-N 269.261 -0.568 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 516171246 LNDWWYIWRFTBAL-SSDOTTSWSA-N 281.272 -0.159 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 549202011 RPMSERFAODEIBX-XPUUQOCRSA-N 281.272 -0.038 5 20 CBBD Cn1c(C(=O)NCCc2nc(N)n[nH]2)ccc1[N+](=O)[O-] 597668608 WLLPROTWQWEZBE-UHFFFAOYSA-N 279.260 -0.394 5 20 CBBD CCCc1[nH]nc(C(=O)NC2=NCC(=O)N2)c1[N+](=O)[O-] 609476721 ZUECUVHCJYOVBG-UHFFFAOYSA-N 280.244 -0.514 5 20 CBBD CNC(=O)CN(C)CCn1c([N+](=O)[O-])cnc1C 611821772 VLHOUDDKVQSAND-UHFFFAOYSA-N 255.278 -0.222 5 20 CBBD O=C(O)CS(=O)(=O)CCn1ccnc1[N+](=O)[O-] 702415429 VETQAQMJYPFMEI-UHFFFAOYSA-N 263.231 -0.709 5 20 CBBD O=C(O)Cc1nc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n[nH]1 739911097 VHGPYBRFCFMLOX-UHFFFAOYSA-N 295.215 -0.825 5 20 CBBD NC(=O)C1=NO[C@@H](CNc2ccc(N)c([N+](=O)[O-])n2)C1 853513202 XMWSHXQVUMECIV-RXMQYKEDSA-N 280.244 -0.386 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1C[C@H](F)CN1 1325825630 HSXHEGZRSFQZKR-BQBZGAKWSA-N 272.240 -0.998 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@H]2[C@@H]3CNC[C@@H]32)c1[N+](=O)[O-] 1342027011 KHCZOYVIDXIFDX-MBTKJCJQSA-N 279.300 -0.073 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1F 1346023694 NBYFKFHTCUWQOR-QMMMGPOBSA-N 271.204 -0.690 5 20 CBBD Cc1nc(CN(C)CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n[nH]1 1753853373 VYKBAXHVUCQPDU-NXEZZACHSA-N 296.331 -0.331 5 20 CBBD COC(=O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 35220817 ASORFXZZCIJWGE-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD CN(C)C(=O)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 44688553 GRKMYYULDDHPPR-SNVBAGLBSA-N 295.299 -0.130 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCO[C@@H]2CCC[C@@H]21 56193279 TVSRQBDYSAFDSU-DTWKUNHWSA-N 281.272 -0.034 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1cnc([N+](=O)[O-])c1 117550510 MESSMBCMRAQIRU-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD COc1c(F)cc(S(=O)(=O)NCCN)cc1[N+](=O)[O-] 193226109 GKWZRTJBTSXIMD-UHFFFAOYSA-N 293.276 -0.021 5 20 CBBD CC(C)CS(=O)(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 194593287 UNVXRXBOFLKUPX-UHFFFAOYSA-N 290.301 -0.107 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 264752870 LHKQJIPQWCMQEI-SECBINFHSA-N 295.299 -0.224 5 20 CBBD Cc1nn(C)c(NCCCN2CCNC(=O)C2)c1[N+](=O)[O-] 269964565 MUOCHRSYAPZRKA-UHFFFAOYSA-N 296.331 -0.129 5 20 CBBD NC(=O)C1=NO[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1 276262572 MYBBIWAUWCKMCG-SCSAIBSYSA-N 281.232 -0.991 5 20 CBBD NS(=O)(=O)CCOCCNc1ccc([N+](=O)[O-])cn1 288892527 HPSOCCCFUXDXCN-UHFFFAOYSA-N 290.301 -0.293 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@H]2COC[C@H]2O)c1[N+](=O)[O-] 342448817 UDRVJXSEXFSNKC-JGVFFNPUSA-N 284.272 -0.532 5 20 CBBD CCc1[nH]nc(C(=O)Nc2nnc(C)n2C)c1[N+](=O)[O-] 346093328 WBNFOMBGAGNLCS-UHFFFAOYSA-N 279.260 0.570 5 20 CBBD Cn1cc(CCNc2nccc(C(N)=O)c2[N+](=O)[O-])cn1 357329682 MIPVDWASBBVSIQ-UHFFFAOYSA-N 290.283 0.477 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC(O)(C3CC3)C2)c1 372689281 DACUBDPAYUXBPB-NSHDSACASA-N 282.300 -0.391 5 20 CBBD Cn1cc([C@H](CO)Nc2ccc(N)c([N+](=O)[O-])n2)cn1 596175076 KXPDQIARGWZZFX-VIFPVBQESA-N 278.272 0.451 5 20 CBBD Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(N)=O 597587605 ZNUJPUVHHZYJPB-SNVBAGLBSA-N 281.268 -0.212 5 20 CBBD Nc1nc(=NCCOC[C@@H]2CCOC2)[nH]cc1[N+](=O)[O-] 609463995 NITFTOWCDSNYPV-MRVPVSSYSA-N 283.288 -0.146 5 20 CBBD Cn1c(C(=O)O[C@H]2CCNC2=O)ccc1[N+](=O)[O-] 769968206 MWNZPJVVLMIISS-ZETCQYMHSA-N 253.214 -0.021 5 20 CBBD COC(=O)C(=O)CCCOC(=O)Cn1ccc([N+](=O)[O-])n1 803289845 VAHFJKRAVZGDJC-UHFFFAOYSA-N 299.239 -0.143 5 20 CBBD Cc1nc(CN2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)n[nH]1 839686422 XIQYXCJTXGTCTO-NXEZZACHSA-N 294.315 -0.577 5 20 CBBD COC(=O)[C@@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 843065196 KEFLGHSKCMDBLI-GHMZBOCLSA-N 284.268 -0.248 5 20 CBBD O=C(NC1CC2(CC(NCCO)C2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 963791910 VEISADDVXVAISQ-GYEOWSFSSA-N 283.328 -0.339 5 20 CBBD Nc1nc(N2CCC(O)(CO)CC2)ncc1[N+](=O)[O-] 1118600087 DGMVHVDRVUHZRR-UHFFFAOYSA-N 269.261 -0.709 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC(O)CC1 1318083204 RVRDSDRFVIWZGM-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@H]1CC(=O)O 1323454752 MZKWTYNQNCSGNH-SSDOTTSWSA-N 298.255 -0.356 5 20 CBBD O=C(NC[C@@H](O)C1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1344130043 VRSYWRUEKSGHSW-SECBINFHSA-N 284.272 -0.165 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]1(CN)CO 1579970489 XXEAJUQAEDTFBW-LBPRGKRZSA-N 298.299 -0.905 5 20 CBBD CONC(=O)CNc1nccc(C(=O)O)c1[N+](=O)[O-] 1599320728 PDKVQSKVSKVGOT-UHFFFAOYSA-N 270.201 -0.223 5 20 CBBD Cn1nnnc1CCNc1nccc(C(=O)O)c1[N+](=O)[O-] 1601046622 ORDUDVWDGYYBOJ-UHFFFAOYSA-N 293.243 -0.134 5 20 CBBD CN(CC(N)=O)C[C@H](O)COc1cccc([N+](=O)[O-])c1 51826259 ORTRCLIYYYVYPT-JTQLQIEISA-N 283.284 -0.248 5 20 CBBD NC(=O)c1ccc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 90281664 HQBRNWYVZHXCKI-SSDOTTSWSA-N 255.230 -0.541 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C(=O)NCC[C@H]1C 194332980 AQIUOFCYKKZQGE-RDDDGLTNSA-N 295.299 -0.259 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 194344386 GQUSTJAYZGUZSP-OIBJUYFYSA-N 281.272 -0.568 5 20 CBBD COCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 298970154 FXAGTXXMGCZKRA-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD CN(CCN1CCOCC1)C(=O)c1cc([N+](=O)[O-])n[nH]1 330568582 BWMCZBAYXGCFDB-UHFFFAOYSA-N 283.288 -0.278 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)CN)c([N+](=O)[O-])n1 347612283 QFYNNOHBNNCPGS-ZCFIWIBFSA-N 277.306 -0.563 5 20 CBBD CNC(=O)Cn1nc(Nc2c([N+](=O)[O-])ncn2C)cc1C 348112603 CNBZERNTYPKJEO-UHFFFAOYSA-N 293.287 0.323 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CNC[C@H]1O 420243206 CKBYXHZWJVMHNO-PSASIEDQSA-N 252.274 0.290 5 20 CBBD CC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 431646849 YZYIPCMCFNAXRI-RXMQYKEDSA-N 256.218 -0.079 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1 580961867 HCTOVVVYEJAWMY-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD CCN1C[C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 593826239 DTERLQUUIHSLRC-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN(CCCO)C2CC2)c1 610369664 RRMSYBXJWNOKLV-GFCCVEGCSA-N 284.316 -0.001 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1N 720820567 JKQCBOHPLFGUBW-QMMMGPOBSA-N 267.289 -0.013 5 20 CBBD CCc1[nH]nc(C(=O)N2CCCNC(=O)C2)c1[N+](=O)[O-] 731809698 BAJSESYVHASXBG-UHFFFAOYSA-N 281.272 -0.158 5 20 CBBD O=C1CN(CCn2cc([N+](=O)[O-])ccc2=O)CCCN1 761658462 CJCKVIOZMAWZFZ-UHFFFAOYSA-N 280.284 -0.422 5 20 CBBD O=[N+]([O-])c1cc(S(=O)(=O)NCCOCCO)cs1 768850758 XMIZGBAYLXMNJM-UHFFFAOYSA-N 296.326 -0.057 5 20 CBBD COCC1(S(=O)(=O)NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 842362917 QRJZXGISKSZBAX-RNFRBKRXSA-N 278.286 -0.723 5 20 CBBD Cn1nncc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031661975 PKURLPSZVWHVMM-GHMZBOCLSA-N 294.315 -0.972 5 20 CBBD NC(=O)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 1097162589 OPPWWAHEGRUQMA-OCAPTIKFSA-N 293.283 -0.076 5 20 CBBD CC[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@H]1O 1324550296 LSIKHEUEEZANOO-JOYOIKCWSA-N 295.295 -0.014 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NN1CCOC1=O 1331807688 PKTZBHVPFRNBPN-UHFFFAOYSA-N 255.190 -0.575 5 20 CBBD NC(=O)Cn1ccc(Nc2ncc([N+](=O)[O-])c(N)n2)n1 76270108 VSQAJDZOJPRERF-UHFFFAOYSA-N 278.232 -0.608 5 20 CBBD CC(C)[C@H](CO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 92394802 XTQCMHIDUSYWPG-MNOVXSKESA-N 272.305 -0.241 5 20 CBBD CC(C)N1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 114655833 JIYWIOBHHZNENO-SECBINFHSA-N 295.299 -0.083 5 20 CBBD NC(=O)CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 118866669 ODPYATZYLOEAAH-MRVPVSSYSA-N 265.273 -0.039 5 20 CBBD COC[C@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 262282690 UVBZWXFFCVOQDY-JTQLQIEISA-N 286.244 -0.603 5 20 CBBD CNC(=O)[C@@]1(C)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 281956871 KIGZIMVRFNPDBB-NSHDSACASA-N 280.288 -0.071 5 20 CBBD CN1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 330865557 RLPCHRNMWXTNMB-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD CO[C@]1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1 330883433 BIGYUDZHNOZZES-JTQLQIEISA-N 270.245 -0.147 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)CSc1ccc([N+](=O)[O-])cc1 341706720 QUWADZLFTUCGCP-SECBINFHSA-N 299.308 -0.351 5 20 CBBD CNC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1 347866565 AAFXJVMGIXLESC-UHFFFAOYSA-N 296.287 -0.575 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)[C@H]1CCOC1 351561695 XXDRRDBTFCFTCH-XVKPBYJWSA-N 296.283 -0.301 5 20 CBBD Cn1nnc(CNC(=O)COc2ccccc2[N+](=O)[O-])n1 362941301 NYGGXCQTOBYRKO-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD Cc1c(C(=O)N[C@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 540882045 DHWLXKZHUMPVFR-VIFPVBQESA-N 278.268 -0.022 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 548941711 FUWOGMJZFVKVJW-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD CN(C(=O)c1ccnc(N)c1[N+](=O)[O-])[C@@H]1CCNC1=O 571819313 VQLHYGMTDYLGPX-SSDOTTSWSA-N 279.256 -0.468 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@H](CC(N)=O)C2)c1[N+](=O)[O-] 588805594 NYOIQAVDBLPAGQ-ZETCQYMHSA-N 281.272 -0.036 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1CCC(O)(CO)CC1 596817876 UPZLXFLBXPIOSW-UHFFFAOYSA-N 296.283 -0.237 5 20 CBBD O=[N+]([O-])CCN(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 791053740 FVMUVZXCMYPBTJ-GHMZBOCLSA-N 292.357 -0.069 5 20 CBBD NC(=O)NCC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-] 1093501104 RORQCTLHCWLKGH-UHFFFAOYSA-N 299.262 -0.070 5 20 CBBD CCn1cc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1157775078 LBXXWEOZNPOROW-GHMZBOCLSA-N 296.331 -0.441 5 20 CBBD CN1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 1256346399 GMKOLIUCKZSOSU-LURJTMIESA-N 267.245 -0.332 5 20 CBBD Cc1nn(C)c(C(=O)NCc2nnn(C)n2)c1[N+](=O)[O-] 1322251628 HCMZBXRNWPDCTE-UHFFFAOYSA-N 280.248 -0.910 5 20 CBBD NC1(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCC1 1328521615 CYLXMAHQHDERQE-UHFFFAOYSA-N 280.284 -0.246 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)CC(N)=O 1344493711 TWINCDTZJGMRAZ-SSDOTTSWSA-N 283.288 -0.130 5 20 CBBD O=[N+]([O-])c1ncn(Cc2nc(N3CCNCC3)no2)n1 1345667875 APFXYSQITMIMIC-UHFFFAOYSA-N 280.248 -0.973 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC[S@](C)=O 110856139 LTKSUGNHRLMRGH-LJQANCHMSA-N 288.329 -0.015 5 20 CBBD CNS(=O)(=O)[C@@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 138263978 IHGNUBUKPBNOOY-MRVPVSSYSA-N 289.317 -0.628 5 20 CBBD CCNC(=O)NC(=O)Cn1cccc([N+](=O)[O-])c1=O 161687271 HVIGHPZIYBISAV-UHFFFAOYSA-N 268.229 -0.398 5 20 CBBD COC(=O)CN(C)CCn1cc([N+](=O)[O-])ccc1=O 179194355 UJCXDHODFXZDCE-UHFFFAOYSA-N 269.257 -0.139 5 20 CBBD N[C@H]1CC[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]12 185196944 YIWORVQUTBKBER-AEJSXWLSSA-N 279.300 -0.013 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1CCn1ccc([N+](=O)[O-])n1 186993274 DIPAVCPMDDDMTG-SECBINFHSA-N 267.289 -0.046 5 20 CBBD CO[C@@H](C)CS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 195425982 ZJLBDAAQKGLSNQ-QMMMGPOBSA-N 292.317 -0.254 5 20 CBBD COc1cc(C(=O)N2C[C@H](O)[C@@H](O)C2)ccc1[N+](=O)[O-] 234913637 ZLYCRRVZTGJZJT-UWVGGRQHSA-N 282.252 -0.219 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 261749689 HFJLUIORBSQOPV-QMMMGPOBSA-N 295.251 -0.310 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)CO 276191291 HJIFHSVFZUGHFW-MRVPVSSYSA-N 290.297 -0.237 5 20 CBBD O=C1NC(=O)N2CCN(c3ccc([N+](=O)[O-])cn3)C[C@@H]12 351902569 ZYOUQBQGCSPHAP-QMMMGPOBSA-N 277.240 -0.270 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352435600 QTDSDPVMCBFUGT-LURJTMIESA-N 253.218 -0.592 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 357459160 NNWFCQJXXVGDGY-SSDOTTSWSA-N 293.283 -0.244 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 360602307 WSDCUCKAZCDMID-QMMMGPOBSA-N 271.229 -0.423 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@]1(CO)CCOC1 393893106 SXJANBCVGXJKMK-NSHDSACASA-N 269.257 -0.186 5 20 CBBD O=C(N[C@@H]1CCCCNC1=O)c1c[nH]nc1[N+](=O)[O-] 549187056 FULTWLDOHFKZPQ-SSDOTTSWSA-N 267.245 -0.284 5 20 CBBD CO[C@@H]1COC[C@H]1NCCn1ccc([N+](=O)[O-])n1 576343068 GYQAHKNLBPSKFS-RKDXNWHRSA-N 256.262 -0.205 5 20 CBBD COC[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C(N)=O 760063657 YBZYNFLEXGSVGQ-JTQLQIEISA-N 297.267 -0.410 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)Cc1nc2ncccn2n1 814037703 DYSJLEWWQKFJIL-SSDOTTSWSA-N 265.229 -0.125 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc(N)c([N+](=O)[O-])n1 853535592 XBEFJOHARUZIAD-LURJTMIESA-N 255.234 -0.909 5 20 CBBD O=C(NOCCN1CCCC1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 856045250 PAGAZKDUUAIYBY-HTQZYQBOSA-N 257.246 -0.678 5 20 CBBD Cc1nn(C)c(C(=O)NCC(=O)NC(C)C)c1[N+](=O)[O-] 1317977043 ABESUFUADQYRFA-UHFFFAOYSA-N 283.288 -0.109 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2C(=O)OC[C@@H]2C1 1335442039 VLRMIYVASOFWFA-ZETCQYMHSA-N 267.245 -0.031 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]1(CN)CO 1579970487 XXEAJUQAEDTFBW-GFCCVEGCSA-N 298.299 -0.905 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCNC[C@H]1CO 1580449077 ARPAIJHXTDJWNV-VIFPVBQESA-N 280.284 -0.417 5 20 CBBD O=C(O)[C@@H](O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 90262651 HVNHTKZOLAOJHV-ZETCQYMHSA-N 290.253 -0.681 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H](CN)C1 122626970 GDJKYSXFBVFFFU-QMMMGPOBSA-N 267.289 -0.362 5 20 CBBD COc1c(C(=O)N2C[C@H](O)[C@@H](O)C2)cccc1[N+](=O)[O-] 234914781 IVRYSZVLPQJUHY-UWVGGRQHSA-N 282.252 -0.219 5 20 CBBD Cc1ccnc(N2CCN[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 265157643 CYTKVZBVFXKUHU-MRVPVSSYSA-N 265.273 -0.438 5 20 CBBD O=C1CN(CCNC(=O)c2ccc([N+](=O)[O-])o2)CCN1 272671827 JASBFWCGQSEKPT-UHFFFAOYSA-N 282.256 -0.651 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285488191 AEJOQEIXCWNXTD-LURJTMIESA-N 269.261 -0.228 5 20 CBBD Nc1c(C(=O)NCCn2ncnn2)cc(F)cc1[N+](=O)[O-] 338960610 MGYHBXNHIURMTF-UHFFFAOYSA-N 295.234 -0.267 5 20 CBBD NC(=O)c1cccc(N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 342937017 FWSOYAXKOHIASP-LURJTMIESA-N 264.241 -0.006 5 20 CBBD CNC(=O)N1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 346508880 QUINBIHRVMHDEG-UHFFFAOYSA-N 282.304 -0.215 5 20 CBBD CCn1cc(S(=O)(=O)NCC[C@@H](C)N)c([N+](=O)[O-])n1 353217284 LSOMSFULBUVWNR-SSDOTTSWSA-N 291.333 -0.173 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)OC 354733412 PVTDGBNJKYJZOQ-ZCFIWIBFSA-N 272.217 -0.764 5 20 CBBD Nc1nc(=NC[C@H]2CN3CCC[C@@H]3CO2)[nH]cc1[N+](=O)[O-] 363571470 NXJCXCVIQKJLHY-BDAKNGLRSA-N 294.315 -0.336 5 20 CBBD Cc1nn(C)c(N2C[C@@H](O)C[C@H](C(=O)O)C2)c1[N+](=O)[O-] 401777517 FIRLXTGQGOJMQX-YUMQZZPRSA-N 284.272 -0.091 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 436886496 SFBZSGNKZMDLDF-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[C@@H](O)CO 516569504 RHRVPWMIZOEPCZ-SSDOTTSWSA-N 281.224 -0.235 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cn1C 548138501 LCGJWZSQDSXNAT-LBPRGKRZSA-N 299.283 -0.023 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 555316937 FNOOAXBJTJLCHY-LLVKDONJSA-N 281.272 -0.084 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CNC(CO)CO 575400999 CMVRVHOVCGHXJJ-SNVBAGLBSA-N 286.284 -0.723 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCc2nn[nH]n2)n1 587975184 KKZQQWDWPCQSNZ-UHFFFAOYSA-N 279.216 -0.098 5 20 CBBD Nc1nccc(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 594336883 OKGBDADPWSNDLN-YFKPBYRVSA-N 265.229 -0.810 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCn1ncnn1 610924651 VJUCAFZASVTKHP-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc([N+](=O)[O-])c(C)n1 757693925 WEHNMDQWUZMUAN-QMMMGPOBSA-N 254.246 -0.183 5 20 CBBD CS(=O)(=O)N1CCCN(CC[N+](=O)[O-])CC1 791054302 SYNYHOFUUMQZIC-UHFFFAOYSA-N 251.308 -0.770 5 20 CBBD COc1ccc(C(=O)NCC(=O)OCCO)cc1[N+](=O)[O-] 913220007 AQWAHJLGYHANRB-UHFFFAOYSA-N 298.251 -0.131 5 20 CBBD Cc1ocnc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991282133 WSCTYNJVZXYINU-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD Cc1nn(C)c(C(=O)N2CCC[C@H]2C(N)=O)c1[N+](=O)[O-] 1118911981 ZEHYFHSWHAPNMA-ZETCQYMHSA-N 281.272 -0.273 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CCS(=O)(=O)C2)c1[N+](=O)[O-] 1318292031 ISZOUZDVMGOVNU-ZCFIWIBFSA-N 288.285 -0.457 5 20 CBBD COC(=O)NC1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1322758087 VPFKIEWRUVTVIE-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1326086804 FYGXZEATTGMKTO-APPZFPTMSA-N 283.288 -0.484 5 20 CBBD CN(Cc1ncon1)C(=O)Cn1ccc([N+](=O)[O-])n1 1337347053 XHPSTOKKKJVSHM-UHFFFAOYSA-N 266.217 -0.167 5 20 CBBD CNC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1345813792 XUJVWBBCKCDGEF-ZETCQYMHSA-N 253.262 -0.001 5 20 CBBD COC[C@@]1(C(=O)O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1593966743 ARENNWADTNSWGS-LLVKDONJSA-N 298.255 -0.119 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](O)C[C@H]1C(=O)O 1610559947 YTZUTXYQFCSWGK-SFYZADRCSA-N 298.255 -0.854 5 20 CBBD CCCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 7020451 FAWXSFHGOOIHFH-UHFFFAOYSA-N 296.283 -0.601 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCN(CCO)CC1 35609680 KSHZMPPSYILUAW-UHFFFAOYSA-N 268.273 -0.327 5 20 CBBD C[C@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)N(C)C 45107361 PQWHHYUQFNBSSM-KOLCDFICSA-N 271.321 -0.308 5 20 CBBD C[C@H](CO)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 86631471 SVJSQCXZWBDCHG-WPRPVWTQSA-N 258.278 -0.630 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)NC2CNC2)c1 90289347 WMWAMDFYOSKCQP-UHFFFAOYSA-N 257.271 -0.155 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C(N)=O 194677048 NVXHWKJUUSPGAQ-RXMQYKEDSA-N 255.234 -0.910 5 20 CBBD CN[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 261639758 DDUOWNHFPNGOIS-ZETCQYMHSA-N 255.278 -0.176 5 20 CBBD COC(=O)C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 270872440 JYWZPPJGIJZRCN-ZETCQYMHSA-N 298.255 -0.278 5 20 CBBD NC(=O)C1=NO[C@@H](CNc2ncc([N+](=O)[O-])cn2)C1 276295312 QNBIRTIQZYNWON-ZCFIWIBFSA-N 266.217 -0.573 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NCCS(N)(=O)=O 288153224 ONGBCCJELABJDN-UHFFFAOYSA-N 277.306 -0.180 5 20 CBBD O=C1CNC(=O)N1CCNc1ncccc1[N+](=O)[O-] 301299066 WRFDWFKVJIIBSU-UHFFFAOYSA-N 265.229 -0.047 5 20 CBBD CC(C)(C(=O)N1CCO[C@@H](CO)C1)n1cc([N+](=O)[O-])cn1 331155039 BJNCQCCELUVFOR-SNVBAGLBSA-N 298.299 -0.254 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O 351853794 MPSNWCXLUFCQAY-WCBMZHEXSA-N 281.268 -0.404 5 20 CBBD Cc1[nH]nc(C(=O)N(C)C[C@@H](O)CO)c1[N+](=O)[O-] 353976931 SGKAHFWYMVKLBP-ZCFIWIBFSA-N 258.234 -0.948 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 443798179 ANODBMIAKZPDBL-UHFFFAOYSA-N 256.218 -0.845 5 20 CBBD Nc1nccc(C(=O)N2CCOCCN2)c1[N+](=O)[O-] 597705578 HTXBQONZPRCMGR-UHFFFAOYSA-N 267.245 -0.451 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](N2CC[C@H](O)C2)C1 599940243 NDZACYUSOMZZIC-BDAKNGLRSA-N 295.299 -0.401 5 20 CBBD Nc1c(C(=O)NCCN2CC[C@@H](O)C2)cccc1[N+](=O)[O-] 600530264 BTZZFLKRGYHYIH-SECBINFHSA-N 294.311 -0.027 5 20 CBBD CNC(=O)[C@H](CO)Nc1nc2ccccn2c1[N+](=O)[O-] 763205806 FCWDOBFCVHVWMJ-ZETCQYMHSA-N 279.256 -0.239 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc(C)c([N+](=O)[O-])c1 763696903 MWVCGYNTZSBQMP-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C(=O)N1 801937665 SIAIIUKSGJGBAR-QMMMGPOBSA-N 297.246 -0.609 5 20 CBBD O=C(O)Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cn2)n[nH]1 833269970 INQGFJYCALKFCA-UHFFFAOYSA-N 292.211 -0.013 5 20 CBBD CC1(C)CNCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923291842 GTPKLVDVYUVUHN-NSHDSACASA-N 283.332 -0.164 5 20 CBBD Cn1ncc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1022064187 ZUMBMCCIYLPALD-JZSSXWJLSA-N 294.315 -0.783 5 20 CBBD NC(=O)NCC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093501038 OVGOFYHOIFHMCM-UHFFFAOYSA-N 282.260 -0.814 5 20 CBBD Cc1noc(CCCNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936827 SSZGIMYPOUJNDH-NXEZZACHSA-N 297.315 -0.318 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc[n+]([O-])c1 1319354149 AZLCNRPMIUFERN-UHFFFAOYSA-N 277.240 -0.145 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCC[C@H]1CCCN1 1325825587 FYXZICYDKHXZFZ-SECBINFHSA-N 282.304 -0.165 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)c1cc([N+](=O)[O-])n[nH]1 1341048173 DUNTXCZCILBKLW-UHFFFAOYSA-N 251.206 -0.292 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@H](C(=O)O)C1 1606242701 QNLHKGRZLHNTOR-SNVBAGLBSA-N 297.315 -0.261 5 20 CBBD Cn1cc(CN2CC[C@@](O)(C(=O)O)C2)c([N+](=O)[O-])n1 1608113551 VEJOIGXCVJIVPG-JTQLQIEISA-N 270.245 -0.650 5 20 CBBD COC(=O)CNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 37326186 AVPINJYPEZBQFA-UHFFFAOYSA-N 290.253 -0.248 5 20 CBBD Cn1c(Cn2cc([N+](=O)[O-])cn2)cc(=O)n(C)c1=O 74061806 BHEXGOXLTCJDIW-UHFFFAOYSA-N 265.229 -0.763 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(=O)O 90261268 FINZXHWFEKGGCC-QMMMGPOBSA-N 284.224 -0.221 5 20 CBBD CNC(=O)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 184051044 PRZWHXBRFQVGGD-SNVBAGLBSA-N 283.288 -0.762 5 20 CBBD CN(C[C@H](O)CO)C(=O)CN(C)c1ccccc1[N+](=O)[O-] 273695898 HUVUHOYHRKHZGF-JTQLQIEISA-N 297.311 -0.157 5 20 CBBD O=C(O)[C@@H]1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)O1 276183025 SNZBELCYHVOEQZ-BDAKNGLRSA-N 298.255 -0.460 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 279644132 ZHNFUMOJWKSUEK-JVXZTZIISA-N 297.267 -0.035 5 20 CBBD COCCCONC(=O)Cn1cc([N+](=O)[O-])cn1 287898342 SAYYHBDIJPUIEP-UHFFFAOYSA-N 258.234 -0.124 5 20 CBBD CC(=O)NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 330830034 QGNCSILJEJPAHL-SNVBAGLBSA-N 296.283 -0.100 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 352981416 AKGGFCCDPLWMEE-ZETCQYMHSA-N 287.659 -0.176 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CCCCNC1=O 360600309 JFVALXGYEPLALF-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD Cn1cnc(CCNc2ncc([N+](=O)[O-])cc2C(N)=O)n1 436367148 QUHDOVVFWSWAPN-UHFFFAOYSA-N 291.271 -0.128 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 555319001 WYMFMEYXKWKPOA-VDTYLAMSSA-N 267.245 -0.428 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@H]1O 824999985 LYXYBFKZBCJCDO-HZGVNTEJSA-N 291.271 -0.013 5 20 CBBD Cn1cnn(CC(=O)OCC(C)(C)[N+](=O)[O-])c1=O 851127771 VTPFICIUMQWNHI-UHFFFAOYSA-N 258.234 -0.820 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCC1CCNCC1 1327469779 ZHAJXUBWJXPDLS-UHFFFAOYSA-N 282.304 -0.308 5 20 CBBD CS(=O)(=O)CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591675334 OYEIIHZGMCVYJG-UHFFFAOYSA-N 287.261 -0.984 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NCCOCC(=O)O)n1 1605925176 BDPIVTBAEGCFQZ-UHFFFAOYSA-N 286.244 -0.358 5 20 CBBD COCC[C@@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)O 1606859492 PGTUVIPCJFHZGS-ZCFIWIBFSA-N 286.244 -0.154 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCS(=O)(=O)CC2)n1 176227944 WUIGLOBZKONUJA-UHFFFAOYSA-N 274.302 -0.478 5 20 CBBD CC1(O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 177333277 RNDHWNXGSZMSRR-LLVKDONJSA-N 284.316 -0.001 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@@H](OCCO)C1 188097126 HGQCZSRRKWTBCY-MRVPVSSYSA-N 284.272 -0.069 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 228790038 KJWFJWCMWFGLJX-LBPRGKRZSA-N 298.299 -0.262 5 20 CBBD NC(=O)COCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 230210436 DXWFSMYZFCQQDQ-UHFFFAOYSA-N 282.256 -0.591 5 20 CBBD COCCN(CCN(C)C)C(=O)Cn1cc([N+](=O)[O-])cn1 264103246 AYATWQRPPMLMRE-UHFFFAOYSA-N 299.331 -0.172 5 20 CBBD CC[C@@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 267270699 MJIZKDNTMPUPQJ-ZCFIWIBFSA-N 266.261 -0.318 5 20 CBBD CN(C[C@H](O)CO)C(=O)Cc1ccccc1[N+](=O)[O-] 271240148 DPJYRLMWHJSWPX-JTQLQIEISA-N 268.269 -0.051 5 20 CBBD CCc1[nH]nc(C(=O)N(CC)CC(N)=O)c1[N+](=O)[O-] 277911050 HTZBFECWHLNUFB-UHFFFAOYSA-N 269.261 -0.172 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1COC[C@H]1O 296970197 OPVTWLFKAUSJGY-GHMZBOCLSA-N 282.252 -0.151 5 20 CBBD CC(C)OC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 312672588 WNNZBFIDTXKLTA-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD Cc1ccn(CCS(=O)(=O)N(C)C)c(=O)c1[N+](=O)[O-] 349231531 FTFVKVGYYNPJRA-UHFFFAOYSA-N 289.313 -0.044 5 20 CBBD NC(=O)[C@H]1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CCO1 352939662 AWMUWVLAJSNQMD-SECBINFHSA-N 295.255 -0.870 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(N)=O 352996117 ZZNKBFSDHFOTLH-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD NC(=O)CC1(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCC1 353922861 DUZWURZYCBQRQG-UHFFFAOYSA-N 267.245 -0.154 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1C(=O)CCC1=O 356402959 FRYSYKQOCIDTQM-UHFFFAOYSA-N 295.255 -0.944 5 20 CBBD COCCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357098421 BEYAFOAINXXUHR-UHFFFAOYSA-N 254.246 0.537 5 20 CBBD CN(C)C(=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 357206832 XTFIPIZENLSEAW-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD CC(=O)NCCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357308314 WCHGFEBYUCWLGA-UHFFFAOYSA-N 281.272 0.027 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 360602655 XNVZVOOVTCSTFD-MRVPVSSYSA-N 297.267 -0.169 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])cnc2N)n1 398166793 JSAOSWIYMPBUMA-UHFFFAOYSA-N 278.232 -0.975 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OC[C@@H]1CNC(=O)O1 495582914 DIVPLNRJRHSMNQ-ZETCQYMHSA-N 284.228 -0.249 5 20 CBBD CC1(C(N)=O)CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 568387574 IQYAFJHGZKZGFP-UHFFFAOYSA-N 279.256 -0.600 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@@H](C)N)c([N+](=O)[O-])n1 592383345 OQTSXXSGBRFAIT-ZCFIWIBFSA-N 277.306 -0.563 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@@H]1COCCN1 599614948 WPIQFYQSCJRZIB-MRVPVSSYSA-N 281.272 -0.478 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 619566068 ZOBUGXGPJLRZCA-RXMQYKEDSA-N 259.243 -0.768 5 20 CBBD CCc1[nH]nc(C(=O)OCc2nnnn2C)c1[N+](=O)[O-] 795614065 CZZLDRNHJILAQK-UHFFFAOYSA-N 281.232 -0.239 5 20 CBBD Cn1c(Cn2ccc(=O)c([N+](=O)[O-])c2)cc(=O)n(C)c1=O 1116174700 PWSHGYZXWOHMLC-UHFFFAOYSA-N 292.251 -0.798 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1C[C@@H](CO)[C@H](CO)C1 1118909912 CGALAASNFRWQET-YUMQZZPRSA-N 297.267 -0.632 5 20 CBBD CCOCC(=O)NCCCNCc1c([N+](=O)[O-])ncn1C 1154341117 KPPNBQKDPMMADM-UHFFFAOYSA-N 299.331 -0.039 5 20 CBBD CCS(=O)(=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1319139848 PVRGPARXWYCLAS-QMMMGPOBSA-N 263.275 -0.413 5 20 CBBD COC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 1321475407 ZOTWFFULTIIBCB-MRVPVSSYSA-N 272.261 -0.777 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(N)=O 10518388 XGEXXTIMWDQJTL-ZCFIWIBFSA-N 273.270 -0.253 5 20 CBBD Cc1cccc(C(=O)NCCS(N)(=O)=O)c1[N+](=O)[O-] 40218730 ZSYIVPNFSKNTMM-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD C[C@@](O)(CNC(=O)COc1cccc([N+](=O)[O-])c1)C(=O)O 90275984 RMDTVWFAOIGMRQ-GFCCVEGCSA-N 298.251 -0.075 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCN3CCC[C@@H]3C2)c1 173365759 CCJMQDKFHNTXMF-YPMHNXCESA-N 295.343 -0.068 5 20 CBBD O=C(O)CNC(=O)CNc1ncc([N+](=O)[O-])s1 226760128 FEOPZLHXXLCYSF-UHFFFAOYSA-N 260.231 -0.336 5 20 CBBD C[C@@H](O)CCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 227714604 KPFXGQNETSELRW-KOLCDFICSA-N 272.305 -0.097 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1 230682117 USNLNBIMRVZSHO-UHFFFAOYSA-N 265.229 -0.856 5 20 CBBD NC(=O)NC(=O)CCNC(=O)Cc1cccc([N+](=O)[O-])c1 267832085 JYPBEZAJZJFSPM-UHFFFAOYSA-N 294.267 -0.162 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNc2ncc([N+](=O)[O-])cn2)O1 302241169 XUQRBQGBHJZFHL-YUMQZZPRSA-N 267.245 -0.170 5 20 CBBD CCN(CCO)CCNC(=O)c1cc([N+](=O)[O-])nn1C 360850810 CXKGTJQVIRICEA-UHFFFAOYSA-N 285.304 -0.628 5 20 CBBD CO[C@@]1(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])CCOC1 563391128 JIFZILSNIBHIFW-GFCCVEGCSA-N 296.283 0.107 5 20 CBBD CNc1nccc(C(=O)NC[C@H](C)C(=O)OC)c1[N+](=O)[O-] 566982075 BSMZWVDSQNAZRE-ZETCQYMHSA-N 296.283 0.570 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CNCCN1C 574392021 JTZDWDYEYGEGKC-SNVBAGLBSA-N 296.331 -0.880 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](C)[C@H](O)C2)c1[N+](=O)[O-] 594335937 YUMFRHCMFRPIRS-IONNQARKSA-N 280.284 0.484 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1CO 598909279 IAMBZHZQHGRLJS-RKDXNWHRSA-N 283.288 -0.337 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 600378599 YNBAJLDOODJDME-LURJTMIESA-N 253.218 -0.592 5 20 CBBD Cc1cc(C(=O)N(C)C[C@H](O)CO)c(N)c([N+](=O)[O-])c1 760014127 KUBYEDSVMQFDAC-QMMMGPOBSA-N 283.284 -0.089 5 20 CBBD C[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnnn1C 787650765 RBTOAIQVRJYXAT-LURJTMIESA-N 281.232 -0.381 5 20 CBBD C[C@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820481675 XRALBQKAEYWHHK-YFKPBYRVSA-N 265.233 -0.037 5 20 CBBD CC[C@@H]1COCCN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 874710554 KFRRAFYVOUCSAW-GMTAPVOTSA-N 271.317 -0.121 5 20 CBBD Cc1nnc(Sc2ncc([N+](=O)[O-])cc2C(N)=O)n1N 914862713 PAEOTRWGONPFTL-UHFFFAOYSA-N 295.284 -0.146 5 20 CBBD COCCCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093497241 AKFVLLWYYOMQKO-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)CCn1ccnn1 1321434788 FWTWGOVXDWLINB-UHFFFAOYSA-N 265.233 -0.051 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1344097405 FAKMPLURQBUNCX-HQJQHLMTSA-N 284.272 -0.402 5 20 CBBD O=C(O)[C@@H]1OCC[C@@H]1NCCn1cc([N+](=O)[O-])ccc1=O 1608815161 YLSGOQGGQVVVBQ-GXSJLCMTSA-N 297.267 -0.412 5 20 CBBD CNC(=O)CNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 37207058 CEYYFPZIWNJYNT-UHFFFAOYSA-N 289.269 -0.675 5 20 CBBD CC(=O)N1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 43285508 ACKSEJBBWQOTOK-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD NC(=O)[C@@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCO1 50956127 ILZTXQBQLKIRAK-LURJTMIESA-N 297.296 -0.006 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCc1nc[nH]n1 80572943 XAYGJKWXPMLWBQ-UHFFFAOYSA-N 279.260 -0.342 5 20 CBBD Cn1c(C(=O)N2CCOC[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 88373457 KHBIXYXXADPRFV-MRVPVSSYSA-N 283.240 -0.141 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](C)O 274520399 SDFACWXUOQKARI-LHLIQPBNSA-N 297.267 -0.171 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2COC[C@H]2O)n1 342403404 FNWNBPUWESCTPX-DTWKUNHWSA-N 284.272 -0.357 5 20 CBBD O=C(N[C@]1(CO)CCOC1)c1cc([N+](=O)[O-])n[nH]1 354767611 FPRGQLIBRBYXLP-VIFPVBQESA-N 256.218 -0.801 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)O1 355843585 GYNWJYQUCJJERV-HTRCEHHLSA-N 298.255 -0.280 5 20 CBBD COC(=O)C[C@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 366291423 LMZMDXBMBQQGOQ-ZETCQYMHSA-N 298.255 -0.278 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)CC(=O)N1CCNCC1 430630866 STAISGNTACHYOC-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD Cc1cc(C(=O)NOCC(N)=O)c(N)c([N+](=O)[O-])c1 772940845 WUGBXVOBONFXCZ-UHFFFAOYSA-N 268.229 -0.368 5 20 CBBD CC(C)N1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 839631845 MZMXGZOIKJIUML-DJLDLDEBSA-N 255.274 -0.223 5 20 CBBD COC(=O)[C@@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 843089055 QOKPGNXMWDEXKA-MNOVXSKESA-N 284.268 -0.248 5 20 CBBD Cn1nccc1[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 887588793 SLAFJMFKMVHMDQ-FBIMIBRVSA-N 280.284 -0.015 5 20 CBBD NC(=O)[C@@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 1326236790 NZUHRFVQWGAZKI-ZJUUUORDSA-N 269.257 -0.936 5 20 CBBD NC(=O)c1ccnc(N2C[C@H]3C[C@]3(CO)C2)c1[N+](=O)[O-] 1327601134 LLYPHKBZSKGMQL-JMCQJSRRSA-N 278.268 -0.093 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 1331169680 UBBUAANAQNHLOX-MRVPVSSYSA-N 271.233 -0.982 5 20 CBBD C[C@H]1OCC[C@@]12CN(c1nnc(C[N+](=O)[O-])n1C)CCO2 1339667301 SUPKLNRYPAWFBC-BXKDBHETSA-N 297.315 -0.024 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H](COC)C(=O)O)c1[N+](=O)[O-] 1597399265 BQRQKQYDEZWVQY-ZCFIWIBFSA-N 286.244 -0.290 5 20 CBBD CN1CC[C@@H](Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)C1=O 1598584383 XSXVYOIHNWOJLX-ZETCQYMHSA-N 295.251 -0.067 5 20 CBBD O=C(Cn1cn[nH]c1=O)NCc1ccccc1[N+](=O)[O-] 122001023 ZMJCPCHWXDJJQZ-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCCNC1=O 183455915 OHHMXTHXEDJQHI-SECBINFHSA-N 293.283 -0.030 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C(=O)O 237418660 WLAFJLIYFNZTDY-YFKPBYRVSA-N 256.218 -0.311 5 20 CBBD CC[C@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 267270697 MJIZKDNTMPUPQJ-LURJTMIESA-N 266.261 -0.318 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])[nH]n2)C1=O 286278791 CGSKKDITLYVBAB-SSDOTTSWSA-N 267.245 -0.379 5 20 CBBD CN(C)C1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCC1 331517721 QOTAZQMJHNFPJS-UHFFFAOYSA-N 282.304 -0.213 5 20 CBBD O=C1CN(CC(=O)Nc2cc([N+](=O)[O-])ccc2O)C(=O)N1 340548666 DJZANVVWTABGDT-UHFFFAOYSA-N 294.223 -0.209 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1COC[C@H]1O 342315170 KXDCWBVZGSGUJL-DTWKUNHWSA-N 284.272 -0.682 5 20 CBBD COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 343960455 VRZAWHHYOBYVPQ-SSDOTTSWSA-N 284.272 -0.301 5 20 CBBD COC[C@@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)OC 351791722 ZMIWUCYHSWHILG-ZCFIWIBFSA-N 286.244 -0.456 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)Cn2nccc2[N+](=O)[O-])C1 361443677 URYAJSXEJRFDPN-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD NC(=O)C1(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1 361983244 NEHDOCLJVKYOSR-UHFFFAOYSA-N 266.213 -0.557 5 20 CBBD CN1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 408063581 VWWVUAUJQPKGHY-UHFFFAOYSA-N 268.277 -0.650 5 20 CBBD Cn1ccc(NCCNC(=O)c2ccc([N+](=O)[O-])n2C)n1 552079876 NWLJVINHXGNOLX-UHFFFAOYSA-N 292.299 0.509 5 20 CBBD NS(=O)(=O)c1ccc(NCCO)cc1[N+](=O)[O-] 596051950 UJBGHCVXMBLBGD-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 728024530 XFCKQSULAJNBTL-UHFFFAOYSA-N 290.301 -0.706 5 20 CBBD NC(=O)C1(C(=O)OCCn2cc([N+](=O)[O-])cn2)CCC1 769095169 DZKMPPSHVHZISS-UHFFFAOYSA-N 282.256 -0.010 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc(N)cc1[N+](=O)[O-] 808047168 HDWIMIDLMAGILD-SECBINFHSA-N 254.246 -0.304 5 20 CBBD C[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 813298034 RHSXEGLXKWZUOP-SNVBAGLBSA-N 268.229 -0.387 5 20 CBBD Cn1ncc(Cn2cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c2)n1 1117629373 NPGBKDUAMKNPBQ-UHFFFAOYSA-N 280.200 -0.159 5 20 CBBD CC(=O)NCCCNC(=O)c1c([N+](=O)[O-])cnn1C 1319889117 KUJMQTXJFMQIQR-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD CS(=O)(=O)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1321087529 JCSKHJZKCWFWCO-UHFFFAOYSA-N 288.285 -0.375 5 20 CBBD Cc1noc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 1322509885 IZWFKOCUEIIMMH-UHFFFAOYSA-N 266.217 -0.201 5 20 CBBD C[C@H]1C[C@H](N)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1326702506 MCGZHRHPFDFFFQ-JGVFFNPUSA-N 268.277 -0.476 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C(=O)O)C2)n1 1333525392 YUJZQGUOOXOICG-IZLXSQMJSA-N 268.229 -0.079 5 20 CBBD NC(=O)c1ccnc(N2CCOC[C@H]2CCO)c1[N+](=O)[O-] 1343058861 VLZMJPWBRVXLFA-MRVPVSSYSA-N 296.283 -0.324 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1601770884 ZXYIKEVCHCWFNA-RITPCOANSA-N 284.228 -0.775 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1C[C@H]1C(=O)O 1607967396 GFUOLBYDPKJHKD-HTQZYQBOSA-N 282.256 -0.063 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 1608676141 WCZABKMPRTVJKK-ZETCQYMHSA-N 284.224 -0.134 5 20 CBBD CN(C)CC(=O)N1CCN(c2c([N+](=O)[O-])ncn2C)CC1 46478831 KHVWFGBJKHLNNU-UHFFFAOYSA-N 296.331 -0.462 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H](O)CN1 50015953 IJQDMLSHAVVODG-ZJUUUORDSA-N 265.269 -0.066 5 20 CBBD COC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 167363099 SDVANSIJTYQBBV-SSDOTTSWSA-N 272.217 -0.993 5 20 CBBD C[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](CO)O1 190123192 RFKFYFQKOKKIBQ-CMPLNLGQSA-N 297.311 -0.162 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C)CN1 237443429 HJLYDTPTBZYAMO-HTQZYQBOSA-N 268.277 -0.605 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC(=O)N(C2CC2)C1 279079735 AIYZIWAMNGVUJA-UHFFFAOYSA-N 293.283 -0.028 5 20 CBBD Nc1nc(NCCCc2nc(=O)[nH][nH]2)ncc1[N+](=O)[O-] 301453315 VENZCOWUZWUTQR-UHFFFAOYSA-N 280.248 -0.577 5 20 CBBD CCCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 346917970 HUNCUHLIQQCIJX-UHFFFAOYSA-N 269.261 -0.485 5 20 CBBD Nc1nc(N2CCC[C@@H]3C(=O)NC[C@@H]32)ncc1[N+](=O)[O-] 358687191 TWTVHGDPXLLZBT-BQBZGAKWSA-N 278.272 -0.318 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 445157335 IDIKKIMTLUDTEE-LLVKDONJSA-N 299.239 -0.651 5 20 CBBD Nc1nccc(C(=O)NC[C@@H](O)C2CC2)c1[N+](=O)[O-] 548712908 LNNXLNPFJCFMOY-MRVPVSSYSA-N 266.257 0.073 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)C1 593382213 SNZDEEQMDNDLCW-OCAPTIKFSA-N 296.287 -0.646 5 20 CBBD CCN(CC(=O)O)S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600655082 IAMRMANYIMYMCN-UHFFFAOYSA-N 292.273 -0.577 5 20 CBBD COC(=O)[C@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 843065202 KEPWPBNNIROSSD-QWRGUYRKSA-N 284.268 -0.248 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)C(F)F)C1 967950630 VJUJVUUAEQKDLG-HTQZYQBOSA-N 291.254 -0.024 5 20 CBBD CC(=O)NCC(=O)NCCNc1ncc([N+](=O)[O-])cc1F 1093455441 JDTDTNWSTWMUHR-UHFFFAOYSA-N 299.262 -0.207 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1319755873 JHTBWRNFKYNWQE-RXMQYKEDSA-N 256.218 -0.380 5 20 CBBD CN1C[C@H](Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)OC1=O 1330310529 KKFSSEJPUBPNHX-SSDOTTSWSA-N 296.239 -0.694 5 20 CBBD C[S@](=O)c1nncn1CCn1cc([N+](=O)[O-])cn1 1334391448 YFTMHJLIHHVTLA-SFHVURJKSA-N 270.274 -0.180 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NCCNS(C)(=O)=O 1515204535 JOOWKAZBCSQZAW-UHFFFAOYSA-N 274.302 -0.319 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1604064088 KPURLKYYJFOFRN-HTQZYQBOSA-N 259.262 -0.874 5 20 CBBD C[C@@](CO)(NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1604193363 LYJCIMIFCGQMNO-JTQLQIEISA-N 269.213 -0.445 5 20 CBBD COCC(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 176210499 VTEWXRWRILFKPN-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD CC(=O)OCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 216689062 WNEJNMXBNRAGDE-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD COCC[C@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 231683916 YYGYTRBDPNOYKT-NSHDSACASA-N 286.288 -0.305 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H](O)C(F)(F)F)c1 236537452 NMUANVMADOYGAB-HTQZYQBOSA-N 298.221 -0.335 5 20 CBBD C[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1CN 237702758 QLCQBBMJVAMBQO-DTWKUNHWSA-N 282.304 -0.228 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](CO)O1 249504324 YBLLSBAKEAUGCJ-ZJUUUORDSA-N 270.289 -0.127 5 20 CBBD CCN(C)C(=O)CNc1ncc([N+](=O)[O-])c(N)n1 274804133 WAXKUGXEGNPUIR-UHFFFAOYSA-N 254.250 -0.143 5 20 CBBD COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)OC 298835508 CFYIXWRRUIJGHS-ZETCQYMHSA-N 299.239 -0.243 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](C)[C@@H](O)C1 351871534 UEDKOSSOFNCSRO-APPZFPTMSA-N 268.273 -0.061 5 20 CBBD CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCNC1 429108907 IVWIKAHBADYSEA-VIFPVBQESA-N 282.304 -0.213 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)[C@H](C)C2)c1[N+](=O)[O-] 594335938 YUMFRHCMFRPIRS-VXNVDRBHSA-N 280.284 0.484 5 20 CBBD O=C(NCC1(CO)COC1)c1ccc([N+](=O)[O-])o1 717580900 QJBLCXSTGLTHNO-UHFFFAOYSA-N 256.214 -0.074 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(n2cncn2)C1 729247326 BSWCQQROLFXRAH-UHFFFAOYSA-N 277.244 -0.534 5 20 CBBD Cn1ncc(C(=O)OCCn2ccc([N+](=O)[O-])n2)c1N 754534180 LMEKIDOOZWTEBG-UHFFFAOYSA-N 280.244 -0.036 5 20 CBBD CC(C)[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 766965030 CFPIBDQJPWEMSG-QMMMGPOBSA-N 270.245 -0.005 5 20 CBBD NC(=O)CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 921269756 KLHJIOQEZMPHIO-UHFFFAOYSA-N 271.204 -0.286 5 20 CBBD CN(CCNC(=O)CC(N)=O)c1ccnc(O)c1[N+](=O)[O-] 1099970811 KVGONXNLFJQMKZ-UHFFFAOYSA-N 297.271 -0.877 5 20 CBBD C[C@H](CS(C)(=O)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 1116057913 PXAMDFSCVLFHJU-SSDOTTSWSA-N 290.301 -0.659 5 20 CBBD COC(=O)Cn1cc(CCn2cnc([N+](=O)[O-])n2)nn1 1319426845 KVWCJRJXHWVEIU-UHFFFAOYSA-N 281.232 -0.807 5 20 CBBD Cn1nncc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 1329597894 PIYQIITZPMYKJZ-UHFFFAOYSA-N 265.233 -0.764 5 20 CBBD COc1ccc(C(=O)CNC(=O)CN)cc1[N+](=O)[O-] 1574023769 NXXWZMALIYCWGW-UHFFFAOYSA-N 267.241 -0.139 5 20 CBBD Cn1c(C(=O)N2CCCNC[C@H]2C(=O)O)ccc1[N+](=O)[O-] 1600897876 CBHYKPSCTZNDQM-VIFPVBQESA-N 296.283 -0.178 5 20 CBBD Cn1nccc1CNC/C=C\CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1754118752 CZIGZCOLAMKIKA-JDEDCZITSA-N 293.327 -0.153 5 20 CBBD COCCCNC(=O)CN(C)Cn1nccc1[N+](=O)[O-] 49281408 XSYGJWMOMDSQGV-UHFFFAOYSA-N 285.304 -0.167 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCO[C@H](C(N)=O)C1 78571694 RGBOCZGDTIDQMX-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD COC[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 172621339 LAPZDTACOPRGLD-JTQLQIEISA-N 284.272 -0.335 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@H]1CO 270406248 MCHSUAYHUBMYNH-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD Cc1nc(N[C@H]2CC(=O)N(C)C2=O)ncc1[N+](=O)[O-] 296918412 AMRJDFBUOLEVLQ-LURJTMIESA-N 265.229 -0.138 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337799515 YCKBVGDQJPQOGK-RCOVLWMOSA-N 281.272 -0.417 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1COC[C@@H]1O 342411299 BUZXQWJJYRYMCO-ZJUUUORDSA-N 298.299 -0.292 5 20 CBBD C[C@@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C[C@H](CO)O1 347554011 MRAFIJJYZGGHGY-VXNVDRBHSA-N 297.267 -0.083 5 20 CBBD CN(C)c1noc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 354921045 YJOWGSJWOXVOIU-UHFFFAOYSA-N 281.232 -0.303 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCCOCCO 357060043 PGMYHLXRGRUGAR-UHFFFAOYSA-N 299.283 -0.728 5 20 CBBD CN1CC[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 357460496 RCJZEIHHKIZQHI-SSDOTTSWSA-N 279.256 -0.269 5 20 CBBD C[C@]1(C(N)=O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 361558846 YUBKVHZLBZBGBT-NSHDSACASA-N 267.289 -0.011 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 557590867 DUNMPGOMLSXMPD-NXEZZACHSA-N 267.241 -0.179 5 20 CBBD CNc1nccc(C(=O)NCC(F)(F)CO)c1[N+](=O)[O-] 570223932 JFJXYJBKSVWJAE-UHFFFAOYSA-N 290.226 0.389 5 20 CBBD CN(C)[C@H]1CN(c2ccnc(O)c2[N+](=O)[O-])C[C@@H]1O 596242594 YSJLSQNRPXYTSV-IUCAKERBSA-N 268.273 -0.194 5 20 CBBD CC(C)(C(N)=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 618221332 AACANPUAFVFKNC-UHFFFAOYSA-N 269.261 -0.581 5 20 CBBD NC(=O)CONC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 772936421 RGDVETJVYXCGOT-UHFFFAOYSA-N 297.223 -0.487 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 808171937 OPYYVJQUTTWHFU-SECBINFHSA-N 282.300 -0.171 5 20 CBBD CC(C)(NS(C)(=O)=O)C(=O)OCC(C)(C)[N+](=O)[O-] 851127338 VAGZHKQJYKTPSO-UHFFFAOYSA-N 282.318 -0.087 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@@H]1CC(=O)N(c2cnn(C)c2)C1 860787392 KXOFESNLBDSJSX-RKDXNWHRSA-N 296.283 -0.019 5 20 CBBD CC(=O)NCC(=O)NCCN(C)c1ncccc1[N+](=O)[O-] 1099900420 CIVMFVGNQTYMDA-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD CN(C)S(=O)(=O)CCCn1cnc([N+](=O)[O-])n1 1318214046 NYXAIEHMKQHQES-UHFFFAOYSA-N 263.279 -0.532 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1ncc[nH]1 1318584418 FQLPKUQFVZOLTQ-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD Cc1nc(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)n[nH]1 1320009605 ITOBYEPTBQXHJW-UHFFFAOYSA-N 278.228 -0.178 5 20 CBBD C[C@H](O)CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](C)CO 1320923817 VRZRMYJCWXTFIM-SFYZADRCSA-N 286.288 -0.468 5 20 CBBD COCC[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)C(N)=O 1325952928 YZDZHERIDAUARS-ZETCQYMHSA-N 294.271 -0.060 5 20 CBBD Cn1nccc1[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)O 1574472548 NAWSUTHZZBAKHT-LPBLVHEISA-N 268.229 -0.673 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1CCC12CNC2 1580789391 WNGNAMPAHVEUAA-UHFFFAOYSA-N 263.257 -0.009 5 20 CBBD C[C@H](C(=O)O)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 1588602600 NXTGVBAXDJHMEQ-BYPYZUCNSA-N 268.189 -0.194 5 20 CBBD CCOC[C@H](C(=O)O)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1605620032 AHUPFBUNIBDACE-BWZBUEFSSA-N 260.246 -0.400 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCC(O)(C(=O)O)CC2)n1 1608122490 FQBNATFANDTDOM-UHFFFAOYSA-N 298.255 -0.620 5 20 CBBD NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1N 122826257 ZPSXPZCOHVLFTR-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@@H](O)C1 236574069 MPXSTEQUWUBDTF-UWVGGRQHSA-N 252.226 -0.228 5 20 CBBD Cc1nc2n(n1)CCN(c1ncc([N+](=O)[O-])c(N)n1)C2 267062233 BZFAVWADYBDTDO-UHFFFAOYSA-N 276.260 -0.113 5 20 CBBD CCc1ccc(C(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 268681747 UMSFRWPVYUQGPP-UHFFFAOYSA-N 295.295 -0.005 5 20 CBBD CCOC(=O)c1ccnc(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 279539153 VHIMVWUAMHMZMP-SSDOTTSWSA-N 298.255 -0.575 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)N1CCN(C)CC1 285390635 CALUUKJKODLLQX-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1(CO)CCC1 292270525 ZPAZPEYWTHOYGT-NSHDSACASA-N 284.316 -0.001 5 20 CBBD CCN1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 330814438 BNCVIAWTVUAIBC-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD CCC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 336813120 SZABJTBRISLOMS-SSDOTTSWSA-N 269.261 -0.439 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CCCC(=O)N1 345545478 MYLMVNRGWPRSQI-SECBINFHSA-N 295.299 -0.115 5 20 CBBD CCN(CC)CCOCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 347884691 XHKVNICZGRFYAL-UHFFFAOYSA-N 298.347 0.159 5 20 CBBD C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 356355966 HQRSTABEXRNORQ-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])nn1C 356487781 YIOFFMLOUMSSKS-UHFFFAOYSA-N 283.288 -0.075 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)COc1cccc([N+](=O)[O-])c1 387413084 DCWRTKNRJQHICB-LDYMZIIASA-N 284.268 -0.169 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](CO)OC[C@@H]2C)c1[N+](=O)[O-] 494681766 MILJGHMVXWVYGB-POYBYMJQSA-N 284.272 -0.152 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 564966194 CJCJTDRMZRCPAK-RXMQYKEDSA-N 254.202 -0.135 5 20 CBBD CNc1nccc(C(=O)N(C)CC(N)=O)c1[N+](=O)[O-] 573503028 HTKSTPZOYQGNBG-UHFFFAOYSA-N 267.245 -0.411 5 20 CBBD CN1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1=O 579336841 YDTVCFUBKOONIH-UHFFFAOYSA-N 278.268 -0.028 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H](O)C(F)(F)F 591786308 UELWNCPJDIEQPB-UJURSFKZSA-N 297.193 -0.386 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 592006812 WVJWJZYSZQHBJZ-RQJHMYQMSA-N 297.271 -0.673 5 20 CBBD COC(=O)CN1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596071038 WJFGWCXGJBRYLW-UHFFFAOYSA-N 296.283 -0.010 5 20 CBBD COC(=O)COCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 600397207 OBWQXDKLKWZZGI-UHFFFAOYSA-N 298.255 -0.509 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCn1cncn1 727050001 OUSMPIDAOICWED-UHFFFAOYSA-N 266.217 -0.374 5 20 CBBD CN1C[C@@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CC1=O 748117859 KNMBTNWUHCROQS-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD CN1C[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 825576138 XORNCICUUGBXGU-SKDRFNHKSA-N 293.279 -0.025 5 20 CBBD CCn1ncc(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 842104410 OTWUAYKIZZGCTO-HTRCEHHLSA-N 268.229 -0.311 5 20 CBBD NC(=O)COC1CCN(Cn2nccc2[N+](=O)[O-])CC1 1322380312 AYNGPZQMAAEXDZ-UHFFFAOYSA-N 283.288 -0.285 5 20 CBBD C[C@@H]1[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CCS1(=O)=O 1329655122 QVNAPOJOYXVJIV-IYSWYEEDSA-N 288.285 -0.377 5 20 CBBD CCN(CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cnn[nH]1 1576525668 WYFSCIHPKIUCSZ-GHMZBOCLSA-N 296.331 -0.202 5 20 CBBD CN(CC(=O)O)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] 1593723618 XRYWZBZDCQCFLX-UHFFFAOYSA-N 289.269 -0.237 5 20 CBBD CO[C@H](C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1593908220 FRPCKHBQZXGWMI-ZETCQYMHSA-N 272.217 -0.993 5 20 CBBD O=C(O)COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 1608756022 BFUUTXDMEVXJJV-UHFFFAOYSA-N 282.208 -0.048 5 20 CBBD CN(CC(N)=O)c1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 1609272884 FSLDGXGSANRWKT-UHFFFAOYSA-N 277.244 -0.304 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cc2c(cc1[N+](=O)[O-])OCO2 1610696599 QZBOYKDFRVHJNE-ZETCQYMHSA-N 298.207 -0.501 5 20 CBBD CN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 37448106 ZKQYYXITOOOXRB-UHFFFAOYSA-N 255.186 -0.560 5 20 CBBD Cc1nn(C)c(NC2CCN(CC(N)=O)CC2)c1[N+](=O)[O-] 37998831 LZWLWNYTLUXGIR-UHFFFAOYSA-N 296.331 -0.002 5 20 CBBD Cc1cc(C(=O)NC[C@H](O)C(N)=O)ccc1[N+](=O)[O-] 227868846 SRNHMWKSLCRVSM-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD Cc1nn(C)c(NCCS(=O)(=O)N(C)C)c1[N+](=O)[O-] 231011078 LNTNRZKLZLJGRU-UHFFFAOYSA-N 291.333 -0.060 5 20 CBBD CCCNCCNC(=O)Cn1cnc([N+](=O)[O-])n1 261794576 IJUTUHFAVACSSM-UHFFFAOYSA-N 256.266 -0.698 5 20 CBBD CN(CCN1CCOCC1)c1ncc([N+](=O)[O-])c(N)n1 263953679 KJEDSWWEPGJQAW-UHFFFAOYSA-N 282.304 -0.265 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)O1 268430554 ZBYIVYYKXDPQFA-XPUUQOCRSA-N 282.256 -0.314 5 20 CBBD COC(=O)N1CC(NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 269401597 ZBGJXWAJMCBQJV-UHFFFAOYSA-N 297.271 -0.252 5 20 CBBD CCN(CCCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 270130395 BEYZPTSDEBXYRT-UHFFFAOYSA-N 283.284 -0.013 5 20 CBBD Cc1ccc([N+](=O)[O-])c(=O)n1Cc1nnn(C)n1 289358898 ILFVNISBAMRZPF-UHFFFAOYSA-N 250.218 -0.363 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 330689813 FHIOJCJFQVOWJK-SNVBAGLBSA-N 281.316 -0.102 5 20 CBBD NC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])o2)CCOCC1 371220510 RXWPRXLFRPYOQR-UHFFFAOYSA-N 283.240 -0.048 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 436676622 RGELKAFUDHDAOH-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD C[C@@H](O)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 555228482 AGDOEZFFWVFREM-SSDOTTSWSA-N 275.286 -0.009 5 20 CBBD O=C1NCCC[C@H]1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 591735406 YYVMPAMLMHFOKS-ONGXEEELSA-N 297.315 -0.732 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 593812330 AUNCTXBELSMEBI-IAQIWYKVSA-N 280.240 -0.311 5 20 CBBD C[C@H](O)[C@H](O)CNc1nccc(C(=O)O)c1[N+](=O)[O-] 717351916 UCXWMQBIWCDZOF-CAHLUQPWSA-N 271.229 -0.158 5 20 CBBD CN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 746296325 ZJVALBUFWWDENB-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD CC(=O)NCC(=O)OCCn1ccc([N+](=O)[O-])n1 764488706 YEMGWJRIBPGBMZ-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD C[C@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820178008 XSPCUITWGQDHKG-LURJTMIESA-N 270.197 -0.227 5 20 CBBD Cc1nn(CN2CCN(C)C(=O)C2)cc1[N+](=O)[O-] 844732358 QXSAHTAITACSDV-UHFFFAOYSA-N 253.262 -0.169 5 20 CBBD CS(=O)(=O)NCC1CCN(CC[N+](=O)[O-])CC1 930448604 GQCCTGYVOUEZPX-UHFFFAOYSA-N 265.335 -0.476 5 20 CBBD CNC(=O)CC(=O)NCCNc1ccnc(O)c1[N+](=O)[O-] 1093568028 NEWMMMZUHKGJJA-UHFFFAOYSA-N 297.271 -0.640 5 20 CBBD COC(=O)c1ncn(CCn2cc([N+](=O)[O-])cn2)n1 1116328158 DURSFBAUXFDKPF-UHFFFAOYSA-N 266.217 -0.130 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1=NCC(=O)N1 1318102349 KFRUQJLUBWLLAO-UHFFFAOYSA-N 280.244 -0.908 5 20 CBBD C[C@@H](N)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1325826527 UAHCGSXWQQVXDO-NXEZZACHSA-N 294.311 -0.048 5 20 CBBD C[C@H](N)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1325826528 UAHCGSXWQQVXDO-UWVGGRQHSA-N 294.311 -0.048 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(C)(CO)CO 1326486389 CZICFIZYIKAJFF-UHFFFAOYSA-N 272.261 -0.951 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](CO)[C@@H](O)C1 1344550231 WITIINRYZRXFTQ-SVRRBLITSA-N 270.245 -0.867 5 20 CBBD C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)NC(N)=O 36800736 NRJQWMJNUJRDCN-RXMQYKEDSA-N 254.202 -0.048 5 20 CBBD COC(=O)CN(CC(=O)OC)C(=O)c1ccc([N+](=O)[O-])[nH]1 61875625 JSQGJONHZJWSEJ-UHFFFAOYSA-N 299.239 -0.289 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCNC1 126846598 QOOWJTQBPSZHCH-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C 264484327 JCNOESKHYGUMSZ-QMMMGPOBSA-N 295.299 -0.013 5 20 CBBD CN1CC[C@H](N(C)c2ncc([N+](=O)[O-])c(N)n2)C1=O 265611556 VGPFGMKOUDSBIX-LURJTMIESA-N 266.261 -0.366 5 20 CBBD CC(=O)NC1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 331545465 OWLMZUBIRIPOFW-UHFFFAOYSA-N 252.230 -0.117 5 20 CBBD CNC(=O)[C@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 346843081 CJQHSINQVPHSMB-ZETCQYMHSA-N 283.288 -0.223 5 20 CBBD NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1 353860247 MFAPBFVNHXMXDD-UHFFFAOYSA-N 265.229 -0.680 5 20 CBBD Nc1nc(N2CCS(=O)CC2)ncc1[N+](=O)[O-] 354416256 VREPJXMJKIQTCY-UHFFFAOYSA-N 257.275 -0.464 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1C(=O)CCC1=O 356401538 BSYUKYJQHLDMOZ-UHFFFAOYSA-N 295.255 -0.944 5 20 CBBD CO[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H](CN)C1 359211928 KAUDIHNENVQUEZ-UWVGGRQHSA-N 297.315 -0.244 5 20 CBBD COCCOC1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 360761660 CETJYOYFMSNHAD-UHFFFAOYSA-N 284.272 -0.184 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@H](CO)[C@H]2CCCO2)c1 447901819 CWXKKFBJSDQPMO-GHMZBOCLSA-N 270.289 -0.079 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCNCC1 568745580 FIFKBDLZVYIVOR-UHFFFAOYSA-N 252.274 -0.338 5 20 CBBD CNc1nccc(C(=O)N2CCN(C)CC2)c1[N+](=O)[O-] 570174233 UFIJCPJEBIIBAV-UHFFFAOYSA-N 279.300 0.419 5 20 CBBD CCC[C@H](O)[C@@H](CO)Nc1ccc(N)c([N+](=O)[O-])n1 596272485 HMQDWYLEZWCIQJ-BDAKNGLRSA-N 270.289 0.506 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCN(C2CC2)C1 609345062 SBOIYWPOXIDFOE-MRVPVSSYSA-N 280.288 -0.461 5 20 CBBD Cn1nnc(CNc2ccnc(O)c2[N+](=O)[O-])n1 695451413 CCJYMSGDSIZKTN-UHFFFAOYSA-N 251.206 -0.169 5 20 CBBD CC(C)(C(=O)OCCC(N)=O)n1cc([N+](=O)[O-])cn1 759542004 MTDLPWZIBSTTQS-UHFFFAOYSA-N 270.245 -0.055 5 20 CBBD NS(=O)(=O)CCCOC(=O)c1ccc([N+](=O)[O-])cn1 761984428 WVUFFFLOOPEELC-UHFFFAOYSA-N 289.269 -0.175 5 20 CBBD CN(CC(=O)OCC(C)(C)[N+](=O)[O-])S(C)(=O)=O 851124933 QDFDGQZQEKMQSA-UHFFFAOYSA-N 268.291 -0.524 5 20 CBBD Cc1cnc(NCCN(C)C(=O)C(N)=O)c([N+](=O)[O-])c1 1101944621 CQFWVKADTZXGFV-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCc2c(O)ncnc2C1 1326792830 PKNFNVAXZYUGDU-VXNVDRBHSA-N 264.241 -0.268 5 20 CBBD Cn1ccc(NCCNC(=O)c2c([N+](=O)[O-])cnn2C)n1 1328592647 ZJZFIGOHKKVZRJ-UHFFFAOYSA-N 293.287 -0.096 5 20 CBBD COC(=O)C(C)(C)N1CCN(CC[N+](=O)[O-])CC1 1351333373 ZTSRSRKRFXHOKP-UHFFFAOYSA-N 259.306 -0.168 5 20 CBBD O=C1NC[C@@H](Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)O1 1602657845 HAUBTTCMTRCPEB-LURJTMIESA-N 283.196 -0.437 5 20 CBBD O=C(O)[C@@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1608540655 UQLHQJCZMRNHDQ-NXEZZACHSA-N 270.241 -0.337 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 88375932 VVPCTYDVXZWQJU-MRVPVSSYSA-N 284.228 -0.897 5 20 CBBD COC(=O)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 163394571 VJXRENVPKBCXMH-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD CN1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 193130706 YTYDFEGRQJGKLB-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD CN[C@@H](C)CNC(=O)CCn1cc([N+](=O)[O-])cn1 261739984 MJRDITHTZNPBQK-QMMMGPOBSA-N 255.278 -0.095 5 20 CBBD C[C@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)C(N)=O 341447813 BKJVKFFJPWFKLB-LURJTMIESA-N 280.240 -0.477 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 353321647 RTEMTMSYAJYAKW-UHFFFAOYSA-N 253.218 -0.722 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 439569230 JUPBDDYVXYWAMM-SSDOTTSWSA-N 255.234 -0.224 5 20 CBBD O=C1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CN1 543565777 MLVOTYLGFWKNQJ-QMMMGPOBSA-N 279.252 -0.022 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)S(C)(=O)=O 552365708 OEFGHPPJWUSQGJ-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD CN1C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C(=O)N1 554452980 ORMTXZPYZJUCED-NSHDSACASA-N 292.295 -0.011 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 592978907 JBBVRZAAPNSRNO-RQJHMYQMSA-N 283.240 -0.380 5 20 CBBD N[C@H]1C[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])o3)CCN2C1=O 594873899 QOMRCZFUNIBJMN-SFYZADRCSA-N 294.267 -0.428 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCCS(C)(=O)=O 766661927 OCOZHKJOTRQGPP-UHFFFAOYSA-N 291.285 -0.080 5 20 CBBD Cc1cc(F)cc(C(=O)NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 834574686 SABHWENSDRVFDF-QMMMGPOBSA-N 285.231 -0.382 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839531817 OOXDHCVDKIZKEY-IVZWLZJFSA-N 257.290 -0.512 5 20 CBBD O=C(O)COCC(=O)NCCn1cc([N+](=O)[O-])cn1 843331564 WRNSGZRKCKDLQV-UHFFFAOYSA-N 272.217 -0.991 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2COCO2)c1[N+](=O)[O-] 861968821 GOCSFVIHHIORQA-LURJTMIESA-N 256.218 -0.271 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cn[nH]c1 990313185 YMNGPYIWTBDGRJ-RKDXNWHRSA-N 279.256 -0.985 5 20 CBBD Cc1ncoc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990675528 VLDZOBRVOMTOJA-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD CC1(C(=O)NCCN(CCO)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1057544584 JECRZQFBEOEQGK-NXEZZACHSA-N 299.327 -0.611 5 20 CBBD COC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093490975 MWUBMVHTWCKAOU-UHFFFAOYSA-N 297.271 -0.126 5 20 CBBD Cc1nc(N(C)CCNC(=O)CC(N)=O)ccc1[N+](=O)[O-] 1099970901 PGUYTBNABKGKHI-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD O=C(CNC(=O)c1n[nH]cc1[N+](=O)[O-])NC1CC1 1319599133 VYZZDFROQQCEAL-UHFFFAOYSA-N 253.218 -0.674 5 20 CBBD CNC(=O)CCN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1321037964 VVKXJABVCCGHAY-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1nnc(C[N+](=O)[O-])n1C 1338205765 MNRJJMCTOPXMPR-SSDOTTSWSA-N 268.277 -0.741 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)c1nnnn1C 1339236180 BMYWHGIVSGWVJS-LURJTMIESA-N 294.275 -0.499 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CCO1 1610637130 XDHWRHMLKPDETK-QMMMGPOBSA-N 296.239 -0.622 5 20 CBBD CN(C)[C@@H]1CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C[C@H]1O 1777037003 VDHINKRCIPKESC-NXEZZACHSA-N 296.283 -0.201 5 20 CBBD O=C(CN1CCCC1=O)NCCn1cc([N+](=O)[O-])cn1 164415532 GKJUFVMRMCWIDF-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCCN1 182619903 ALJJHJSANMHBBO-VIFPVBQESA-N 253.262 -0.341 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@](F)(CO)C2)c1 338597871 YLCSMJFNSZZEPI-MNOVXSKESA-N 288.279 -0.442 5 20 CBBD C[C@H]1C[C@@H](O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 385022071 LTDNASVJXZFUBK-JGVFFNPUSA-N 254.246 -0.227 5 20 CBBD C[C@H]1CN(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCN1 417908888 JCXNBYBHJOUPFS-VIFPVBQESA-N 282.304 -0.205 5 20 CBBD NC[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 428627638 XYNQSAMKZXXAOP-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD Cc1nnnn1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 432734365 ROTHAAXFIZKODL-QMMMGPOBSA-N 253.222 -0.853 5 20 CBBD CCN1C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 452999734 UXZHVAAPIISJCL-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CNc1nc(C(=O)NCCn2ncnn2)ccc1[N+](=O)[O-] 455958465 JNUHLELLUBUIJO-UHFFFAOYSA-N 292.259 -0.552 5 20 CBBD O=c1onc(-c2cccc([N+](=O)[O-])c2)n1C[C@H](O)CO 519546379 VCJOKIBFZZYYAU-VIFPVBQESA-N 281.224 -0.235 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 519620000 XCVNUJQBLHWFHU-ZCFIWIBFSA-N 280.240 -0.580 5 20 CBBD CNc1nccc(C(=O)NC[C@@](C)(O)COC)c1[N+](=O)[O-] 582496887 OVZUPWKTRWVGCU-GFCCVEGCSA-N 298.299 0.159 5 20 CBBD CNc1nccc(C(=O)N2CC[C@](F)(CO)C2)c1[N+](=O)[O-] 594356897 HLRCPWLDPHRDJG-GFCCVEGCSA-N 298.274 0.578 5 20 CBBD CN(C)CCN(CC(=O)N(C)C)c1c([N+](=O)[O-])ncn1C 596463818 SSQBLNQCWIOZCE-UHFFFAOYSA-N 298.347 -0.216 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 763701002 PPXHWSHFGQJKAP-VIFPVBQESA-N 267.241 -0.569 5 20 CBBD Cn1cc(CCOC(=O)Cn2ccc([N+](=O)[O-])n2)nn1 851371287 WZWNMYPJPBLNBH-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD Cc1noc(CS(=O)(=O)CCO)c1[N+](=O)[O-] 1261647006 FMSFNRPUFZOLOL-UHFFFAOYSA-N 250.232 -0.202 5 20 CBBD CN(C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1)C1CCC1 1343188458 ZYUUIQXNTCPUDR-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD Cn1nnc2c1CC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C2 1346490940 FMTCGXPTMPNOAS-LURJTMIESA-N 291.271 -0.266 5 20 CBBD C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1574059760 FKCHNCKLDULCJU-YFKPBYRVSA-N 275.242 -0.259 5 20 CBBD COC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 31671666 HVJJZNSWAZTDKT-UHFFFAOYSA-N 269.213 -0.954 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H](CO)O1 163571831 PXBHJVNUPSKXPF-SECBINFHSA-N 298.299 -0.210 5 20 CBBD CNC(=O)C1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 186143932 NYJLSUJSOSVCFI-UHFFFAOYSA-N 253.218 -0.864 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)C1 234206511 IMKVXFOLOFCULS-YUMQZZPRSA-N 256.262 -0.339 5 20 CBBD CNC(=O)[C@@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247226940 CZVQRAWAACHZFR-MNOVXSKESA-N 297.315 -0.637 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C)C(=O)C2)c1[N+](=O)[O-] 265964596 ZKLTZILCATXEIR-UHFFFAOYSA-N 267.245 -0.459 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCO 268638202 MVMYQCGXXWZBNI-UHFFFAOYSA-N 256.262 -0.012 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1O 331181235 RLRPJHDEIVLINE-MWLCHTKSSA-N 295.295 -0.014 5 20 CBBD CN(CCOCCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 337487384 JHHCGEQRHZFULV-LLVKDONJSA-N 288.304 -0.907 5 20 CBBD CCC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 343464084 WIVZLDGFUDZTIG-RXMQYKEDSA-N 255.234 -0.298 5 20 CBBD COc1nc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1 352684434 LXSPSSRKXPRIHL-UHFFFAOYSA-N 253.178 -0.303 5 20 CBBD NC(=O)c1ccnc(NCCCc2nc[nH]n2)c1[N+](=O)[O-] 357510478 KBKLEXNYOZRCRZ-UHFFFAOYSA-N 291.271 0.252 5 20 CBBD O=C(O)c1ccnc(NCCCOCCO)c1[N+](=O)[O-] 380116265 PWLLDQXEWVCWED-UHFFFAOYSA-N 285.256 0.499 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 554876540 QFLRORXVHWSWRJ-JTQLQIEISA-N 272.261 -0.165 5 20 CBBD CNc1nccc(C(=O)NCCCCC(N)=O)c1[N+](=O)[O-] 577744585 QKVUPLNAYCSJJR-UHFFFAOYSA-N 295.299 0.417 5 20 CBBD CNc1nccc(C(=O)N[C@H](CO)CCOC)c1[N+](=O)[O-] 579858347 YHJHJKKQBFULKP-QMMMGPOBSA-N 298.299 0.159 5 20 CBBD COC(=O)COCCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 596816498 IPLDHVQVUVUBIB-UHFFFAOYSA-N 298.255 -0.277 5 20 CBBD CCc1[nH]nc(C(=O)NCc2nnnn2C)c1[N+](=O)[O-] 616172972 WBYSFIMYGFHVAT-UHFFFAOYSA-N 280.248 -0.666 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1CN 708846924 BVAYJZQWESHTFD-RKDXNWHRSA-N 267.289 -0.156 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 863708573 KSURKNJWLKAFND-ZCFIWIBFSA-N 297.271 -0.290 5 20 CBBD O=C(NCC1CN(C(=O)c2cn[nH]c2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001795579 HVAWRUAQBCFPCT-NXEZZACHSA-N 293.283 -0.737 5 20 CBBD CC(=O)NCC(=O)NCCNCc1ccccc1[N+](=O)[O-] 1122668181 VHKYIFAOBRVTSX-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD CNC[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1261645825 PNCWQHABSWRIAB-LURJTMIESA-N 255.278 -0.026 5 20 CBBD CCNC(=O)CN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1320108268 LOVJRPHQCOPSNO-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD O=[N+]([O-])c1cnn(CCNC2CCS(=O)(=O)CC2)c1 1331964715 QBYQQWCEPGZMFH-UHFFFAOYSA-N 288.329 -0.042 5 20 CBBD COC(=O)NCC(=O)OCCn1cnc([N+](=O)[O-])n1 1344568790 JLHVWCFQAQIVML-UHFFFAOYSA-N 273.205 -0.915 5 20 CBBD CN(CC(N)=O)c1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] 1591044819 XBUJGBXJKYIMTF-UHFFFAOYSA-N 283.273 -0.242 5 20 CBBD Cn1cc(Cn2cc(-c3nn[nH]n3)nn2)c([N+](=O)[O-])n1 1592575584 HQVUGVLWCRNHKB-UHFFFAOYSA-N 276.220 -0.852 5 20 CBBD CNC(=O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 25598245 KAJJTNNSFZPTBY-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1CCCS1(=O)=O 60874744 MSUIAIMPGJFFHQ-UHFFFAOYSA-N 289.317 -0.224 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C 264510534 NOUVIERISYJVOQ-SECBINFHSA-N 295.299 -0.163 5 20 CBBD CCN(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 264947884 XNCJHVSWZNUOSE-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD COCC(=O)N(C)CC(=O)NCCn1cc([N+](=O)[O-])cn1 270576713 WFBUHAOWPIPWKO-UHFFFAOYSA-N 299.287 -0.988 5 20 CBBD O=C(N[C@H]1CCCCNC1=O)c1cc([N+](=O)[O-])[nH]n1 285007809 DBYWUHLHBRCYEB-LURJTMIESA-N 267.245 -0.284 5 20 CBBD C[C@H](CC(N)=O)NC(=O)NCCn1cc([N+](=O)[O-])cn1 426965716 QUUQKUUXVCVDES-SSDOTTSWSA-N 284.276 -0.646 5 20 CBBD CNc1nccc(C(=O)N2CCS(=O)CC2)c1[N+](=O)[O-] 553095002 BMZUYEBOKQUHIE-UHFFFAOYSA-N 298.324 0.236 5 20 CBBD CC(C)(CN)C(=O)NCCn1cc([N+](=O)[O-])cn1 566101350 KGWZZTFVAKJTFT-UHFFFAOYSA-N 255.278 -0.108 5 20 CBBD Nc1ccc(N2CCN3C(=O)[C@H](N)C[C@H]3C2)nc1[N+](=O)[O-] 596013651 ITVYQHDBMIGKBY-IONNQARKSA-N 292.299 -0.680 5 20 CBBD NC(=O)NCCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 822880257 LYSLPYOAWKRLJV-UHFFFAOYSA-N 293.247 -0.750 5 20 CBBD COCCN(CCN(C)C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840324333 BPWRTUVEYAMJJK-NXEZZACHSA-N 259.306 -0.312 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccc[nH]1 990226325 PIAYBPVKZOEWKF-PSASIEDQSA-N 278.268 -0.380 5 20 CBBD Cc1ncc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)[nH]1 991282158 XKHPYSIPNVVELF-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1nnc(S)n1C 1116429908 UFOUAAVUXRDPJG-UHFFFAOYSA-N 297.300 -0.325 5 20 CBBD C[C@@H]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C(=O)O1 1261246004 XPMVHTBAQYLOEI-UHNVWZDZSA-N 254.202 -0.248 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@H]2OCC[C@@H]2C1 1299904391 IYQBGABORSZKDJ-BDAKNGLRSA-N 281.272 -0.176 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])nc2C)C1 1329607342 YTNNQQKAIKWFJN-SNVBAGLBSA-N 295.299 -0.163 5 20 CBBD C[C@H](CNC(=O)CNC(=O)CN)c1ccccc1[N+](=O)[O-] 1576015918 NKSWXGZWDDQZGJ-SECBINFHSA-N 294.311 -0.111 5 20 CBBD CNc1c(C(=O)NC[C@H]2CNC[C@H]2O)cccc1[N+](=O)[O-] 1578754226 KLOSGLBICRLEKS-LDYMZIIASA-N 294.311 -0.053 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCNC[C@@H]1F 1580579151 ZFSMHYAVJVHNMJ-DTWKUNHWSA-N 298.274 -0.427 5 20 CBBD NC1=CCN(c2cccc(-c3nn[nH]n3)c2[N+](=O)[O-])N1 1592739521 DQVWENHPTCIYDU-UHFFFAOYSA-N 274.244 -0.100 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCCNC1=O 42479699 LKBTVLIDENZPQH-SECBINFHSA-N 281.272 -0.424 5 20 CBBD O=C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCCN1 112207312 ADZXDJTYPXLLEZ-UHFFFAOYSA-N 267.245 -0.860 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCC(=O)NC1CC1 127948049 WSUAPFICAMOHAW-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC3(C2)OCCO3)c1 173326528 DICZFAGHXNQXRO-NSHDSACASA-N 298.299 -0.399 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 229975808 JMKFNUGSGVFIMM-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD COC[C@@H](O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 230158125 LLQGATAJPXOIDY-WDEREUQCSA-N 288.304 -0.861 5 20 CBBD CO[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H]1OC 277923537 RNGBWDDVXSFLJX-OCAPTIKFSA-N 270.245 -0.196 5 20 CBBD CCOC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285198890 SINGNTDPTIVCKI-UHFFFAOYSA-N 256.218 -0.047 5 20 CBBD CN(C)C1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1 290977826 RAAVQYMBIQCQJC-UHFFFAOYSA-N 265.273 -0.161 5 20 CBBD NC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 294495409 SKWZISDRKNOBGW-UHFFFAOYSA-N 292.295 -0.162 5 20 CBBD CN(CCO)c1cccc([N+](=O)[O-])c1S(N)(=O)=O 532883505 MFHVQAZDUOTJNM-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD C[C@H](Cn1cncn1)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 553393491 VOLQHRSAEWAHFR-SSDOTTSWSA-N 291.271 -0.018 5 20 CBBD NCC(F)(F)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 583630174 MHHCADNNTZIUNU-UHFFFAOYSA-N 296.255 -0.138 5 20 CBBD COC(=O)c1nccnc1NCCn1cc([N+](=O)[O-])cn1 591923989 QDVHWFBIXVTPHB-UHFFFAOYSA-N 292.255 0.480 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H](CO)CC1CC1 598292817 JKZGFWLQURJMSR-SECBINFHSA-N 283.288 -0.289 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(=O)N(CC2CC2)C1 619153443 QCXBDGKQTYDSJK-UHFFFAOYSA-N 293.283 -0.020 5 20 CBBD COC(=O)CN(CCn1ccc([N+](=O)[O-])n1)CC(=O)O 831175392 MCOJPFHQPSNPPH-UHFFFAOYSA-N 286.244 -0.649 5 20 CBBD COC[C@@H](O)C(=O)OCc1onc(C)c1[N+](=O)[O-] 853906575 JCRPDGBLZAFSAG-ZCFIWIBFSA-N 260.202 -0.058 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)C1 1022633412 JEOJUJXFCSXLKW-AOOOYVTPSA-N 292.295 -0.183 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCN(C)C(=O)C(N)=O 1101945052 YKOGEUNLCVVTTH-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD Cc1nn(C)c(C(=O)NCCOCCO)c1[N+](=O)[O-] 1115890355 HXPJTOJTWIUSLV-UHFFFAOYSA-N 272.261 -0.625 5 20 CBBD COCCONC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 1327437231 OKARWECYCKKZGQ-UHFFFAOYSA-N 297.267 -0.095 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1342821237 SLOUFQVQTWPRLU-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NC1CNC1 1574293410 HYEQHBNBWZNAIX-UHFFFAOYSA-N 292.295 -0.197 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1CC(O)(C(=O)O)C1 1601626117 PPXZNVVEWPANRJ-UHFFFAOYSA-N 282.212 -0.925 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C(=O)O)C1 1604745334 PWNWXALOYKWJQY-YUMQZZPRSA-N 297.271 -0.102 5 20 CBBD Cn1c(C(=O)N[C@@H]2CCC(=O)NC2)ccc1[N+](=O)[O-] 110906602 GHCSJVXOQZRZII-SSDOTTSWSA-N 266.257 -0.058 5 20 CBBD CN(CCO)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 170358335 QVTYOYUENAZZMD-UHFFFAOYSA-N 267.241 -0.016 5 20 CBBD O=C1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCN1 181777655 DCVUEZSJMUDJQD-UHFFFAOYSA-N 265.225 -0.128 5 20 CBBD CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230696117 MSOOGTKXLAIUPE-QMMMGPOBSA-N 281.272 -0.188 5 20 CBBD N[C@@H]1CC[C@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@H]12 248586078 GDIMCROPUZEUFC-INTQDDNPSA-N 279.300 -0.013 5 20 CBBD COCCN(CCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266526952 KRSXHSKWYJXETH-LLVKDONJSA-N 288.304 -0.907 5 20 CBBD CCN(CCO)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 347795400 SCEVVJKQYADSCE-UHFFFAOYSA-N 299.331 -0.319 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 360602297 WSDCUCKAZCDMID-MRVPVSSYSA-N 271.229 -0.423 5 20 CBBD NC(=O)c1cc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n[nH]1 586799006 MYPGMLGZVRNDGM-UHFFFAOYSA-N 291.223 0.375 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@H]2C[C@H]21 590433968 XTEVZGZJJFXLPI-SVRRBLITSA-N 252.230 -0.058 5 20 CBBD CS(=O)(=O)CC(=O)OCCn1cc([N+](=O)[O-])cn1 748124075 VXTQUGDNFWUGSS-UHFFFAOYSA-N 277.258 -0.621 5 20 CBBD Cn1cc([C@@H](O)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 797245667 SGTOTVKYLGWAPS-QMMMGPOBSA-N 280.244 -0.485 5 20 CBBD CC(C)(C)OC(=O)[C@@](C)(O)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839725644 HWBUHFLABZYUFF-RWYTXXIDSA-N 288.300 -0.140 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CCN(S(C)(=O)=O)C1 839777173 RGTKXHBNZJHSHS-DJLDLDEBSA-N 291.329 -0.856 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@H]1CCCN(S(C)(=O)=O)C1 860788767 VEENPFFIAUNVPI-IUCAKERBSA-N 294.329 -0.134 5 20 CBBD Nc1nccc(C(=O)N2C[C@H]3C[C@H]2C(=O)O3)c1[N+](=O)[O-] 861868627 LWCUBXIEJHCECX-VDTYLAMSSA-N 278.224 -0.288 5 20 CBBD NC(=O)C(=O)NC/C=C\CNc1ccnc(O)c1[N+](=O)[O-] 1107480454 JYJLRDRQJLVHQQ-UPHRSURJSA-N 295.255 -0.735 5 20 CBBD NC(=O)CC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 1125079572 ADWVIXPZGFCLOD-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-n1cnnc1[S@](C)=O 1318479687 JJLXYZOZIWLGKO-KRWDZBQOSA-N 256.247 -0.354 5 20 CBBD CC(C)(CS(C)(=O)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1320167323 SNSZFQOMGIKWPD-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD C[C@H](CC(=O)O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1592408775 GZNMCYZRJKRRBN-OPRDCNLKSA-N 285.300 -0.341 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC(=O)C(=O)O 1594460726 NERMTSKTBMCCNU-UHFFFAOYSA-N 285.212 -0.313 5 20 CBBD CN(CCNCCN1CCCC1=O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1753188203 MRBKWOVJXTZCGO-GHMZBOCLSA-N 298.343 -0.678 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 88373729 UZLUALHNESQZRB-SSDOTTSWSA-N 284.228 -0.897 5 20 CBBD O=C(O)[C@@H](O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 90263041 KEQGITJMJGVWBI-QMMMGPOBSA-N 290.253 -0.681 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC[S@@](C)=O 110856142 LTKSUGNHRLMRGH-IBGZPJMESA-N 288.329 -0.015 5 20 CBBD CCN1C[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 164417276 JNMLQXFRSLZHGY-SECBINFHSA-N 295.299 -0.224 5 20 CBBD CN1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 330403370 VZPXTHYDNPHDOM-VIFPVBQESA-N 282.300 -0.006 5 20 CBBD CC(C)(CNC(=O)c1n[nH]cc1[N+](=O)[O-])OCCO 354179825 LDHOMBQHRMZTIC-UHFFFAOYSA-N 272.261 -0.165 5 20 CBBD Cn1nccc1CNC(=O)c1cc([N+](=O)[O-])nn1C 356148740 SFEMNBGJZBYRHC-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD CC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 431646850 YZYIPCMCFNAXRI-YFKPBYRVSA-N 256.218 -0.079 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2cc[nH]n2)c1 566107672 PLYVDKUPPRNMNY-JTQLQIEISA-N 266.261 -0.335 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1cc([N+](=O)[O-])cnc1O 600838564 RLCLXVUBFZJQHE-VIFPVBQESA-N 296.283 -0.508 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCO1 615927474 KZBMIFLKFUKVKR-GFCCVEGCSA-N 297.267 -0.412 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OC[C@@H]1CCC(=O)N1 845109477 PYGMDXWWLDODTG-QMMMGPOBSA-N 282.256 -0.078 5 20 CBBD Cc1noc(COC(=O)C(C)(CO)CO)c1[N+](=O)[O-] 853905723 GJSVLBZLVHRORD-UHFFFAOYSA-N 274.229 -0.075 5 20 CBBD Cc1cc(N(C)CCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1100294897 VGLZJDJOXSOLKA-UHFFFAOYSA-N 280.284 -0.059 5 20 CBBD Cn1ccnc1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1520837222 YAMHYLGBTGVRTB-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD CS(=O)(=O)CCn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1599753008 WEISBUHLFPQEDY-UHFFFAOYSA-N 290.253 -0.501 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 1608602136 QAGSTWVTQDXFDJ-IONNQARKSA-N 295.251 -0.103 5 20 CBBD O=C(O)c1cn(CCn2cc([N+](=O)[O-])cn2)nn1 20596685 SRYTYGMIYMKSCH-UHFFFAOYSA-N 252.190 -0.219 5 20 CBBD COC(=O)[C@@H](CC(C)C)NC(=O)Cn1cnc([N+](=O)[O-])n1 53835764 NWWHODMQTVEAFC-MRVPVSSYSA-N 299.287 -0.110 5 20 CBBD NC(=O)NC1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 175759231 OUPBRDIOGGCKBJ-UHFFFAOYSA-N 282.304 -0.076 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NCCn1cc([N+](=O)[O-])cn1 193570172 PIXGFPIMSZSDMY-PSASIEDQSA-N 267.289 -0.095 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 228790051 KJWFJWCMWFGLJX-GFCCVEGCSA-N 298.299 -0.262 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262532019 PEYLLFZOLHSCKS-ZETCQYMHSA-N 283.240 -0.407 5 20 CBBD CCC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 271001395 YERQBZXPFKWBPC-UHFFFAOYSA-N 267.241 -0.148 5 20 CBBD COc1cc(CNC[C@H](O)CO)c([N+](=O)[O-])cc1O 276704294 FRYKCWJDVKQTHQ-QMMMGPOBSA-N 272.257 -0.248 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1O 330505502 KCMUTRGROXJNSI-YUMQZZPRSA-N 269.261 -0.584 5 20 CBBD O=C(CCn1ccnn1)NCCn1cc([N+](=O)[O-])cn1 338413068 FAWGWLVBUVNLBE-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD CNc1c(C(=O)NC[C@H](O)C(=O)OC)cccc1[N+](=O)[O-] 360943797 JQVWMIWCYKXTFT-VIFPVBQESA-N 297.267 -0.100 5 20 CBBD Cn1nnc(CSc2ncc([N+](=O)[O-])c(N)n2)n1 573578491 CYMGHEKHRUUFNN-UHFFFAOYSA-N 268.262 -0.217 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1O 576361906 YOIODKQRVJMVKZ-UWVGGRQHSA-N 295.299 -0.681 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)C(N)=O 760063706 HCIQPLVWMBNXMI-QMMMGPOBSA-N 297.267 -0.167 5 20 CBBD C[C@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CNC(=O)C1 802197321 IPUBWARWRKMICQ-LLVKDONJSA-N 282.256 -0.139 5 20 CBBD COc1ccc(NC(=O)C(=O)NCC(=O)O)cc1[N+](=O)[O-] 820840961 BSFLOGFEKCWKHG-UHFFFAOYSA-N 297.223 -0.257 5 20 CBBD CN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)C(N)=O 1101944920 SAIAFZWUSXJFJW-UHFFFAOYSA-N 267.245 -0.655 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)NCCF 1116921600 KMZWYTYVQQRFHS-LURJTMIESA-N 287.251 -0.468 5 20 CBBD Cc1ccc(=O)n(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1252238822 VTSBIWPHUWVZTA-SNVBAGLBSA-N 279.256 -0.282 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 1261494992 MUZGEULUIKTVGE-YUMQZZPRSA-N 268.277 -0.557 5 20 CBBD COC[C@@H](CCO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1319716497 GWXWKVZLIKTFTR-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)NC2(CCO)CNC2)n1 1579642542 KFGWHLWBNTXMFU-UHFFFAOYSA-N 280.284 -0.248 5 20 CBBD C[C@H](O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1589997627 SYHVZGFAJOUBFT-WKEGUHRASA-N 294.271 -0.072 5 20 CBBD Cn1cc(CN2CCO[C@@H](C(=O)O)C2)c([N+](=O)[O-])n1 1594542885 PCWVPEGUKFYOGK-MRVPVSSYSA-N 270.245 -0.386 5 20 CBBD C[C@H]1[C@H](C(=O)O)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1609835946 UBQSFYMLSBGUNH-NKWVEPMBSA-N 283.244 -0.492 5 20 CBBD CN1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])CC1 76040201 GTWUHQRBVRXVKW-UHFFFAOYSA-N 286.313 -0.074 5 20 CBBD COc1cc(C(=O)NC(CO)CO)ccc1[N+](=O)[O-] 146053824 BRAHPICUQIMIGV-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD CC(C)(C)[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 173343293 KQGGEECLPNTXGR-VHSXEESVSA-N 299.331 -0.358 5 20 CBBD CC(CO)(CO)NC(=O)CNc1ccccc1[N+](=O)[O-] 183517816 XEUSMPLWCOLAHE-UHFFFAOYSA-N 283.284 -0.134 5 20 CBBD CN[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 261639755 DDUOWNHFPNGOIS-SSDOTTSWSA-N 255.278 -0.176 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)N1CCOCC1 285218471 QAKLVEKQRKVLQS-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD CC(C)(C(=O)N[C@@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1 286245784 IKZPBLMIPVJNEN-JTQLQIEISA-N 295.295 -0.165 5 20 CBBD CCOC[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 311589818 QTAIVOLAIGDLJB-VIFPVBQESA-N 272.261 -0.695 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@@H]2COC[C@H]2O)c1[N+](=O)[O-] 342469814 QUPHYVJWVWKJOG-RNFRBKRXSA-N 270.245 -0.542 5 20 CBBD Cn1c(C(=O)NC[C@H]2CC[C@H](C(N)=O)O2)ccc1[N+](=O)[O-] 347391916 PWJDXUPDUPUCJR-VXNVDRBHSA-N 296.283 -0.304 5 20 CBBD CCN(CC(=O)OC)C(=O)c1cc([N+](=O)[O-])nn1C 359514657 HSMPSUDAYNXLCU-UHFFFAOYSA-N 270.245 -0.037 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCC2(CO)CC2)c1 395895411 HSIVRASRWKITQE-NSHDSACASA-N 284.316 -0.096 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 447742195 OZMRYBPAHNJSNX-MADCSZMMSA-N 296.283 -0.158 5 20 CBBD CCN(CCO)C(=O)c1ccnc(N)c1[N+](=O)[O-] 561116021 NCROBCUDYLNCJP-UHFFFAOYSA-N 254.246 0.026 5 20 CBBD CNC(=O)CN1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 590572667 MMXHMEYSKSDNRS-UHFFFAOYSA-N 294.315 -0.560 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 875680380 VEDMQVBBSTUWIH-UHFFFAOYSA-N 270.245 -0.269 5 20 CBBD Cn1cccc1C(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 919519744 ZECBFJCIQRVWCW-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2ccon2)C1 954235498 XPVFLOOGWMKUKT-PSASIEDQSA-N 294.267 -0.377 5 20 CBBD CCCNC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1116428101 XFHNPNQCBOLEAE-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD CCNCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118197284 PYEBZRHVXWFXSE-UHFFFAOYSA-N 268.273 -0.518 5 20 CBBD COCC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)OC 1324677824 SXLFDKAEUSDUIS-SSDOTTSWSA-N 286.244 -0.374 5 20 CBBD C[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 1589045910 PABPJTYPMQJBSP-RXMQYKEDSA-N 257.206 -0.977 5 20 CBBD Cc1cc(C(=O)NCC(=O)OCC(N)=O)ccc1[N+](=O)[O-] 11626255 VTBDTJWKGCTSGE-UHFFFAOYSA-N 295.251 -0.338 5 20 CBBD CCOC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 65791765 HXWHDGUDLDQGJI-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](O)C(N)=O 228602102 YXNVWJHVEBAAGG-ZCFIWIBFSA-N 257.250 -0.622 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](C)C1 276589092 KGUNEVQMAZJSPD-BDAKNGLRSA-N 297.315 -0.155 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 281765172 ZCNRRAGEAJWSRS-IYSWYEEDSA-N 266.261 -0.097 5 20 CBBD NS(=O)(=O)CCCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 311623289 ABVSZPMKDJVTEC-UHFFFAOYSA-N 290.301 -0.279 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCN2C(=O)NC[C@H]2C1 331845814 NJJGFOPEGQQUGX-ZETCQYMHSA-N 279.256 -0.228 5 20 CBBD COc1ccc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)cn1 342941507 XKABKEIFDYPRDI-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD CN(C)C(=O)CC(=O)NCCn1cc([N+](=O)[O-])cn1 427572588 NSOBFWSHPNIENG-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD CN1C[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 561220145 KACBFVLTIPXBLN-ZCFIWIBFSA-N 279.256 -0.468 5 20 CBBD C[C@H](O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 598387213 SDXQMUIXPRJXBN-ZETCQYMHSA-N 254.246 -0.179 5 20 CBBD Cc1noc(CN2CCN(C)C[C@@H]2CO)c1[N+](=O)[O-] 602906935 VHZOFXXKZNYGTF-SECBINFHSA-N 270.289 0.000 5 20 CBBD CCNC(=O)CN(C)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 604547160 LPGNDQWVSVBWQR-UHFFFAOYSA-N 269.261 -0.166 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 610892077 PXNKPDBWVMAZFU-LURJTMIESA-N 284.228 -0.448 5 20 CBBD Cc1nn(C)c(N2CC[C@@H](NC(N)=O)C2)c1[N+](=O)[O-] 611193797 YNDTXPDINUHQAW-SSDOTTSWSA-N 268.277 -0.116 5 20 CBBD O=C1NC[C@H]2CN(c3ncc([N+](=O)[O-])cn3)CCN12 612401406 PYFZCFZAMJIXNK-QMMMGPOBSA-N 264.245 -0.401 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H](O)C[C@H]1CO 698136602 ICRAWNUPBCOEAV-BQBZGAKWSA-N 255.230 -0.509 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H](CO)C2CC2)c1 763068660 MMQDUQBVIMXKKD-GHMZBOCLSA-N 270.289 -0.487 5 20 CBBD Nc1nccc(C(=O)N2CC(n3cncn3)C2)c1[N+](=O)[O-] 847431672 VJACGLYDXSFBIX-UHFFFAOYSA-N 289.255 -0.139 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H](N2CCOC2=O)C1 855504237 ZBUPNFQYGDEHMN-SSDOTTSWSA-N 295.255 -0.015 5 20 CBBD CN(C)C(=O)OCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 855647450 YQLBBYQRAWWGIG-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCOC)C1 950056190 WKOJNDODYQQGKQ-GHMZBOCLSA-N 271.317 -0.169 5 20 CBBD Cn1cnc(CNC(=O)NCCn2cc([N+](=O)[O-])cn2)n1 1319934247 WMOZWVQQEFMGJH-UHFFFAOYSA-N 294.275 -0.581 5 20 CBBD C[C@@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)N1CCOCC1 1348350833 WKJLWJLEQVNYCG-IWSPIJDZSA-N 272.257 -0.558 5 20 CBBD COc1ccc(S(=O)(=O)NCC(=O)O)c([N+](=O)[O-])c1 21517959 IQUPBBLVUPQIIG-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD Cc1nn(C)c(N2CCN(CC(N)=O)CC2)c1[N+](=O)[O-] 49320737 HXPNCDQFDHNDSG-UHFFFAOYSA-N 282.304 -0.756 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N(CCO)C1CC1 50469778 XENYXPUFKQGCOV-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD COC[C@@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 71270206 NGKPITBMUGVQEK-VIFPVBQESA-N 290.297 -0.120 5 20 CBBD COCCOCCNC(=O)Cn1ccc([N+](=O)[O-])n1 140758793 VHTFVGYELSTRRO-UHFFFAOYSA-N 272.261 -0.430 5 20 CBBD CNC(=O)CN(C)c1nc(C(=O)OC)ccc1[N+](=O)[O-] 166674515 BEYFEPWBRIZBMS-UHFFFAOYSA-N 282.256 -0.041 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC(O)C1 268237308 LJKWPMFQCMOZMK-UHFFFAOYSA-N 254.246 -0.307 5 20 CBBD CNC(=O)CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 272218027 PDBWOUBCIUXEFK-UHFFFAOYSA-N 281.224 -0.201 5 20 CBBD O=C1C[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CN1 332273859 XAVTYBXPCRDFGL-SSDOTTSWSA-N 293.235 -0.058 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)[C@H]1CCCO1 344855483 FCUHIQKTOAXHPY-DTWKUNHWSA-N 284.272 -0.553 5 20 CBBD COC(=O)[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)OC 347830559 KQHKQPPGTFBPTQ-SSDOTTSWSA-N 286.244 -0.905 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCCN(C)C2=O)c1[N+](=O)[O-] 359601302 HPYJZTNFFILTTK-ZETCQYMHSA-N 281.272 -0.023 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-] 563381918 WEWZWYDOCDEALW-ZCFIWIBFSA-N 281.272 -0.104 5 20 CBBD CC[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 577288531 SCTJXAHUJRMBHS-MRVPVSSYSA-N 285.260 -0.046 5 20 CBBD COCC[C@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(N)=O 596184371 GDYZLPPJWGUMAY-ZETCQYMHSA-N 269.261 -0.126 5 20 CBBD Cn1[nH]c(COC(=O)c2c(N)cccc2[N+](=O)[O-])nc1=O 765501983 HJBKDFDQHVMNSI-UHFFFAOYSA-N 293.239 -0.044 5 20 CBBD CON(C)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 776566478 CLJRUHRFGPHSTN-UHFFFAOYSA-N 284.272 -0.634 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCCOCCO 823625493 WPUNHGDLLLABQN-UHFFFAOYSA-N 295.259 -0.409 5 20 CBBD COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 831134533 QUXXUAVAKFUIBS-MRVPVSSYSA-N 297.223 -0.264 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H](n2cncn2)C1 1320566721 OTJURJIXKOZURE-VIFPVBQESA-N 291.271 -0.144 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)NC1CNC1 1331477349 WNFCKNVEPKDQMS-UHFFFAOYSA-N 292.295 -0.659 5 20 CBBD O=C1[C@H](NCC[N+](=O)[O-])CCN1C1CCOCC1 1336134722 CMLATWIODMEJAC-SNVBAGLBSA-N 257.290 -0.367 5 20 CBBD C[C@H]1CN(CCC(=O)O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1594519507 XVDCEYZQYNBOFY-IVZWLZJFSA-N 285.300 -0.341 5 20 CBBD O=C(O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 1595063754 VETPFACLSOZDRR-UHFFFAOYSA-N 275.242 -0.257 5 20 CBBD CN1C[C@H](C(=O)O)N(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 1606198948 BTJYRMOYNHSXDG-SSDOTTSWSA-N 296.239 -0.710 5 20 CBBD C[C@@H](CN1CCCC1=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 55815321 MJOYACDNNLYXCC-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD O=[N+]([O-])c1nc(Br)n(C[C@@H]2CNCCO2)n1 231803173 KVACPXUVHKNATR-YFKPBYRVSA-N 292.093 -0.063 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@@H](C(=O)O)C1 262036926 CAMODXLTCSDGJA-MRVPVSSYSA-N 298.255 -0.588 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1(C(=O)O)CC1 263138193 IPLWGYBXCNPEMO-UHFFFAOYSA-N 281.224 -0.510 5 20 CBBD COc1cc(OCC(=O)NCCC(N)=O)ccc1[N+](=O)[O-] 266562687 NUNQLIHLDJZAIF-UHFFFAOYSA-N 297.267 -0.026 5 20 CBBD C[C@@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 269132797 MKXYJZFXUZZUGY-LURJTMIESA-N 253.218 -0.268 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CC(N)=O 298919981 DBFZFPNGKHBWOL-UHFFFAOYSA-N 294.267 -0.215 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 336985605 HGLJUTSKOUZXAT-ZCFIWIBFSA-N 287.301 -0.410 5 20 CBBD CN(C(=O)N=c1cc[nH]cc1[N+](=O)[O-])C1CNC1 415384534 MXUJQHLQYIAWSW-UHFFFAOYSA-N 251.246 -0.153 5 20 CBBD CCNC(=O)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 611201322 NQLYIXAOWNJZBR-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)CC(F)F 717732385 IEGWVWVYVOBIPK-LURJTMIESA-N 278.215 -0.076 5 20 CBBD O=C1OCC[C@@H]1NS(=O)(=O)c1cccnc1[N+](=O)[O-] 742267883 FQMALULDCLRWOH-LURJTMIESA-N 287.253 -0.416 5 20 CBBD C/C(=C/COC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 825769326 NVZNKMJRESAGSL-KXFIGUGUSA-N 270.201 -0.240 5 20 CBBD CCOC(=O)COCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840673673 XWJQPVNLCOZKOQ-HTQZYQBOSA-N 261.230 -0.226 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@]2(CO)CCOC2)c1[N+](=O)[O-] 1254721302 PJCDDABPIQDUJX-SNVBAGLBSA-N 270.245 -0.492 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC/C=C\CO 1330920818 FYJKCBMDACKPGK-UPHRSURJSA-N 267.241 -0.579 5 20 CBBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)NCC(=O)O 1604409156 LUVOWZZPBUEWKS-ZCFIWIBFSA-N 299.239 -0.321 5 20 CBBD Cn1ncc(Cn2cc([N+](=O)[O-])cc(C(=O)O)c2=O)n1 1610615406 KUACUNIVEIFLBJ-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD COC(=O)[C@@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1 268011879 QGMBVIJNYLZWLC-LLVKDONJSA-N 298.255 -0.760 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 316934347 XBCXAQPOUHZQBR-POYBYMJQSA-N 283.240 -0.523 5 20 CBBD CN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 330861177 PSKXKMJMKHDAHX-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1Cc1c([N+](=O)[O-])ncn1C 331283695 FEOUQRRENGVPIH-ZJUUUORDSA-N 298.299 -0.173 5 20 CBBD O=C(NC[C@H](O)[C@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 354059146 PBAVCJXOEQUMMZ-XPUUQOCRSA-N 270.245 -0.555 5 20 CBBD Nc1nc(N2CC[C@H](c3nc[nH]n3)C2)ncc1[N+](=O)[O-] 425278090 DPFQOUULJZUUMY-LURJTMIESA-N 276.260 0.079 5 20 CBBD O=C1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CN1 450450243 GMJURFZJHRBNSE-RXMQYKEDSA-N 266.213 -0.686 5 20 CBBD COC(=O)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 519545475 VEYCOSGLYYGMBQ-SNVBAGLBSA-N 286.288 -0.305 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 546090389 FUPYQFRRHMUTNS-NSHDSACASA-N 284.272 -0.301 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 795482327 GMDLYXGSUUHWPP-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD Cc1nc(NCCCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1094741547 CEMSPGCCYYQBSR-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CCS(C)(=O)=O)c1[N+](=O)[O-] 1326131195 ZEVMLKLYYLOYNA-UHFFFAOYSA-N 290.301 -0.257 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN2CCOC[C@H]2C1 1340990599 AKZBDSLQSLJANE-SNVBAGLBSA-N 296.331 -0.405 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)N2CCC2)c1 1602298774 DXBOFJGKTJODCC-UHFFFAOYSA-N 281.224 -0.313 5 20 CBBD CO[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C(=O)O)C1 1606751755 ZNIPMBZFZIJGCJ-FNCVBFRFSA-N 272.257 -0.258 5 20 CBBD O=C(O)[C@H]1CSCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1608650746 ZMJVEAHUZJNLEA-ZCFIWIBFSA-N 286.269 -0.040 5 20 CBBD Cc1nn(CC(=O)N2CCNC2=O)c(C)c1[N+](=O)[O-] 8985912 SXWDECZSSOWKNX-UHFFFAOYSA-N 267.245 -0.040 5 20 CBBD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCN 36286392 MJGTXYAXHWBKFM-UHFFFAOYSA-N 275.286 -0.160 5 20 CBBD CCC1(O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1 89648291 GIIOUEFLFANXMV-UHFFFAOYSA-N 267.241 -0.120 5 20 CBBD O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CC(O)C1 161399759 DTSPYJOYUILXCR-UHFFFAOYSA-N 289.251 -0.008 5 20 CBBD C[C@H](O)[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 248602164 URSZEJVXCWYOGT-JBLDHEPKSA-N 284.316 -0.145 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 286297583 GGQMXTGDPOBDAD-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)OC 294191488 XIKRLDFUSKNPKB-ZCFIWIBFSA-N 272.217 -0.764 5 20 CBBD COCCOC1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 331442014 CYTRRLQAXMWQLD-UHFFFAOYSA-N 270.245 -0.195 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN([C@@H]2CCOC2)CC1 378312219 FFWKUHXPRYHDFF-SECBINFHSA-N 295.299 -0.135 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(O)(C2CC2)C1 408279541 AOMMFAFGGCOSJM-UHFFFAOYSA-N 266.257 -0.075 5 20 CBBD O=C(NC[C@H]1CNCCCO1)c1cc([N+](=O)[O-])cnc1O 519707271 CJYYYHGSOHBVAH-SECBINFHSA-N 296.283 -0.196 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1N 595229164 VCIRDASNWQILTO-KOLCDFICSA-N 294.311 -0.048 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCc1nc(N)n[nH]1 597668899 YRCFPYXPHPAFJW-UHFFFAOYSA-N 279.260 -0.394 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 763707724 LCYQJJCPGZMGPF-VIFPVBQESA-N 282.256 -0.986 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@@H]1O 824999987 LYXYBFKZBCJCDO-MUWHJKNJSA-N 291.271 -0.013 5 20 CBBD NS(=O)(=O)C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840404257 YKJVAHWYLHNGCJ-DJLDLDEBSA-N 291.329 -0.679 5 20 CBBD COC(=O)CNC(=O)CNC(=O)CCC(C)(C)[N+](=O)[O-] 848009732 XIZSDZYJXDVKHG-UHFFFAOYSA-N 289.288 -0.773 5 20 CBBD CC(C)(O)CC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093582532 WFFKEZIDIWGCDO-UHFFFAOYSA-N 298.303 -0.344 5 20 CBBD O=C(Cc1nc[nH]n1)NCCNc1ccc([N+](=O)[O-])cn1 1093851901 PNRHCCQNYJEAES-UHFFFAOYSA-N 291.271 -0.121 5 20 CBBD NC(=O)CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1 1094345687 FPHFEBRSGWMSLR-UHFFFAOYSA-N 281.272 -0.217 5 20 CBBD CC(C)CNC(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126938941 OIIPCGIMRDBWNI-NXEZZACHSA-N 286.332 -0.870 5 20 CBBD NC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1150015554 YTZGSLYLASTZKH-SSDOTTSWSA-N 253.218 -0.925 5 20 CBBD CN(C[C@H](O)CN)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 1328711731 HFWJZTLBZKMAAV-SNVBAGLBSA-N 296.283 -0.689 5 20 CBBD CC(=O)N1C[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@H]2C1 1331857459 WYDQFKOHFKWFSC-DTORHVGOSA-N 293.283 -0.132 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H]2COCCO2)c1[N+](=O)[O-] 1337778922 HLONAFBAVNGXTD-MRVPVSSYSA-N 284.272 -0.218 5 20 CBBD C[C@@H]1CN(CCC(=O)O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1594519508 XVDCEYZQYNBOFY-OPRDCNLKSA-N 285.300 -0.341 5 20 CBBD CC(C)(NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1602952079 QJIHQSSOIGJRKB-UHFFFAOYSA-N 283.240 -0.264 5 20 CBBD O=C(O)[C@@H]1CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cn1 1608639530 BJQBVXAEUZDQLU-ZETCQYMHSA-N 287.253 -0.163 5 20 CBBD Cn1nnnc1Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1610618270 FAEGMJVPUVCBDE-UHFFFAOYSA-N 280.200 -0.974 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 28480917 DSQCZXMHXRMOQN-UHFFFAOYSA-N 283.288 -0.226 5 20 CBBD O=C1CN(NC(=O)COc2ccc([N+](=O)[O-])cc2)C(=O)N1 29018269 GCMYDWJIARDYQG-UHFFFAOYSA-N 294.223 -0.443 5 20 CBBD COC(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 50469842 FPIAFXNOEZSGLA-LURJTMIESA-N 256.218 -0.531 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCN2CCCC2)c1 54126944 NIDUJPAYLWKUEK-GFCCVEGCSA-N 283.332 -0.162 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 62118210 OVNDWEXXXGTESN-SSDOTTSWSA-N 268.229 -0.276 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCCCNC1=O 67829178 NMXQEMOLGTXYJA-VIFPVBQESA-N 295.299 -0.115 5 20 CBBD C[C@@H](O)CN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 91236142 YTKMJKAGQCVHKR-MRVPVSSYSA-N 271.277 -0.187 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCN1 179180202 LBNFFWFBRZETRG-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236573853 LCMVKWUJWFTHOX-UWVGGRQHSA-N 270.216 -0.089 5 20 CBBD C[C@@H](CN(C)C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330669250 CRHZVXFFJCHZMX-ZETCQYMHSA-N 256.266 -0.747 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)[C@@H]1CCCO1 344855481 FCUHIQKTOAXHPY-BDAKNGLRSA-N 284.272 -0.553 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)CC(N)=O 348463918 VIDDIFMEGOQATO-UHFFFAOYSA-N 283.288 -0.130 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1O 436791722 SXDPVKOGOGUYGD-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD CNc1nc(C(=O)NC2CN(C(C)=O)C2)ccc1[N+](=O)[O-] 455774944 DZVNEKXLHIWMFA-UHFFFAOYSA-N 293.283 -0.008 5 20 CBBD O=C1CC[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2N1 855676973 MQPQOIZAKIGRHC-QCLAVDOMSA-N 267.285 -0.221 5 20 CBBD Cn1cnnc1CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 1318725298 VDPSATJYINRPLO-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD COC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)OC 1323543221 FKNDOZUEQHBONZ-RXMQYKEDSA-N 272.217 -0.764 5 20 CBBD CNCCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1326821149 RHACMDZEABFWBM-UHFFFAOYSA-N 255.278 -0.024 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)c1nn(C)cc1[N+](=O)[O-] 1334603328 OTCCGODNNWPQCM-YFKPBYRVSA-N 256.218 -0.079 5 20 CBBD C[C@@H](C(=O)O)C(=O)OCCn1cnc([N+](=O)[O-])n1 1588580756 VNTYGXJOHUTAAD-YFKPBYRVSA-N 258.190 -0.550 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(NC[C@H](O)CO)n1 236494382 DKKBNQXGMHIUMX-YFKPBYRVSA-N 257.202 -0.547 5 20 CBBD O=C(NCCNC(=O)C1CC1)c1cc([N+](=O)[O-])cnc1O 263958577 OOTUNYIRWDADGP-UHFFFAOYSA-N 294.267 -0.049 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@@H](C)O 276027615 TYAJYEZVEONCMM-LHLIQPBNSA-N 298.251 -0.047 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1 352989731 MYORNQYFAKGTCF-QMMMGPOBSA-N 253.214 -0.829 5 20 CBBD O=C(NC[C@H]1CCCS1(=O)=O)c1cc([N+](=O)[O-])n[nH]1 354033908 NNUJTDTXNJEXSC-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD O=C(O)c1cnc(N2CC[C@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1 396795567 DUOGSHHRZGVFRU-WPRPVWTQSA-N 297.267 -0.133 5 20 CBBD COC(=O)N1CC(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)C1 492242844 HMWPFDZOLQMQJK-UHFFFAOYSA-N 297.271 -0.183 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OC[C@@H]1CNC(=O)O1 495649194 GDSMJRRHZRGHAQ-ZETCQYMHSA-N 270.201 -0.557 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594348055 PHECKKWXMJAPTO-JVXZTZIISA-N 296.283 -0.158 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])o1 600551514 QLCLHRHPZPZAJV-MRVPVSSYSA-N 269.257 -0.016 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(C)(C)CO 610369762 UNSFKTMFVVZCOC-SNVBAGLBSA-N 272.305 -0.145 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC2(C1)OCCO2 764148891 MUADTFSZURDFJX-UHFFFAOYSA-N 268.229 -0.093 5 20 CBBD NC(=O)NCCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 773020683 LCWLXRUPSGEMRI-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 782866974 HWCIDJAQWJWHJA-SECBINFHSA-N 295.299 -0.130 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)N1CCO 839783130 VAIMULRCHSTOJS-LMLFDSFASA-N 271.317 -0.435 5 20 CBBD C[C@@H]1CN(CCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 840673556 SGVDBUHPKYABJV-OPRDCNLKSA-N 258.274 -0.085 5 20 CBBD CC1(C)CN(CC[N+](=O)[O-])CCN1CC[N+](=O)[O-] 929999878 OIRGIRBMJPFTJY-UHFFFAOYSA-N 260.294 -0.064 5 20 CBBD CC(C)(F)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991276400 DQJGUILQMDBKKC-HTQZYQBOSA-N 273.264 -0.273 5 20 CBBD O=C(NCCN(CCO)C(=O)CC1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1056779013 MOZYKPZOPYHODU-GHMZBOCLSA-N 299.327 -0.611 5 20 CBBD NC(=O)C(=O)NC[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1 1091395496 PATCHHZOGOIIDQ-OCAPTIKFSA-N 293.283 -0.218 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc[n+]([O-])cc1 1319354682 KOLDYRJYKGFJFY-UHFFFAOYSA-N 277.240 -0.145 5 20 CBBD NC(=O)COC1CCN(Cn2cc([N+](=O)[O-])cn2)CC1 1323609617 WDMHQGOPCRJQSR-UHFFFAOYSA-N 283.288 -0.285 5 20 CBBD Cc1nn(C)c(C(=O)NCCCOCCO)c1[N+](=O)[O-] 1325077737 RSXOYIQRCRYYAI-UHFFFAOYSA-N 286.288 -0.234 5 20 CBBD NC(=O)c1ccnc(N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 1594653112 DRAYOEATPWGVNY-SSDOTTSWSA-N 296.239 -0.622 5 20 CBBD Cc1cc(OCC(=O)N[C@@H](CO)C(=O)O)ccc1[N+](=O)[O-] 1600287959 NYEWWGJKDHFQNH-VIFPVBQESA-N 298.251 -0.156 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@](O)(C(=O)O)C1 1602625514 PWEWNDCFVUTLBL-GFCCVEGCSA-N 296.235 -0.038 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCCC(=O)C(=O)O 1610677941 PWWBQIJQOBQLMX-UHFFFAOYSA-N 285.212 -0.232 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)CO 133445342 KVDVCXHLPOQUNS-MRVPVSSYSA-N 269.257 -0.281 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCCC[C@@H]2CO)c1 159733988 HLLCNTBHELPHFV-ZYHUDNBSSA-N 284.316 -0.001 5 20 CBBD CCN(C)C(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 187264119 BGVYRTYTFILBFK-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD CN(CCO)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] 273430238 AEGCTOBUDVDFPQ-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 281330828 XDLNGMGMCLSGDQ-SSDOTTSWSA-N 270.245 -0.189 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1O 351853081 BLSYFAJBKPIBEK-SFYZADRCSA-N 254.246 -0.370 5 20 CBBD C[C@H](CNC(=O)c1ccc([N+](=O)[O-])o1)S(N)(=O)=O 359569198 XYPQMJCVLOLHEO-RXMQYKEDSA-N 277.258 -0.405 5 20 CBBD N[C@@H]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCN2C1=O 519613886 LJSRUQLAUWBCJW-JGVFFNPUSA-N 293.283 -0.693 5 20 CBBD CN1C[C@@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 582634097 FQUNEPXTNAWKNN-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD C[C@H](C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 582964127 IJMLBLKSKITPKU-LURJTMIESA-N 256.218 -0.372 5 20 CBBD NC(=O)N[C@@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1 588008761 YQORLRXHCDFIHM-MRVPVSSYSA-N 295.299 -0.084 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OC[C@@H]1COC(=O)O1 763955358 NJHOZFZRYGPENH-MRVPVSSYSA-N 298.207 -0.165 5 20 CBBD CC[C@](C)(NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 770015691 IQSNAZSRGDRFJM-NSHDSACASA-N 283.288 -0.048 5 20 CBBD CC[C@@H](CO)C(=O)NCCn1cc([N+](=O)[O-])cn1 779813730 URJFQKKXDQANCM-QMMMGPOBSA-N 256.262 -0.074 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCNC(=O)CNC(N)=O)n1 1093500700 HPLKOHNFKBFOAN-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD C[C@H](O)C1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1118791424 AXICGQHXGFNMQZ-LURJTMIESA-N 255.234 -0.784 5 20 CBBD CO[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1320651961 FEHPYDXUGNXBPB-QMMMGPOBSA-N 270.245 -0.227 5 20 CBBD CSc1cccc(C(=O)N[C@@H](CO)C(N)=O)c1[N+](=O)[O-] 1322479794 PFFXVIVMKZUVGG-ZETCQYMHSA-N 299.308 -0.107 5 20 CBBD CN(CCO)C(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 1323045531 XVTHUTKZDBBTPB-UHFFFAOYSA-N 281.268 -0.338 5 20 CBBD COC(=O)[C@@H]1C[C@H](C(=O)OC)CCN1CC[N+](=O)[O-] 1333921487 WKRNNINEBWALHQ-BDAKNGLRSA-N 274.273 -0.310 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1338619715 ZGODGNKWCVSUTO-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC[C@@]1(O)CCCOC1 1346306384 LNGFORBYKSHSCV-NSHDSACASA-N 299.287 -0.766 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN3CCOC[C@@]3(CO)C2)cn1 1516033260 WDFSWQHMOBOVRV-ZDUSSCGKSA-N 294.311 -0.127 5 20 CBBD NCCC(=O)NC[C@@H]1CCCCN1CC[N+](=O)[O-] 1580281553 DVDZUMOBLXLTHC-JTQLQIEISA-N 258.322 -0.417 5 20 CBBD Cn1ncc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n1 1592600982 MJPPOAFNYJZMPE-UHFFFAOYSA-N 276.220 -0.852 5 20 CBBD O=C(O)CN1CC[C@@H](n2ncc([N+](=O)[O-])n2)C1=O 1595086793 NUYLEKGVABPLDW-RXMQYKEDSA-N 255.190 -0.956 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@H]1C[C@H]1C(=O)O 1601383957 DBNMFXVNKGJKFE-HTQZYQBOSA-N 295.251 -0.407 5 20 CBBD CC(=O)N1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CC1 65834429 AOBGVCNPMPBXJU-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])cc1 264947625 JECXXFUSMBBFEM-UHFFFAOYSA-N 292.251 -0.124 5 20 CBBD NC[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CCO1 274843620 XCCDJBAEGGTNKR-VIFPVBQESA-N 280.284 -0.023 5 20 CBBD CC1(O)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 277838766 YKQQSUPZGNAPBK-UHFFFAOYSA-N 267.241 -0.650 5 20 CBBD CCOC1CC(O)(CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1 332035202 VYRSQDGGUYEMTQ-UHFFFAOYSA-N 298.299 -0.012 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@](C)(C(N)=O)C2)c1[N+](=O)[O-] 358351540 GBSLIGMLRDWSPA-NSHDSACASA-N 281.272 -0.036 5 20 CBBD COC(=O)C1(NC(=O)c2cc([N+](=O)[O-])nn2C)CC1 359485979 SYZCZVGTBILFSI-UHFFFAOYSA-N 268.229 -0.236 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])nn1C 494758129 PAFQMIZBRYSSQR-SSDOTTSWSA-N 281.272 -0.369 5 20 CBBD CN1C[C@@H](COC(=O)c2c([N+](=O)[O-])cnn2C)OC1=O 495731082 QFCHQSPENDHZIW-LURJTMIESA-N 284.228 -0.064 5 20 CBBD COC[C@@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 565275545 MKRDXXAOYAWDEY-NSHDSACASA-N 284.272 -0.102 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CC[C@H](CO)[C@@H](O)C2)n1 578466858 UTZNJPLECJCDRB-ZJUUUORDSA-N 270.289 -0.534 5 20 CBBD O=C(NC/C=C\CO)NCCn1cc([N+](=O)[O-])cn1 596505734 PRYATJIIUAJJTF-UPHRSURJSA-N 269.261 -0.361 5 20 CBBD N[C@]12CCC[C@@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 598670285 TVCFVRWCSLEROW-KCJUWKMLSA-N 280.288 -0.474 5 20 CBBD CN(CC(=O)N1C[C@H](O)[C@@H](O)C1)c1ccccc1[N+](=O)[O-] 600217255 VXJJMJKDHLHHGI-RYUDHWBXSA-N 295.295 -0.405 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(n2ccnn2)C1 779553847 BRHMUFQYBOPFPT-UHFFFAOYSA-N 277.244 -0.534 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O 779675667 ZRUZNRMNDARKOH-QMMMGPOBSA-N 283.240 -0.470 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C(N)=O 801800182 VBNLAKHVKKOYLU-SCSAIBSYSA-N 270.220 -0.080 5 20 CBBD CN(C)C(=O)Cn1cc(C(=O)OCCC[N+](=O)[O-])nn1 860915160 CGALJVGYYGILQA-UHFFFAOYSA-N 285.260 -0.810 5 20 CBBD Cc1nnc(N2CCN(CC[N+](=O)[O-])CC2)n1C 931453080 LEQSNSWLICUKGQ-UHFFFAOYSA-N 254.294 -0.478 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cn[nH]c1 1001022374 IICXFRRWKVLGEF-NXEZZACHSA-N 293.283 -0.737 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ncccc1[N+](=O)[O-] 1100294781 ODJWZRXOBMCZMR-UHFFFAOYSA-N 267.245 -0.973 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N(C)CCN(C)C(=O)C(N)=O 1105543214 OWMGWVCUFMAGAV-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NN1CCCC1=O 1116595120 UPBFMZUILUBLML-UHFFFAOYSA-N 265.229 -0.161 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]1(C)CCNC1 1118512151 IGIGJIVVIHDNDQ-JTQLQIEISA-N 253.262 -0.190 5 20 CBBD COC(=O)c1ncn(CCn2cc([N+](=O)[O-])ccc2=O)n1 1319583933 PKWLQBGZSZILIT-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD Cc1noc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 1319598614 JLCNXQKWZUCTBL-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD CNC(=O)CCN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1319757231 YZJBEKFNURZETP-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD O=C(NC[C@H]1CCCNC1=O)c1n[nH]cc1[N+](=O)[O-] 1321344260 OWCJQQMJMYQBBF-ZCFIWIBFSA-N 267.245 -0.426 5 20 CBBD O=[N+]([O-])CCN1CCC[C@H](N2CCCS2(=O)=O)C1 1333015855 DCRANESWJYNRRY-JTQLQIEISA-N 277.346 -0.237 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@]1(C(=O)O)CCOC1 1343713141 SIJSMSVFGXHOLU-SNVBAGLBSA-N 284.228 -0.698 5 20 CBBD COc1cccc(C(=O)NCC(N)=O)c1[N+](=O)[O-] 1343823305 OGJVKYCUWCNSKD-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD CN1CCN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C[C@H]1CO 1598623153 YRYIHMIROAHPSL-QMMMGPOBSA-N 296.283 -0.199 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1610732868 JHJAYJMSOYYLAR-HTRCEHHLSA-N 284.228 -0.632 5 20 CBBD Cn1c(C(=O)NCCN2CCNCC2)ccc1[N+](=O)[O-] 36278216 YZCVBSVHXNDCIM-UHFFFAOYSA-N 281.316 -0.432 5 20 CBBD NS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 73636859 WDJCWELGKHJQIL-UHFFFAOYSA-N 287.301 -0.685 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](N)C1CC1 237576680 PULNNSSFBWOMFN-SECBINFHSA-N 267.289 -0.047 5 20 CBBD CNC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 267997707 LZZJAXFCJLXCLJ-UHFFFAOYSA-N 295.299 -0.573 5 20 CBBD CCCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])cnc1N 346904062 LFCYKYOVCVFBRP-UHFFFAOYSA-N 281.272 -0.091 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCc2nn[nH]c2C1 353510747 SOIQXKUZZSTXLW-UHFFFAOYSA-N 263.217 -0.366 5 20 CBBD CN1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1 356481751 PJNPFQCEOMGOTM-MRVPVSSYSA-N 283.288 -0.611 5 20 CBBD NC(=O)NC(=O)COc1ccc([N+](=O)[O-])c(CO)c1 428069651 KXBSYNRLPHRFQM-UHFFFAOYSA-N 269.213 -0.339 5 20 CBBD Nc1nc(=NC[C@@H]2CCCC(=O)N2)[nH]cc1[N+](=O)[O-] 432918848 QPWSTXVDKFZXGW-LURJTMIESA-N 266.261 -0.531 5 20 CBBD CN1C(=O)C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 549760945 MFKMCTJHXUJQEC-QMMMGPOBSA-N 295.255 -0.945 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CNCCN1C 578858761 PLWFCWHCEYBGCU-LLVKDONJSA-N 293.327 -0.068 5 20 CBBD CN1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1=O 596184811 JRAINFRUNCZWII-UHFFFAOYSA-N 264.241 -0.070 5 20 CBBD O=C1C[C@@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)N1 597198917 JUTYCGFYVZFPTB-JTQLQIEISA-N 279.252 -0.022 5 20 CBBD COC(=O)c1ccnc(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 598620774 DXUDAVBOHVUTFO-ZCFIWIBFSA-N 284.228 -0.966 5 20 CBBD Cc1cc(C(=O)OCC(=O)NC(N)=O)c(N)c([N+](=O)[O-])c1 727900772 NOVMTYCVJVFTKP-UHFFFAOYSA-N 296.239 -0.163 5 20 CBBD COC[C@@H](O)C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 766142783 BEGFKROIODOTKQ-SECBINFHSA-N 286.240 -0.693 5 20 CBBD O=C(O)CNC(=O)COc1cccnc1[N+](=O)[O-] 821533055 XEFWBJXEOLXJQR-UHFFFAOYSA-N 255.186 -0.431 5 20 CBBD O=C(c1cnco1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1011114167 HZLBORZZWZFJAP-RKDXNWHRSA-N 294.267 -0.376 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(N)=O 1116018628 GICLDMPJELCZBW-UHFFFAOYSA-N 255.234 -0.909 5 20 CBBD C[C@@H](CN(C)C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1322604426 CDRJQIUFQMXATM-VIFPVBQESA-N 282.300 -0.177 5 20 CBBD C[C@H]1CN(CC[N+](=O)[O-])CCN1S(C)(=O)=O 1333913733 TVRAWADLDOVGGL-QMMMGPOBSA-N 251.308 -0.771 5 20 CBBD CCN(CC)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1343181170 FHSOJCZOAIULAO-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD O=[N+]([O-])CCN1CCC(N2CCS(=O)(=O)CC2)CC1 1354351710 RKCIXMMDANXEKA-UHFFFAOYSA-N 291.373 -0.542 5 20 CBBD NC(=O)NCCNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 1592731433 CWTKCOPQQBWFNA-UHFFFAOYSA-N 292.259 -0.145 5 20 CBBD O=C(O)C[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 1601930866 SQDNGYBZMNRCFC-XSSZXYGBSA-N 258.230 -0.598 5 20 CBBD COC[C@@](C)(NCCn1cc([N+](=O)[O-])ccc1=O)C(=O)O 1610244978 XASLHXSLFJAGQO-GFCCVEGCSA-N 299.283 -0.164 5 20 CBBD C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CC(N)=O)C1=O 4307356 BECIMWRQFOGMBT-GFCCVEGCSA-N 292.251 -0.153 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H]2CC[C@@H](O)C2)c1 227691062 PKTZYNWMZWIIKH-YUSALJHKSA-N 284.316 -0.097 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCSC1=O 266098449 JQIPNHKUZKUKKI-MRVPVSSYSA-N 297.292 -0.095 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NCCN1CCNC(=O)C1 281498533 OLKHDKMHQXWCAB-UHFFFAOYSA-N 296.331 -0.037 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 285814478 DYOGMAGYMQIUAG-XRGYYRRGSA-N 267.245 -0.428 5 20 CBBD CC(C)(CCNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 424233707 QDRPIMMJYHARNF-UHFFFAOYSA-N 285.260 -0.197 5 20 CBBD O=C1NC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]nc1[N+](=O)[O-] 516880791 XORMHBAVXAPYDU-HTRCEHHLSA-N 279.256 -0.332 5 20 CBBD CC(C)Oc1nc(NC[C@H](O)CO)ccc1[N+](=O)[O-] 571178441 DMZVNQXUISXNPD-QMMMGPOBSA-N 271.273 0.542 5 20 CBBD Nc1nccc(C(=O)N[C@@H](CO)CCF)c1[N+](=O)[O-] 594373424 TUDWAENPQPKZTN-ZCFIWIBFSA-N 272.236 0.022 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCOCCF 598563104 ZDIDBISDWFSSOO-UHFFFAOYSA-N 260.225 -0.106 5 20 CBBD CS(=O)(=O)[C@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 799949396 NQVNFJUZRKYKGC-QMMMGPOBSA-N 274.302 -0.132 5 20 CBBD C[C@@H](CO)Nc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 826231837 DZONPHSREFXIJV-YFKPBYRVSA-N 265.233 -0.037 5 20 CBBD CNC(=O)C1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 829516179 RKOKIFTVTRZTIR-LLVKDONJSA-N 293.279 -0.167 5 20 CBBD CC(C)(CO)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 840405344 IHRXTRZPZRMMOA-NXEZZACHSA-N 271.317 -0.433 5 20 CBBD CN1CCN(C(=O)CN(C)c2c([N+](=O)[O-])cnn2C)CC1 894958169 MNWYJTUJSUUVRX-UHFFFAOYSA-N 296.331 -0.462 5 20 CBBD O=[N+]([O-])CCN[C@@H]1CCCN(CCN2CCOCC2)C1 905447320 QCSCXHNYRDVBJO-CYBMUJFWSA-N 286.376 -0.351 5 20 CBBD Cn1cnnc1CNC(=O)CCn1cc([N+](=O)[O-])cn1 1115886558 SPRXMVGIXNMEQN-UHFFFAOYSA-N 279.260 -0.374 5 20 CBBD CC(C)S(=O)(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1117644415 KRQXPEVCYKSXON-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD Cc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])no1 1126943418 OJUBUIAGMSNTGZ-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H](n2cncn2)C1 1325268187 KSPIFRAEYVECPO-ZETCQYMHSA-N 277.244 -0.003 5 20 CBBD NC(=O)N[C@@H]1CCN(c2ccnc(O)c2[N+](=O)[O-])C1 1327688862 RUISWGQHUZQPAD-ZCFIWIBFSA-N 267.245 -0.058 5 20 CBBD O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H](O)C(=O)O 1601280459 NWXSMELFXUXBQR-JTQLQIEISA-N 297.267 -0.042 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@](C)(O)C(=O)O)c1[N+](=O)[O-] 1605433839 GXZLUQSPGUCIBD-SNVBAGLBSA-N 286.244 -0.798 5 20 CBBD NC(=O)CNC(=O)CCNc1ccccc1[N+](=O)[O-] 67509109 VLSNZHMZDCWYLK-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NCC(F)(F)CO 185087517 FNWWNRLMPLKIBE-UHFFFAOYSA-N 293.230 -0.282 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C(=O)NCC[C@@H]1C 194333007 AQIUOFCYKKZQGE-WRWORJQWSA-N 295.299 -0.259 5 20 CBBD Cn1cnc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 236131449 MECWDBMZCMDTIR-SECBINFHSA-N 281.276 -0.930 5 20 CBBD COCCN(CCO)C(=O)c1n[nH]cc1[N+](=O)[O-] 342233480 XCIUIJYVOXWGIU-UHFFFAOYSA-N 258.234 -0.601 5 20 CBBD CNC(=O)N[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 342354977 NTUMPANOTADAQS-SECBINFHSA-N 282.304 -0.205 5 20 CBBD CNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])n2C)C1 344937061 SBFWTWQQTBRKOY-UHFFFAOYSA-N 266.257 -0.249 5 20 CBBD CCCC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 347260267 LWFSZAQOMDTOMK-SSDOTTSWSA-N 285.260 -0.054 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H](CO)C1 352256655 LUZRPFKRFQFXCV-SSDOTTSWSA-N 266.257 -0.093 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 353364292 NJRWGMMBBRMNPV-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD O=C(NCc1nnnn1CC1CC1)c1cc([N+](=O)[O-])n[nH]1 354911137 NDCOSLAGPTXZRI-UHFFFAOYSA-N 292.259 -0.356 5 20 CBBD C[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H](CO)O1 357711222 XQYXJFSGTRNNAL-JGVFFNPUSA-N 296.283 -0.325 5 20 CBBD COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])nn1C 360753985 KNIFEHLVNTYFEH-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD COC[C@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])ccc1=O 593065746 AXGGBUSAARXHSC-VXGBXAGGSA-N 297.311 -0.162 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)N1 593412577 LGTWPIIWJPXUBE-JTQLQIEISA-N 299.308 -0.097 5 20 CBBD C[C@@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCNC1 595992009 NEXLBFXJOOFZTF-SNVBAGLBSA-N 253.262 -0.341 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1c1c([N+](=O)[O-])ncn1C 610076588 XBVVSDKRUQZITF-ZETCQYMHSA-N 274.302 -0.048 5 20 CBBD C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1N)C(=O)NC(N)=O 758953245 DYCPEMORWBIEPV-YFKPBYRVSA-N 296.239 -0.083 5 20 CBBD NCCN(Cc1cc(F)ccc1[N+](=O)[O-])C[C@H](O)CO 852753432 AXKXRRCPZHOFOK-NSHDSACASA-N 287.291 -0.152 5 20 CBBD O=C(NC[C@@H]1COCO1)c1cnc(O)c([N+](=O)[O-])c1 861977501 HAUKIMWUTRMFFI-SSDOTTSWSA-N 269.213 -0.202 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCn1ccnc1 1317922965 OMFWDKJPKAMMEN-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)Cn1cnc([N+](=O)[O-])n1 1328480036 ZDXZIBSLMHMMBE-MRVPVSSYSA-N 285.260 -0.940 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NC1CC=CC1 1349671407 UJRAFUIVWNYZMP-UHFFFAOYSA-N 293.283 -0.258 5 20 CBBD O=C(Cc1cc[nH]n1)OCCn1cnc([N+](=O)[O-])n1 1516784121 ZGMFZGDLDBFDRB-UHFFFAOYSA-N 266.217 -0.305 5 20 CBBD CCN(CC[N+](=O)[O-])[C@H](C)CC(=O)N1CCNCC1 1577728629 IXMXPGFOJZRQGS-LLVKDONJSA-N 272.349 -0.205 5 20 CBBD O=C(N[C@H](CF)C(=O)O)c1cnc(O)c([N+](=O)[O-])c1 1601418249 PVBBDSHXOXFFBR-RXMQYKEDSA-N 273.176 -0.152 5 20 CBBD CC1(C(=O)O)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1604502561 UTRVRRRAHFETLZ-UHFFFAOYSA-N 254.202 -0.135 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](CO)C(=O)O)n1 1607710042 SZBSEIUNRLLDMH-MRVPVSSYSA-N 269.213 -0.526 5 20 CBBD CNS(=O)(=O)c1ccc(NCCN)c([N+](=O)[O-])c1 35059768 JHQXQDDLFUMHSZ-UHFFFAOYSA-N 274.302 -0.127 5 20 CBBD CSc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 227872001 MZDKTMUMJMMZOM-MRVPVSSYSA-N 299.308 -0.107 5 20 CBBD CCNCCNC(=O)CCn1cc([N+](=O)[O-])cn1 236904882 XDJAYJWYIQWPRB-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 276643569 RFQMJELDFNMJJD-MRVPVSSYSA-N 283.288 -0.226 5 20 CBBD CO[C@H]1C[C@@H](CO)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 314565482 MGDZUEMCSYYMLU-IUCAKERBSA-N 296.283 -0.206 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337799512 YCKBVGDQJPQOGK-HZGVNTEJSA-N 281.272 -0.417 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CC[C@H](CO)O1 349622044 AGOMVLYHPPAHED-RKDXNWHRSA-N 284.272 -0.553 5 20 CBBD Cn1ccnc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 352584485 UHOGFNIFMHZAJC-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD C[C@H](CS(C)(=O)=O)N(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 352972165 GTHNJDWUHHXZDG-ZCFIWIBFSA-N 290.301 -0.177 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 358046027 KBTCZWIFLDSBRV-GFCCVEGCSA-N 282.300 -0.270 5 20 CBBD Cn1nnc(CNC(=O)CNc2ccccc2[N+](=O)[O-])n1 428545456 ZQGSRMFWQMOUFN-UHFFFAOYSA-N 291.271 -0.153 5 20 CBBD C[C@H](CN)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 441617707 DETIRZWUSFTODC-MRVPVSSYSA-N 268.273 -0.533 5 20 CBBD O=C1CN(CCNc2cccnc2[N+](=O)[O-])CCN1 611583638 MYGQZGLUXKFAPJ-UHFFFAOYSA-N 265.273 -0.167 5 20 CBBD CCNC(=O)CN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 618356978 ZQZAWDVQUNKIOY-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD NC(=O)C1(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 759608928 RJCGMZQTOLWIIZ-UHFFFAOYSA-N 264.241 -0.075 5 20 CBBD O=C(O)Cn1cc(CCn2cc([N+](=O)[O-])ccc2=O)nn1 833273217 CGWWRXYOXWBPKC-UHFFFAOYSA-N 293.239 -0.325 5 20 CBBD CC(C)(CCC(=O)N[C@]1(C(N)=O)CCOC1)[N+](=O)[O-] 848318406 HLVCFDVVIOGTFW-LLVKDONJSA-N 273.289 -0.418 5 20 CBBD NC(=O)[C@@H]1CC[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)O1 860414222 XZLDGTQXEIHRGY-DTWKUNHWSA-N 298.255 -0.633 5 20 CBBD CNC(=O)CN1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1 881772259 KIXZOCOBRILHEW-UHFFFAOYSA-N 297.290 -0.003 5 20 CBBD CC(=O)NC1(CO)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1080649355 INQSZQXHCMWTRZ-NXEZZACHSA-N 285.300 -0.859 5 20 CBBD COc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])on1 1126936896 WQLZDAXSHIAMFH-RKDXNWHRSA-N 284.272 -0.446 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCS(=O)(=O)CC1 1321851181 VUZOSAZTOVKNJT-UHFFFAOYSA-N 288.285 -0.421 5 20 CBBD O=[N+]([O-])c1c(N2CC[C@@H](CO)[C@@H](O)C2)ccnc1O 1333710849 XISDAIODZXVHNN-CBAPKCEASA-N 269.257 -0.125 5 20 CBBD C[C@H](O)[C@@H](O)CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1589997631 TUVQSHXUVHUBES-WKEGUHRASA-N 294.271 -0.072 5 20 CBBD CN(CCNC(=O)c1c[nH]nc1[N+](=O)[O-])CC(=O)O 1598492321 JCGWGQLWJYPSRV-UHFFFAOYSA-N 271.233 -0.936 5 20 CBBD CN(CCC(=O)O)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 37931969 HCMASHJOTHXNCJ-UHFFFAOYSA-N 269.213 -0.170 5 20 CBBD NS(=O)(=O)CCNC(=O)Cc1ccccc1[N+](=O)[O-] 40223380 PSLNICULZJPYAH-UHFFFAOYSA-N 287.297 -0.458 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@H]1CO 276024982 SXXGIMLHFJSWIL-KOLCDFICSA-N 295.295 -0.014 5 20 CBBD C[C@H]1C[C@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330987059 GJCNMAAMGWPYSH-WPRPVWTQSA-N 281.268 -0.262 5 20 CBBD NC(=O)N[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 342798887 YFRGKPIQQXGARJ-QMMMGPOBSA-N 293.283 -0.059 5 20 CBBD CN(C)C(=O)CCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 390031530 DKKVZPZRQJLONM-NSHDSACASA-N 299.331 -0.390 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])n2C)CCOC1 446489748 CQWRMAJQKAGSGN-GFCCVEGCSA-N 297.267 -0.005 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@@H]1CNC(=O)O1 495719016 SDMYITJFZNSHQZ-LURJTMIESA-N 270.201 -0.557 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 592923046 HGRIRGROVHOGDY-RQJHMYQMSA-N 298.255 -0.686 5 20 CBBD CN1C(=O)CC[C@@H]1CC(=O)NCCn1cc([N+](=O)[O-])cn1 597410888 SEXYTVVFMUJNPL-SECBINFHSA-N 295.299 -0.082 5 20 CBBD NC(=O)[C@@H](O)CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] 808050230 CKJRKWHWZBONOU-ZETCQYMHSA-N 270.201 -0.239 5 20 CBBD Cc1noc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1020138949 JFDCOKXMTGCYQM-ZYUZMQFOSA-N 295.299 -0.220 5 20 CBBD O=C1NC(=O)C2(CCN(c3ncc([N+](=O)[O-])cn3)CC2)N1 1323875893 DBFPCKNIPKFHMZ-UHFFFAOYSA-N 292.255 -0.437 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)c1c([N+](=O)[O-])cnn1C 1341457686 XLXGGIRUYZOOOX-UHFFFAOYSA-N 290.301 -0.555 5 20 CBBD Cc1nc(Cn2cc(C(=O)O[C@@H](C)C[N+](=O)[O-])nn2)no1 1514774437 JJDZVALVIABZDX-LURJTMIESA-N 296.243 -0.160 5 20 CBBD NC1=CCN(c2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])N1 1606436503 DOIWEAMGLWYLCZ-UHFFFAOYSA-N 274.244 -0.100 5 20 CBBD COC[C@](C)(CC(=O)O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610242015 GCJXHIAEIBEPNT-XSSZXYGBSA-N 260.246 -0.352 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H](O)C2CC2)c1 71304733 LULOMGOMDYMRDL-GHMZBOCLSA-N 270.289 -0.487 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(OCCO)CC1 129215325 ISKIBEFYNXHTPS-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD N[C@H]1CC[C@@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]12 185130921 GDIMCROPUZEUFC-IEBDPFPHSA-N 279.300 -0.013 5 20 CBBD CNC[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 237098802 OLQVHHXEDPXRTG-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCCO)c(N)c([N+](=O)[O-])c1 269547385 NEWOWGNSGRRTNX-UHFFFAOYSA-N 296.283 -0.676 5 20 CBBD COCCCN(CCO)C(=O)Cn1ccc([N+](=O)[O-])n1 275969365 LLYDBTKTSMXMMO-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD CCNC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])cn1 294024053 MLDFTMMVCOTSOW-UHFFFAOYSA-N 298.303 -0.383 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1cc([N+](=O)[O-])ccc1O 296787016 DFTSESWSKVWGQM-PSASIEDQSA-N 268.225 -0.210 5 20 CBBD CS(=O)(=O)c1cccc(N2CCNC(=O)C2)c1[N+](=O)[O-] 301885095 JVNWEPKLHHMFGG-UHFFFAOYSA-N 299.308 -0.066 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCCNC1=O 330562797 JHCHYQOTDFVNNZ-VIFPVBQESA-N 295.299 -0.115 5 20 CBBD COCCN1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 337970733 HERYQBICPXMBAE-UHFFFAOYSA-N 282.256 -0.189 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)S(N)(=O)=O 349080921 RYGLNLMBGLRGTH-YFKPBYRVSA-N 276.274 -0.670 5 20 CBBD NC(=O)N[C@H](CO)C(=O)NCCc1ccccc1[N+](=O)[O-] 352098490 RDSBMOAKPZTJBN-SECBINFHSA-N 296.283 -0.717 5 20 CBBD CCCc1[nH]nc(C(=O)NCCC(N)=O)c1[N+](=O)[O-] 362610604 JLBMJLMFBKTWPI-UHFFFAOYSA-N 269.261 -0.124 5 20 CBBD CC(=O)NCCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525184726 ORENZCSIDIWWDQ-UHFFFAOYSA-N 288.285 -0.596 5 20 CBBD Nc1nc(SCC(=O)N2CCOCC2)ncc1[N+](=O)[O-] 568883830 VITXWUJXASIWHV-UHFFFAOYSA-N 299.312 -0.082 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCCC1=O 583150541 WMXAVAULSXDFNQ-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD O=C(NCc1nnnn1C1CC1)c1cc([N+](=O)[O-])n[nH]1 586790238 YZPJRTAOMWACTC-UHFFFAOYSA-N 278.232 -0.431 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H](C)N 592332970 CARXZQPCPCKXJN-ZETCQYMHSA-N 255.278 -0.047 5 20 CBBD O=C(O)C12CC(CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2 594734188 RQIOVJRCIKCTEU-BSTRBVHOSA-N 296.283 -0.299 5 20 CBBD O=[N+]([O-])c1cnc(N2C[C@@H](CO)[C@H](CO)C2)nc1 705335113 ABYPSTHEHAJFEY-YUMQZZPRSA-N 254.246 -0.578 5 20 CBBD CC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(OC)OC 834415195 NNHVHNGMJHXXRU-ZETCQYMHSA-N 287.276 -0.300 5 20 CBBD O=C(NCCOC[C@H]1CCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 839684393 WADRXXOHBVFLNU-OPRDCNLKSA-N 258.274 -0.037 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCn1cnc([N+](=O)[O-])n1 1116371939 DPSWYDKGFSQWOS-UHFFFAOYSA-N 280.200 -0.044 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H](N2CC[C@H](O)C2)C1 1261818837 JDFYHPIHNGKGGK-BDAKNGLRSA-N 295.299 -0.401 5 20 CBBD Cc1nc(Cn2cc(C(=O)OC[C@H](C)[N+](=O)[O-])nn2)no1 1263475450 IZYVKZYQULBSPK-LURJTMIESA-N 296.243 -0.160 5 20 CBBD Cn1cnnc1COCC(=O)OCC(C)(C)[N+](=O)[O-] 1263520804 RBLQRSYAPBYSLY-UHFFFAOYSA-N 272.261 -0.070 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 1325268166 KMLQJIZHIXTDNZ-JTQLQIEISA-N 269.261 -0.886 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC1(C(=O)O)CCC1 1574809786 UEDGJQOJADLHQW-UHFFFAOYSA-N 295.251 -0.120 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN[C@@H]2C[C@H]21 1579877707 ZQMSGKUFFAYNJE-RKDXNWHRSA-N 265.273 -0.328 5 20 CBBD O=C1NCCC[C@H]1n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1593408894 PYRNTXRGNMBUTG-RXMQYKEDSA-N 278.232 -0.578 5 20 CBBD CON(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](C)C(=O)O 1594040720 PRRIMBHUNLAJBD-BYPYZUCNSA-N 258.190 -0.205 5 20 CBBD O=C(O)[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cccnc1 1601664320 GAEJIBFZGMNDAH-IWSPIJDZSA-N 265.225 -0.011 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@](F)(C(=O)O)C1 1602625015 QJSZJSQFOGCGDA-VIFPVBQESA-N 272.192 -0.043 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H](C(=O)O)C1CC1 1608377406 WGNHSSKOXGDDIJ-LLVKDONJSA-N 295.251 -0.264 5 20 CBBD COCCN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 44685448 NVUOWKSPKNENFN-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD NC(=O)CONC(=O)c1cc(F)cc([N+](=O)[O-])c1 124259438 MMLACBGSJSWXRG-UHFFFAOYSA-N 257.177 -0.119 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CCN1 140020366 WGMICMDCLGDYEV-QMMMGPOBSA-N 251.246 -0.747 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCOC[C@@H]1C1CC1 161368320 HHGUKCQKTDVWRF-SECBINFHSA-N 281.272 -0.176 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H](O)C2)c1 246692767 IOBVTAHBCCELMF-GHMZBOCLSA-N 270.289 -0.391 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@@H](C)O 274512962 HLDFDWSBGLYHFM-XRGYYRRGSA-N 272.213 -0.160 5 20 CBBD Nc1ccc(N2CCC(O)(CO)CC2)nc1[N+](=O)[O-] 313742893 OOBNQLKINSWZPO-UHFFFAOYSA-N 268.273 -0.104 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 345915623 NLAOSNRLIMDKKS-DTWKUNHWSA-N 295.299 -0.178 5 20 CBBD CC(C)(NC(=O)c1cc([N+](=O)[O-])n[nH]1)c1nn[nH]n1 353476068 ZQMFKDRMSXVZCW-UHFFFAOYSA-N 266.221 -0.504 5 20 CBBD C[C@H]1COCCN1CCNC(=O)c1cc([N+](=O)[O-])nn1C 356467316 ZMGCRAFZWIQAMJ-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CO[C@]1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1 359465729 KZBORAQVSCLMSB-NSHDSACASA-N 284.272 -0.287 5 20 CBBD CO[C@@H](C)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 359771697 HPQFKNHXCCKDTG-LURJTMIESA-N 255.230 -0.110 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 401912709 MOLCGTMVKWYEOU-HTRCEHHLSA-N 283.240 -0.170 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CCN1 443441632 XENWEXVEURZBRG-YFKPBYRVSA-N 257.275 -0.685 5 20 CBBD C[C@H](CCN=c1nc(N)c([N+](=O)[O-])c[nH]1)N(C)C 596424279 FVAKQIUALJXKQS-SSDOTTSWSA-N 254.294 0.141 5 20 CBBD O=C1C[C@H](C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)N1 597575331 OCPJENHHSLBDLS-SECBINFHSA-N 293.283 -0.157 5 20 CBBD Cn1c(C(=O)NCCn2cnnc2)ccc1[N+](=O)[O-] 597710708 CPTMWXLLYDXNCD-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD CN(Cc1nnc(O)o1)C(=O)c1cc([N+](=O)[O-])n[nH]1 598743645 BYGQZITVXBOJQT-UHFFFAOYSA-N 268.189 -0.321 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](N2CC[C@@H](O)C2)C1 599940244 NDZACYUSOMZZIC-DTWKUNHWSA-N 295.299 -0.401 5 20 CBBD COC[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C(N)=O 760051379 ZWROOFHLPQOBQP-MRVPVSSYSA-N 285.231 -0.036 5 20 CBBD Cn1cc([C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCN2)cn1 913456560 LVQSHODCIVBVLN-OUAUKWLOSA-N 279.300 -0.442 5 20 CBBD COCCO[C@H]1C[C@@H](CO)CN(CC[N+](=O)[O-])C1 1119855042 LYELNJURTPXHHN-MNOVXSKESA-N 262.306 -0.391 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1256261706 CFTHOWRNKQYGMH-LDWIPMOCSA-N 270.245 -0.412 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1nncn1C 1319729650 PPLADCPHNFPFAN-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD C[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1O 1324663484 XKHMBRTZHMCQQL-POYBYMJQSA-N 266.257 -0.094 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@]1(C)CNCCO1 1579877502 PYRRDJOKSRNVHB-GFCCVEGCSA-N 297.315 -0.406 5 20 CBBD Cc1nn(C)c(N2CCN(CCO)CC2)c1[N+](=O)[O-] 40444198 HLETXEMDRODOJF-UHFFFAOYSA-N 269.305 -0.249 5 20 CBBD Cc1ccc(C(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 279596138 IBMWDHLTDWJIFQ-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD O=C(NN1CCOCC1)c1cc([N+](=O)[O-])cnc1O 298094858 RPGDGQZNODDWIV-UHFFFAOYSA-N 268.229 -0.328 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCCNC1=O 330562796 JHCHYQOTDFVNNZ-SECBINFHSA-N 295.299 -0.115 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(N)=O 342370649 UMCLKKVHNFKGSJ-SSDOTTSWSA-N 294.267 -0.685 5 20 CBBD O=C(CO)N1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 351486229 CWGQAJQWVFDFAV-UHFFFAOYSA-N 282.256 -0.800 5 20 CBBD CN(C)C(=O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357177758 VYLOFPVBAHKJSD-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD O=C1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CN1 358884131 NIAFMRZEUCHIJU-ZETCQYMHSA-N 285.281 -0.238 5 20 CBBD O=C(CNC(=O)c1cnc(O)c([N+](=O)[O-])c1)NCC1CC1 445141587 UUQYCJMEDIQEFL-UHFFFAOYSA-N 294.267 -0.049 5 20 CBBD C[C@@H](C(=O)N[C@@H](CO)C(N)=O)c1cccc([N+](=O)[O-])c1 552964976 FIENWMFCOYZAIS-XCBNKYQSSA-N 281.268 -0.339 5 20 CBBD NC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CCCC1 579222066 AGWKVNXZACWADK-VIFPVBQESA-N 282.304 -0.180 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)O[C@H]1CCNC1=O 769982901 YKDFUSWNHQWVBS-ZETCQYMHSA-N 254.202 -0.777 5 20 CBBD CCONC(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 773748446 CLOPXCXDQGPZKM-UHFFFAOYSA-N 289.269 -0.077 5 20 CBBD CC[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)N1CCOCC1 840384133 FBLBMRRRLCQURO-OPRDCNLKSA-N 285.300 -0.595 5 20 CBBD Cc1ncoc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991279116 JFGDDQOZLHTIIF-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD NC(=O)c1cc(N2CC[C@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-] 1118591681 FIIVDYNEWZBCHY-PRHODGIISA-N 295.295 -0.127 5 20 CBBD Cn1cncc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932426 XIZADFGWWUCWNT-NXEZZACHSA-N 267.289 -0.709 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1261247667 FZDFMUKMPBNORK-LURJTMIESA-N 269.261 -0.499 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1324457218 KFYZAWHLSLFGSO-MYJAWHEDSA-N 280.284 -0.204 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1C[C@@H](CO)[C@H](CO)C1 1331804375 UBGLCOSNDZPRTQ-IUCAKERBSA-N 297.267 -0.632 5 20 CBBD CC(C)NC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1334935582 JMKZCHONJOSQIH-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD O=C(O)CNC(=O)[C@@H]1CCCN1c1ncc([N+](=O)[O-])cn1 1608752402 QCDWUOWRFBGJOQ-QMMMGPOBSA-N 295.255 -0.446 5 20 CBBD C[C@@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)N(C)C 45107362 PQWHHYUQFNBSSM-GXSJLCMTSA-N 271.321 -0.308 5 20 CBBD Nc1ccc(C(=O)NCc2nnn[nH]2)cc1[N+](=O)[O-] 50708677 SWDTVQQXCCKESL-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD COC(=O)[C@@H]1COCCN1CCn1c([N+](=O)[O-])cnc1C 163550909 ABMQXWXSODYRRS-JTQLQIEISA-N 298.299 -0.026 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCC(F)(F)CO 186100842 FTCFXHSRMTXGLH-UHFFFAOYSA-N 278.215 -0.075 5 20 CBBD COC(=O)[C@H]1CN(C)CCN(c2ncc([N+](=O)[O-])cn2)C1 413511462 ZQFLNKCMYYTSBX-VIFPVBQESA-N 295.299 -0.074 5 20 CBBD C[C@@H]1CNCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 432516994 YMLLPEBMEMYEEM-MWLCHTKSSA-N 294.311 -0.129 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@H](OCCO)C1 549739614 DSZMZYJEVBZNCF-QMMMGPOBSA-N 284.272 -0.069 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O 566460416 KELZZIZTRONPNX-QMMMGPOBSA-N 293.235 -0.213 5 20 CBBD O=[N+]([O-])c1c(NCCO)ncnc1N1CCOCC1 598584876 YQQREDHQNRXVAI-UHFFFAOYSA-N 269.261 -0.374 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCCC(=O)O)n1 600651724 IERXBSWLOISFBJ-UHFFFAOYSA-N 278.246 -0.919 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NN1CC(=O)NC1=O 756812722 MGODOXIPCNATBX-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD COC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 760075808 JNOFLADQXSPNDU-SSDOTTSWSA-N 282.256 -0.593 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1OCCCO1 787965701 WDLDQKWFDNUWCJ-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD CC(CO)(CO)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 846224614 ULTNZTJITNROOM-LLVKDONJSA-N 298.295 -0.265 5 20 CBBD O=C(NCc1cc2n(n1)CCCO2)[C@@H]1C[C@H]1[N+](=O)[O-] 848097355 FLQWLPHYTSWJHW-RKDXNWHRSA-N 266.257 -0.053 5 20 CBBD O=C(N[C@]1(CCO)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1255999291 QJFJAYPCUFGHPV-SNVBAGLBSA-N 270.245 -0.411 5 20 CBBD Cn1ccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1317917166 MYNVGAVAGXKZBG-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCOCCO 1320057815 ABQWKJOWQXRQSX-UHFFFAOYSA-N 272.261 -0.543 5 20 CBBD CCOCC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1320452859 DITBXWGIJPDJLM-UHFFFAOYSA-N 283.240 -0.539 5 20 CBBD Cn1nncc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1323589968 ZXYVFNFFBFBQIK-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD O=C(Nc1ccc(-c2nn[nH]n2)cn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1582638291 IDGNBZCROWJENW-RNFRBKRXSA-N 275.228 -0.135 5 20 CBBD C[C@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)O 1594239759 GTOXHMYLCFOABR-BYPYZUCNSA-N 254.202 -0.225 5 20 CBBD Cc1nn(CCC(=O)OCC(=O)C(=O)O)c(C)c1[N+](=O)[O-] 1594486309 OJVRAZVEDRVGCA-UHFFFAOYSA-N 299.239 -0.005 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@H]1C[C@H]1C(=O)O 1601029136 VQSKKDXUYGRURN-CRCLSJGQSA-N 254.202 -0.013 5 20 CBBD O=C1NCC2(CN(c3nc(C(=O)O)ccc3[N+](=O)[O-])C2)O1 1602658996 NBWRWYQKQDBRBX-UHFFFAOYSA-N 294.223 -0.013 5 20 CBBD CC(=O)N1CCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 164466888 SMRGIONVBGYAOO-NSHDSACASA-N 295.299 -0.082 5 20 CBBD C[C@@H]1CNCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 178496213 XRARRZUEQIKSFC-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CN1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C1=O 270604083 XOSQOSXAWAJPCE-NSHDSACASA-N 294.311 -0.081 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 340449818 FRJLDRYYFYBAAO-SECBINFHSA-N 281.272 -0.472 5 20 CBBD CNC(=O)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 343031722 SRCWIAKBUNHVPJ-MRVPVSSYSA-N 296.287 -0.687 5 20 CBBD CC(=O)N[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)C(N)=O 353510141 LYHGGFNZLNQPHS-JTQLQIEISA-N 294.267 -0.087 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)NC(C)C)c1[N+](=O)[O-] 354764604 DVUJQPNCIDFWOC-UHFFFAOYSA-N 269.261 -0.119 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])cn2C)n1 569646178 MOJAYDXBTNXHMN-UHFFFAOYSA-N 265.233 -0.613 5 20 CBBD Cc1nc(N2CCN3C(=O)[C@@H](N)C[C@H]3C2)ncc1[N+](=O)[O-] 581380852 HGWCRSKCBLGCBF-IUCAKERBSA-N 292.299 -0.559 5 20 CBBD CC(=O)N[C@@H]1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 594372467 DOIIGDPJKXFVMO-MRVPVSSYSA-N 293.283 -0.077 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN(C)C[C@H]1CO 699457426 JXFZJPFATBBYOW-NSHDSACASA-N 283.332 -0.292 5 20 CBBD Cn1nnnc1COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 733478885 BMJBKLLWWZRWDM-UHFFFAOYSA-N 295.259 -0.207 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1CCC(C(=O)O)CC1 739360214 AIVWPNJCRMFWJA-UHFFFAOYSA-N 297.271 -0.054 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)O1 808200137 CLGDHGGKQLQLKR-HTRCEHHLSA-N 268.229 -0.389 5 20 CBBD O=C(NCCN1C[C@@H]2CC[C@H](C1)O2)[C@@H]1C[C@H]1[N+](=O)[O-] 839782474 KNWMENCHFFEVMJ-LMLFDSFASA-N 269.301 -0.369 5 20 CBBD Cc1nc(O)nc(O)c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840387431 MLKSVJJUGZIXOH-RFZPGFLSSA-N 254.202 -0.200 5 20 CBBD NC(=O)C(=O)NCCNc1ccc([N+](=O)[O-])cc1F 1094079639 SRTHUQOTOKAOSO-UHFFFAOYSA-N 270.220 -0.253 5 20 CBBD CCN(CCNc1ccnc(O)c1[N+](=O)[O-])C(=O)C(N)=O 1106943535 OGJDSYQBPFJCPR-UHFFFAOYSA-N 297.271 -0.559 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](CC(N)=O)C1 1117572994 AJDONKOXHRLCAS-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD Cn1ncc(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)n1 1330100228 SXDNLPORRPGELV-UHFFFAOYSA-N 278.228 -0.968 5 20 CBBD C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1nncn1C 1338859701 BIPSIQLCXNMALP-ZCFIWIBFSA-N 279.260 -0.020 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@H]2CC[C@@H](C1)N2 1345993230 OFNMEFDRSLMNIH-BDAKNGLRSA-N 280.288 -0.461 5 20 CBBD O=C(O)C[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 129302356 HUFCSAGHXNTXQW-QMMMGPOBSA-N 298.255 -0.507 5 20 CBBD CC(C)N(CCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 174659007 RSKRPQLCJZKAAY-LLVKDONJSA-N 272.305 -0.145 5 20 CBBD COC(=O)[C@H](O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 217694840 NRJZEPGEXZHORA-SNVBAGLBSA-N 282.252 -0.213 5 20 CBBD CCOC(=O)c1ccnc(N2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 277552345 XUJGWQXORJTXHH-DTORHVGOSA-N 297.267 -0.292 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@@H](CO)O1 349662448 BIFDMROFICCPTE-BDAKNGLRSA-N 296.283 -0.158 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[S@](=O)C1 350867742 NHGJZYJFUZOOHE-YIVBRQOJSA-N 284.297 -0.177 5 20 CBBD COC(=O)[C@@H](NC(=O)Cn1ncc([N+](=O)[O-])c1N)C(C)C 351913826 VYQRAOCNBMWBPR-VIFPVBQESA-N 299.287 -0.313 5 20 CBBD O=C(O)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 354172101 NEWPIXURLJBFNU-SSDOTTSWSA-N 283.244 -0.348 5 20 CBBD Nc1nccc(C(=O)N2CCC[C@](O)(CO)C2)c1[N+](=O)[O-] 571059748 DPTBTSVLCGZETB-GFCCVEGCSA-N 296.283 -0.469 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CN(C)CCO1 586799496 KKQNCYACKQSVNC-APPZFPTMSA-N 283.288 -0.233 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC1(CO)COC1 717622371 CZONJBSNMVTMOD-UHFFFAOYSA-N 269.257 -0.328 5 20 CBBD O=Cc1ccc(OCC(=O)NCC(=O)O)c([N+](=O)[O-])c1 738721861 PFMAFEKHGAQKGM-UHFFFAOYSA-N 282.208 -0.013 5 20 CBBD C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 746595822 HCCMTJQSAHOWEN-LURJTMIESA-N 256.218 -0.402 5 20 CBBD CC[C@@](C)(CC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 767056777 WUPHKKGDNPCAOX-JTQLQIEISA-N 285.260 -0.054 5 20 CBBD Cc1cc(C(=O)NCC(=O)NOCCO)ccc1[N+](=O)[O-] 787293323 XDTAOECMULETMR-UHFFFAOYSA-N 297.267 -0.327 5 20 CBBD CCn1ncn(NC(=O)c2cc([N+](=O)[O-])cnc2O)c1=O 816737507 PBTALGJLFCINCO-UHFFFAOYSA-N 294.227 -0.543 5 20 CBBD O=C(O)[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 819240063 GWEMNWRLLBZVFZ-VHSXEESVSA-N 284.272 -0.299 5 20 CBBD C[C@H](CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 827443078 YDRBSUDJFFMMPH-SCZZXKLOSA-N 286.288 -0.195 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@]3(CCNC3)C2)c1 923331666 MQHMXNHAXGKDQY-OLZOCXBDSA-N 295.343 -0.162 5 20 CBBD Cn1nncc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020139178 VGCTZQGIWWRBCS-YJFSRANCSA-N 294.315 -0.783 5 20 CBBD O=C(NC[C@H](O)C1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1344130046 VRSYWRUEKSGHSW-VIFPVBQESA-N 284.272 -0.165 5 20 CBBD C[C@H]1NCC[C@@H]1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1579500654 LNLQUODNWIIKNX-BDAKNGLRSA-N 280.284 -0.377 5 20 CBBD C[C@H](CCO)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 97440673 RXPMVWDLWYDFJD-KOLCDFICSA-N 272.305 -0.240 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCN(CC(N)=O)CC1 195340754 OTWCTMWGGSRYCU-UHFFFAOYSA-N 296.331 -0.273 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H](C(=O)O)O1 262179024 QJCSDOZESBQEGK-HTQZYQBOSA-N 298.255 -0.508 5 20 CBBD COC[C@@](C)(N)CNc1ncc([N+](=O)[O-])cc1C(N)=O 265283706 ZWALFRSZSFSSSA-NSHDSACASA-N 283.288 -0.136 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1ccc(O)c([N+](=O)[O-])c1 273865296 OSUGUUJQDHIQGB-QMMMGPOBSA-N 270.241 -0.274 5 20 CBBD CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CC(=O)NC1=O 299512862 JECMXZWVCOUOOZ-SSDOTTSWSA-N 295.255 -0.945 5 20 CBBD CN(C)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299535513 UATLHQZSRYHBDF-UHFFFAOYSA-N 268.273 -0.566 5 20 CBBD COCC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])cn1 336804759 KAJZHLLCJVZQBP-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1C=C[C@H](CO)C1 341732772 IOWDFSPMCLEFCT-DTWKUNHWSA-N 266.257 -0.156 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 353364293 NJRWGMMBBRMNPV-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)N1 393923162 CLPDPMACFPAHGP-SSDOTTSWSA-N 280.240 -0.625 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCc1cncnc1N 427436313 QUSQKPHIAXXVHH-UHFFFAOYSA-N 289.255 0.073 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O 436963413 CMUOHJSDKPSABV-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 547728769 DXJDKPYCPKQSSX-UHFFFAOYSA-N 281.272 -0.268 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCC2CC(O)C2)c1 578132344 YRSQYZLTOFVMBN-QEWOUOOISA-N 284.316 -0.097 5 20 CBBD CNc1nccc(C(=O)N[C@H]2CCOC2)c1[N+](=O)[O-] 594326179 MJETXZSSGCXVSD-ZETCQYMHSA-N 266.257 0.550 5 20 CBBD CN(c1ncc([N+](=O)[O-])c(N)n1)[C@H]1C[C@@H](C(N)=O)C1 599177935 AVAZRSMKGLJTKK-IZLXSQMJSA-N 266.261 -0.333 5 20 CBBD CO[C@]1(C(=O)O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 600869938 NQBWFHIYJZWGPW-LLVKDONJSA-N 298.255 -0.507 5 20 CBBD CS(=O)(=O)NC1CC(Nc2ncc([N+](=O)[O-])cn2)C1 619746076 RXXDEXYKYQPIBW-UHFFFAOYSA-N 287.301 -0.123 5 20 CBBD CN(CCNS(C)(=O)=O)c1ccc(N)c([N+](=O)[O-])n1 689751890 ONDOZLFNBYPRKF-UHFFFAOYSA-N 289.317 -0.443 5 20 CBBD CCNC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cn1 761975686 JZNCMXOZGVTCJZ-UHFFFAOYSA-N 296.239 -0.008 5 20 CBBD CN1C(=O)CN(NC(=O)c2cccc([N+](=O)[O-])c2N)C1=O 770453815 CVNIRBUINSRLQD-UHFFFAOYSA-N 293.239 -0.284 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)O1 808204763 PMHWODMBXCYJQR-RNFRBKRXSA-N 268.229 -0.389 5 20 CBBD C[C@@H](C(=O)O)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 817772429 ZEFAGJXHXAYJSU-CBAPKCEASA-N 272.261 -0.443 5 20 CBBD CC(C)(O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839666850 UWFIBYCHAQELGR-NXEZZACHSA-N 271.317 -0.433 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(Cc2nc[nH]n2)CC1 846527087 MPSAFMQUQAZTEW-RKDXNWHRSA-N 280.288 -0.886 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1nccc(N)n1 854761572 IMDHLMNVZQQVFE-FSDSQADBSA-N 251.246 -0.099 5 20 CBBD COC(=O)COC(=O)c1c([N+](=O)[O-])c(C)nn1C 920661666 WVROLJUHNNABFI-UHFFFAOYSA-N 257.202 -0.033 5 20 CBBD COCC(=O)N1CCC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1019012903 UQGQXIXTCBINPK-NXEZZACHSA-N 297.311 -0.641 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)Nn1cnnc1 1319878395 MQKSCUVJVHDSHL-UHFFFAOYSA-N 251.206 -0.457 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@H]1N 1579432209 XITCPVTVUHCHGL-RKDXNWHRSA-N 280.284 -0.438 5 20 CBBD COC(=O)[C@@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591230946 XKEFOMXPLVJHRP-SCSAIBSYSA-N 267.205 -0.295 5 20 CBBD O=C(O)C1(O)CN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 1601726679 XXBCLTCUPDAEJV-UHFFFAOYSA-N 286.215 -0.138 5 20 CBBD O=C(O)c1cn([C@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1602497497 WMYMGZNTFOUOBP-LKEWCRSYSA-N 295.255 -0.585 5 20 CBBD C[C@](CO)(NC(=O)CNc1ccccc1[N+](=O)[O-])C(=O)O 1604190375 GZCBPBSERSZHHV-GFCCVEGCSA-N 297.267 -0.042 5 20 CBBD O=C(NCc1cc[nH]n1)c1cc([N+](=O)[O-])c[nH]c1=O 40444930 AIOBCULOURDERZ-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CNCCO1 134252828 CSIBFVWZGBGGMT-SECBINFHSA-N 268.273 -0.349 5 20 CBBD CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CCNC1=O 281759004 IHKFRRLJOSJMBC-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD COCCN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 298690226 NQDWHWGIJCVTRG-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD Cn1nncc1C(=O)NCCn1cc([N+](=O)[O-])cn1 336965757 JLWBBSMPCAQTBD-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(N)=O 353001032 DWPJPZWYJUAGCW-SECBINFHSA-N 267.241 -0.521 5 20 CBBD CNC(=O)c1ccc(N2C[C@@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 355549359 VSLFCWCPFBKVSV-UWVGGRQHSA-N 295.295 -0.114 5 20 CBBD CNc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 393930297 JULQKRQNHRNDSL-VIFPVBQESA-N 293.283 -0.289 5 20 CBBD CO[C@]1(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])CCOC1 563391129 JIFZILSNIBHIFW-LBPRGKRZSA-N 296.283 0.107 5 20 CBBD CNc1nccc(C(=O)N(C)[C@@H]2CCNC2=O)c1[N+](=O)[O-] 565192954 XFEAFQSICBYMRX-MRVPVSSYSA-N 293.283 -0.008 5 20 CBBD CNc1nccc(C(=O)N(C)CCC(N)=O)c1[N+](=O)[O-] 574889090 PONVAVQLGNVRBD-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD CC[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 766973822 UJWNIGSTJQNKGH-ZCFIWIBFSA-N 256.218 -0.251 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@H]1CCCN(C(N)=O)C1 814042197 HVCIVECMHVIVRE-YUMQZZPRSA-N 259.262 -0.015 5 20 CBBD O=C(O)CNC(=O)COC(=O)Cc1cccc([N+](=O)[O-])c1 821531115 GCJJNTOXZYAKCF-UHFFFAOYSA-N 296.235 -0.119 5 20 CBBD Cc1nn(CC(=O)OCC(C)(C)[N+](=O)[O-])c(=O)n1C 851129566 JVHXGAKDWXXYMG-UHFFFAOYSA-N 272.261 -0.511 5 20 CBBD CN1CCC(N(CCO)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 911945396 JBFUTUVUERRZHY-GHMZBOCLSA-N 271.317 -0.433 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@@H]2C[C@@]2(CO)C1 1116942198 KNAIGJBLWSNEQD-WKEGUHRASA-N 252.230 -0.228 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@H](O)C1 1317990833 USEWSLRHIHQIPR-ZETCQYMHSA-N 255.234 -0.830 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCCN(C(N)=O)CC1 1318234212 GXYTXBFHWUXAPN-UHFFFAOYSA-N 268.277 -0.081 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(=O)OC 1324411895 NVFVFXMZDQLRIV-SNVBAGLBSA-N 297.267 -0.100 5 20 CBBD CC(C)(C)C(=O)NCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1329799499 KUDUONCJASNEQY-UHFFFAOYSA-N 298.303 -0.535 5 20 CBBD CO[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@](C)(C(=O)O)C1 1599135652 VRSACDWKQKNKTQ-NKIIXMILSA-N 272.257 -0.258 5 20 CBBD O=C(O)C[C@@H](O)Cn1cc([N+](=O)[O-])cc(F)c1=O 1610790589 BTTRMPSOKSEEJO-ZCFIWIBFSA-N 260.177 -0.269 5 20 CBBD O=C(O)[C@H](CO)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 22162071 FYHXCZGDBVUGTI-QMMMGPOBSA-N 290.253 -0.681 5 20 CBBD CN(C)c1nc(N)nc(Cn2cnc([N+](=O)[O-])c2)n1 26124099 YOMZQVAFNOVSCQ-UHFFFAOYSA-N 264.249 -0.327 5 20 CBBD Cc1nn(C)c(N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 43703233 DPWLRHNCZAQWSY-ZETCQYMHSA-N 270.245 -0.073 5 20 CBBD CCNC(=O)CN(CC)C(=O)Cn1ccc([N+](=O)[O-])n1 49179084 FBHVLSLHAUZATH-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD COC(=O)[C@@H]1C[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 122256475 LZNRYVDBWMXEHA-RKDXNWHRSA-N 282.256 -0.283 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC2OCCO2)c1=O 265813613 UBIIWLZEBYRFQN-UHFFFAOYSA-N 284.224 -0.084 5 20 CBBD CC(C)[C@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 269241028 CQBTYRUURQGKGZ-SNVBAGLBSA-N 282.300 -0.144 5 20 CBBD CC(C)[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 343485334 YVALGZNIWJXXNB-ZCFIWIBFSA-N 255.234 -0.442 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354726048 ULNPQLOCBZHEPQ-VDTYLAMSSA-N 284.228 -0.934 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N=c1nc[nH]n1C 355237896 KADJWKIKPSGJBD-UHFFFAOYSA-N 279.260 -0.321 5 20 CBBD COC(=O)[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 362664457 AUROMHUMVLOSPK-SNVBAGLBSA-N 282.256 -0.141 5 20 CBBD CCN1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C)C1=O 426343972 RWDXDWADTSVHFZ-MRVPVSSYSA-N 296.287 -0.735 5 20 CBBD CN1C(=O)CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1=O 550155570 RYHOAWMPWLJPJW-UHFFFAOYSA-N 292.251 -0.382 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc([N+](=O)[O-])o2)n1 590551726 SABPGWYZXVBUGC-UHFFFAOYSA-N 266.217 -0.139 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C)C[C@@H]2CN)c1[N+](=O)[O-] 592309014 NBZCPEFHMQMWPC-QMMMGPOBSA-N 282.304 -0.659 5 20 CBBD Nc1ccc(N2C[C@@H](O)C[C@@H]2CO)nc1[N+](=O)[O-] 596178834 LRSZSKVDNXIPNJ-RQJHMYQMSA-N 254.246 -0.496 5 20 CBBD Nc1ccc(C(=O)N2CC[C@@H](CO)[C@H](O)C2)cc1[N+](=O)[O-] 763269601 OTZNAZLKIPBCNB-JOYOIKCWSA-N 295.295 -0.008 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCOCCO 766968392 VJMJRAVZHPRRNC-UHFFFAOYSA-N 259.218 -0.506 5 20 CBBD O=C(O)C[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 819351432 KNQJCDOGIRTEEQ-MRVPVSSYSA-N 297.271 -0.100 5 20 CBBD C[C@@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820481674 XRALBQKAEYWHHK-RXMQYKEDSA-N 265.233 -0.037 5 20 CBBD COCCCN(CC[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 929970372 JVCAXCQBKJBERX-SNVBAGLBSA-N 280.346 -0.211 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCc1nc[nH]n1 1293424448 IPYFUYHOJOQSEO-UHFFFAOYSA-N 279.260 -0.423 5 20 CBBD Cn1cnnc1COC(=O)c1c([N+](=O)[O-])cnn1C 1320557487 OZEIGROZUKGMDO-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD Cc1nc(N2CCN(C)C[C@H]2CO)ncc1[N+](=O)[O-] 1348850224 JAWFCCITDTZTQO-VIFPVBQESA-N 267.289 -0.194 5 20 CBBD O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCNC[C@@H]1CO 1580474950 CYFBVZBNIYAJRW-NEPJUHHUSA-N 295.295 -0.579 5 20 CBBD NC(=O)[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCO1 50858672 BKYMDTLXUNBBJP-LLVKDONJSA-N 293.279 -0.150 5 20 CBBD Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])cnc2N)n1 230721311 FWWCDDGTCSRMBL-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD COC[C@H](CO)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 234817717 UWLYAVMHGGSONA-QMMMGPOBSA-N 290.297 -0.120 5 20 CBBD COCCNCCNC(=O)CCn1cc([N+](=O)[O-])nc1C 237276319 YFDXGSNDQVJSGB-UHFFFAOYSA-N 299.331 -0.158 5 20 CBBD CC(=O)N1CCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 269120843 SMRGIONVBGYAOO-LLVKDONJSA-N 295.299 -0.082 5 20 CBBD COC(=O)[C@H](C)N(C)c1ncc([N+](=O)[O-])c(N)n1 280941564 JKHVWAPGIZMCJZ-YFKPBYRVSA-N 255.234 -0.035 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285411752 UXHVYKYFOCGUCH-SECBINFHSA-N 281.272 -0.086 5 20 CBBD Cc1c(NC(=O)NC(CO)(CO)CO)cccc1[N+](=O)[O-] 294113286 DKXZZZYKSVTRIZ-UHFFFAOYSA-N 299.283 -0.260 5 20 CBBD CCN(C[C@@H](C)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 341333723 AOGOVJPUQNNWRP-SECBINFHSA-N 283.284 -0.014 5 20 CBBD CC[C@H](C)NC(=O)[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 344185664 QUUFANNQVPVDQP-YUMQZZPRSA-N 298.303 -0.394 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356486982 VWTNQJYLRUAVKN-LURJTMIESA-N 267.245 -0.711 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCCO 356500565 XYVRPTPWUITXFQ-UHFFFAOYSA-N 255.230 -0.745 5 20 CBBD CO[C@@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1 359474463 ZXEXSIXWYZOYLT-LLVKDONJSA-N 284.272 -0.287 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 440964162 NLPBFMHJEJIQKK-MNOVXSKESA-N 297.315 -0.637 5 20 CBBD CCc1[nH]nc(C(=O)N[C@]2(CO)CCOC2)c1[N+](=O)[O-] 444371673 MSEZJEHGLPVYQJ-NSHDSACASA-N 284.272 -0.239 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 444996607 BSIPMKPBHQHWBS-YFKPBYRVSA-N 268.229 -0.311 5 20 CBBD CCN1CC[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 591765803 IUHGJWGZRPYNKR-MNOVXSKESA-N 297.315 -0.637 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCOC2)n1 599321036 UTWXBTIWWXOJTK-UHFFFAOYSA-N 262.247 -0.693 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H](O)C[C@@H](O)C1 610588331 ZOWIIKNKMOZGMO-OCAPTIKFSA-N 282.256 -0.979 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1(C(=O)O)CCCC1 610853235 XBIZHTSPRKSEAE-UHFFFAOYSA-N 297.271 -0.053 5 20 CBBD CCNC(=O)CC(=O)OCCn1ccc([N+](=O)[O-])n1 782345517 URNUSNWZEZOFHT-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD Cn1nncc1C(=O)OCCn1cc([N+](=O)[O-])cn1 798798117 JTLWOWYQURHMHU-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC[C@@H](CO)C1 823620022 GPQLTGCQBWFFBO-SSDOTTSWSA-N 291.271 -0.012 5 20 CBBD Cn1nccc1C(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 848697996 CVAWEHBVUCUPDY-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD COCCn1cc(C(=O)OCCC[N+](=O)[O-])nn1 860918698 DBMSTWKTEPLOMF-UHFFFAOYSA-N 258.234 -0.252 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@H]3NCC[C@@H]3C2)c1 923360129 WIEXXRIYPPFYGV-RTXFEEFZSA-N 295.343 -0.164 5 20 CBBD O=C(NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCC1 1057543743 WCOFAXDFVNDNCH-GHMZBOCLSA-N 299.327 -0.611 5 20 CBBD CCCN(CCNC(=O)C(N)=O)c1ncccc1[N+](=O)[O-] 1101227371 JAGSPQDTFFNNKD-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 1118317611 RLHPCHYLCBVUAY-VXNVDRBHSA-N 296.283 -0.543 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CC[C@H]2O)c1[N+](=O)[O-] 1184392202 CBERDIWCDKWNFM-RNFRBKRXSA-N 254.246 -0.110 5 20 CBBD Cc1[nH]nc(C(=O)N2CCCO[C@H](CN)C2)c1[N+](=O)[O-] 1261474419 CWXPLMXIIUPMFW-MRVPVSSYSA-N 283.288 -0.184 5 20 CBBD CC(=O)N1CC[C@@H](CN(C)c2nnc(C[N+](=O)[O-])n2C)C1 1262864928 UXVQOITVKCAVRG-JTQLQIEISA-N 296.331 -0.104 5 20 CBBD CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])cnc1O 1317981471 UYGAFCVBRIHYMH-UHFFFAOYSA-N 254.202 -0.747 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@]1(O)CCOC1 1319585808 JQDAWQCZAZGXFE-NSHDSACASA-N 284.272 -0.633 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ncnn1C 1338899447 LBVOPYUUBAKROX-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD O=C(O)C[C@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601965761 PQQFYZNSOSMRKZ-LURJTMIESA-N 284.228 -0.366 5 20 CBBD C[C@H](O)[C@H](O)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603694203 QGQGWWXFAAZHEF-QUBYGPBYSA-N 294.271 -0.072 5 20 CBBD C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N(C)C 76268153 JGOIZDACDSABAR-RXMQYKEDSA-N 254.250 -0.144 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCC(=O)N(C)C1 134045767 QUOOJBSPNUNXIS-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1CCCN1 178779184 GAXHOPKYASRBJD-SECBINFHSA-N 280.284 -0.375 5 20 CBBD COC(=O)[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 276506467 YVEGYALLLOLGFO-WDEREUQCSA-N 298.299 -0.307 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](CO)C(N)=O 341746660 LCQZXTBXDSKEDF-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCN(C(=O)CO)CC1 361063153 OJWRTYWNHFCGEF-UHFFFAOYSA-N 297.315 -0.239 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCNC1 428184411 MMPHIYSBOWEGOR-MRVPVSSYSA-N 266.257 -0.765 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CN(C)NC2=O)c1 450613157 SSGNXEHRDLSCHK-SECBINFHSA-N 278.268 -0.022 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 555316938 FNOOAXBJTJLCHY-NSHDSACASA-N 281.272 -0.084 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594348057 PHECKKWXMJAPTO-MADCSZMMSA-N 296.283 -0.158 5 20 CBBD Cc1ncc(C(=O)NCCn2cc([N+](=O)[O-])cn2)c(N)n1 597411205 VGWCLPBDDNKHOX-UHFFFAOYSA-N 291.271 -0.098 5 20 CBBD CC(C)(C(=O)NC[C@@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1 597587569 YUQLQCCVVBCLSN-SNVBAGLBSA-N 295.295 -0.165 5 20 CBBD Cc1[nH]nc(C(=O)N2CCOCCN2)c1[N+](=O)[O-] 597707596 OARIDHRVNLCFEN-UHFFFAOYSA-N 255.234 -0.397 5 20 CBBD O=C1NC(=O)[C@H]2CN(c3ccc([N+](=O)[O-])cn3)C[C@@H]12 599084759 XETPSQXZBOOMNL-OCAPTIKFSA-N 262.225 -0.301 5 20 CBBD COC(=O)COCCNc1ncc([N+](=O)[O-])cc1C(N)=O 599156514 KFMBWZXYHRLVFL-UHFFFAOYSA-N 298.255 -0.310 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@H]1CO 698122678 INNPDIKVUDCJSW-DTWKUNHWSA-N 269.257 -0.499 5 20 CBBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NOCCO 787293876 MHLKTIPUNZZSTJ-UHFFFAOYSA-N 280.240 -0.015 5 20 CBBD CC(C)(CO)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 917497543 RNJOVQICSDEMNG-UHFFFAOYSA-N 269.257 -0.126 5 20 CBBD Cn1cccc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991281535 USDBATYYNQNCMT-MWLCHTKSSA-N 292.295 -0.369 5 20 CBBD O=C(NC1CNC1)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1117981084 QVKLMFKLVHTBNA-UHFFFAOYSA-N 290.279 -0.475 5 20 CBBD C[C@@H](CCS(C)(=O)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1321426913 OEDGXDQYQPTVQM-LURJTMIESA-N 290.301 -0.129 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@]2(O)CCO[C@H]2C)c1[N+](=O)[O-] 1321428862 CIBLZHQVGMAAOW-UFBFGSQYSA-N 298.299 -0.094 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1nnc(C[N+](=O)[O-])n1C 1350597836 JHAZPCMPLZBNSA-SSDOTTSWSA-N 268.277 -0.741 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCNC[C@H]1CO 1358026003 CCMHSLSLMRYHGO-LBPRGKRZSA-N 279.296 -0.070 5 20 CBBD O=C(NC[C@@H](C(=O)O)[C@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1608418831 TWENINXTICDJBE-NKWVEPMBSA-N 298.255 -0.215 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1OC 122029648 AMNFHRIJRHDGPS-MRVPVSSYSA-N 298.251 -0.133 5 20 CBBD O=C(O)C[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 129302597 HUFCSAGHXNTXQW-MRVPVSSYSA-N 298.255 -0.507 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1CCNCC1 178404091 OKQOEVYIPSXZOY-UHFFFAOYSA-N 267.289 -0.093 5 20 CBBD C[C@@H](CO)N(C[C@@H](C)O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 279150727 ZKWXOESKWDSAOT-JGVFFNPUSA-N 299.283 -0.101 5 20 CBBD C[C@@]1(C(N)=O)CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 280676929 GIMXGGPDVFKEOQ-CYBMUJFWSA-N 294.311 -0.046 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H](CO)C2)c1 304380526 YFEHPDRWCVORFL-JQWIXIFHSA-N 284.316 -0.144 5 20 CBBD C[C@H]1OCC[C@@]1(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330865042 YTFFIMAEERPDAZ-GMSGAONNSA-N 269.261 -0.130 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1(C(=O)O)CCC1 345903800 ZYAIBYUCJZNOBO-UHFFFAOYSA-N 269.217 -0.690 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[S@]1=O 352258660 ZGIMARYTQFPCQY-QQOXFEPMSA-N 271.302 -0.076 5 20 CBBD C[C@H](CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362604343 SCTCETFSHWSWKV-ZCFIWIBFSA-N 271.233 -0.635 5 20 CBBD COC(=O)[C@H]1C[C@H](OC)CN1c1ncc([N+](=O)[O-])c(N)n1 372787260 WDLYHXNGTGQNEO-NKWVEPMBSA-N 297.271 -0.266 5 20 CBBD Cc1nn(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c(=O)s1 424144795 YDDOJDMNFHWBJB-MRVPVSSYSA-N 285.285 -0.221 5 20 CBBD O=c1scnn1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 424145963 ZZOIWCCCDUKAEY-SSDOTTSWSA-N 271.258 -0.529 5 20 CBBD O=C(NC[C@H]1CNCCO1)c1cc([N+](=O)[O-])n[nH]1 582419755 FVRJPUOVYYTURX-ZCFIWIBFSA-N 255.234 -0.964 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2CCOC2)c1[N+](=O)[O-] 594326178 MJETXZSSGCXVSD-SSDOTTSWSA-N 266.257 0.550 5 20 CBBD C[C@](O)(CNc1ccc(N)c([N+](=O)[O-])n1)C(=O)O 595968076 DRHQCOKDNXZIKU-VIFPVBQESA-N 256.218 -0.181 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])ncn2C)CCC1=O 596493368 NXEFPGVSBLHCTR-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](CO)C1CC1 778706215 XJXKFXKTRXRUOL-SNVBAGLBSA-N 283.288 -0.139 5 20 CBBD O=C(O)[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 819240061 GWEMNWRLLBZVFZ-NXEZZACHSA-N 284.272 -0.299 5 20 CBBD O=C(O)C[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 833220199 VMCICTOHUDAAGY-JTQLQIEISA-N 284.272 -0.033 5 20 CBBD CS(=O)(=O)N[C@H]1CCCN(CC[N+](=O)[O-])C1 929470723 GLXTYGDGUJSIAF-QMMMGPOBSA-N 251.308 -0.723 5 20 CBBD Cn1cc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1020139325 XKPBBTCOFPWROY-YJFSRANCSA-N 294.315 -0.783 5 20 CBBD CCC(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1099902526 ASKCQIUHRAOVGC-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC(C(N)=O)CC2)c1[N+](=O)[O-] 1115917632 WSLURDPAZIGQME-UHFFFAOYSA-N 281.272 -0.036 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)C1(CO)CC1 1118763982 OMAUORYNDKAUFE-UHFFFAOYSA-N 254.246 -0.075 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NN1CCCC1=O 1325092444 YGJOAVBKDJNZAD-UHFFFAOYSA-N 280.240 -0.590 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2ccnc(O)c2[N+](=O)[O-])C1 1328010652 ROIBMMQFXAASEX-ZCFIWIBFSA-N 288.285 -0.437 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN2C(=O)CC[C@@H]2C1 1339456551 PDVUNDQRXJIHMW-SECBINFHSA-N 294.315 -0.114 5 20 CBBD NCC(=O)NCC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1345780795 ISXXFUFMMFFEOA-UHFFFAOYSA-N 278.268 -0.488 5 20 CBBD COC[C@]1(C(=O)O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1593963386 DKBUCXDRZXLZLX-XLDPMVHQSA-N 272.257 -0.399 5 20 CBBD C[C@H](N)C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 40834910 DNKGUWVWYZALEV-VIFPVBQESA-N 279.300 -0.014 5 20 CBBD Cn1cnc([N+](=O)[O-])c1Nc1cnn(CC(N)=O)c1 48836651 RBTGFOOLHNWYPE-UHFFFAOYSA-N 265.233 -0.246 5 20 CBBD COc1ccc(C(=O)NC[C@H](O)C(=O)O)cc1[N+](=O)[O-] 90261638 DENNZKWXRWUKSQ-QMMMGPOBSA-N 284.224 -0.221 5 20 CBBD CN1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 172489590 JYUQKJQMTKHUKF-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@H]1CC[C@H](C(N)=O)O1 268317383 LVAVMOUEFZSSIL-RNFRBKRXSA-N 269.261 -0.227 5 20 CBBD COc1ccc(C(=O)NCCOCC(N)=O)cc1[N+](=O)[O-] 268647904 QUSGURQUUAOOIJ-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)CO 292098705 GDUIZOIPEKVSIF-KOLCDFICSA-N 272.305 -0.145 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@H](CCO)C1 330529582 FTGLDNPNDPARRN-SNVBAGLBSA-N 295.295 -0.013 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H](CO)[C@@H]1CCCO1 344844276 HVCUHRBXBLLZSX-MNOVXSKESA-N 298.299 -0.163 5 20 CBBD Cc1cc(=O)n(CCN2C(=O)CNC2=O)cc1[N+](=O)[O-] 353825064 JSPOPCVPWWUQPL-UHFFFAOYSA-N 280.240 -0.383 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356551467 BJILGCHNYJYTKO-ZETCQYMHSA-N 283.288 -0.075 5 20 CBBD CCN1C[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 391568002 BYGOBVWWGMJEMN-KOLCDFICSA-N 297.315 -0.637 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 593176007 OSOJFEZVTYMDIR-KNVOCYPGSA-N 279.256 -0.203 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)CCO)c1[N+](=O)[O-] 594319120 WFUFSMIGATVRFM-ZETCQYMHSA-N 268.273 0.532 5 20 CBBD COC(=O)[C@H]1C[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 596066259 AREXGPKOWWZXOO-FXPVBKGRSA-N 298.299 -0.307 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])ncn2C)[C@@H](CO)C1 601980402 VLFMOANIIRLMRV-MRVPVSSYSA-N 255.278 -0.559 5 20 CBBD CNC(=O)CCN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 619260323 UZXGWPBQZLUJML-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)Nn2cnnc2O)n1 757671293 JLUTWVLTEZCADK-UHFFFAOYSA-N 267.205 -0.508 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(=O)N(C)C[C@@H]2C)c1[N+](=O)[O-] 782888767 YCRVWLVBZCJRLB-ZETCQYMHSA-N 295.299 -0.061 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H](O)CO)c1 843064565 ZIBTVPFIKWJUDG-GHMZBOCLSA-N 256.258 -0.429 5 20 CBBD CCN1CC[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 849676877 KNVLTRCUNVZDER-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD O=C(NCC1CN(Cc2csnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031662051 RTUGKJJAIODSBQ-NXEZZACHSA-N 297.340 -0.249 5 20 CBBD NCc1ccccc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1118082143 PVQSFEURBYNDLN-UHFFFAOYSA-N 290.283 -0.039 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411993 UMIIDDZWZQNWRM-QMMMGPOBSA-N 297.267 -0.176 5 20 CBBD NS(=O)(=O)CCCn1cccc([N+](=O)[O-])c1=O 1318482128 YFWOJTDKSZNZME-UHFFFAOYSA-N 261.259 -0.565 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](CO)C1 1319526945 HTPAAZIROLDGJT-SECBINFHSA-N 268.273 -0.059 5 20 CBBD COC(=O)C1(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)CC1 1591242248 LKYQLCRNIFXUAE-UHFFFAOYSA-N 293.243 -0.075 5 20 CBBD CS(=O)(=O)NCCNc1ccc([N+](=O)[O-])cn1 30546987 GZMPETOYIJAOPC-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1csc([N+](=O)[O-])c1 37563192 IWUOVNIWOKLVJO-RXMQYKEDSA-N 260.227 -0.168 5 20 CBBD Cc1nnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)[nH]1 112703062 OICHWVZIYQOFSG-UHFFFAOYSA-N 251.206 -0.143 5 20 CBBD CNC(=O)CN1CCN(c2ncc([N+](=O)[O-])s2)CC1 190315628 JAVAXDPXVATVLV-UHFFFAOYSA-N 285.329 -0.081 5 20 CBBD Nc1c([N+](=O)[O-])cnn1CCCN1C(=O)CNC1=O 340076954 NQJNUMRZIBPYOH-UHFFFAOYSA-N 268.233 -0.685 5 20 CBBD N[C@H]1CCC[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 446400410 JXPVBOZMARJSMW-YUMQZZPRSA-N 268.277 -0.428 5 20 CBBD CN1C[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])C(=O)N1 538681136 RPFDJZDLDGDDHQ-MRVPVSSYSA-N 264.241 -0.330 5 20 CBBD C[C@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1C 743272047 MANSSKMJJGVFOF-CMPLNLGQSA-N 283.332 -0.212 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 758280066 VTZRHBJTOFSJHD-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](O)C(=O)NC 795174199 UNSLVUMXILOWSU-ZETCQYMHSA-N 271.277 -0.362 5 20 CBBD CC(C)(COC(=O)CCCN1C(=O)CNC1=O)[N+](=O)[O-] 851122838 JYQXGQRSXVCOHM-UHFFFAOYSA-N 287.272 -0.083 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)c1cnc(O)c([N+](=O)[O-])c1)C2 861869925 PAIRNZCBDPYTRQ-POYBYMJQSA-N 279.208 -0.165 5 20 CBBD Cc1nonc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031661893 MFIVYVSPLONMFT-MWLCHTKSSA-N 295.299 -0.409 5 20 CBBD CNC(=O)CC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1 1093568336 XMBAHEZLDHXZMG-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD C[S@](=O)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1321219415 ABYWINUCBSTYGG-SFHVURJKSA-N 272.286 -0.041 5 20 CBBD O=C(NCCN1CC=CC1)c1c[nH]nc1[N+](=O)[O-] 1325233798 OBPDSRWPFTZSMI-UHFFFAOYSA-N 251.246 -0.081 5 20 CBBD O=C(O)CCNC(=O)Cn1cc([N+](=O)[O-])cc(F)c1=O 1608729888 AJLVNSKUQRYBTQ-UHFFFAOYSA-N 287.203 -0.514 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1cc([N+](=O)[O-])c[nH]1 85848239 UESANDCJKNOFNG-JTQLQIEISA-N 269.213 -0.104 5 20 CBBD CCC1(O)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 89648671 DZYPLTJAZCYSAJ-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD COCCCNC(=O)CN(C)c1c([N+](=O)[O-])ncn1C 139985926 AYBSYEZLZJBESP-UHFFFAOYSA-N 285.304 -0.083 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1 227840406 ZJWMUDRHOOFMEO-MRVPVSSYSA-N 268.229 -0.438 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC[C@H](O)C(=O)O 236080250 ISFVSZQUDDJBMR-QMMMGPOBSA-N 271.229 -0.501 5 20 CBBD CN1C[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]2C1 279183387 IYVROWDLRXXOAR-AOOOYVTPSA-N 279.300 -0.189 5 20 CBBD O=C1N[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@@H]2CO1 285898275 JLWGDOBRWFVXAO-RQJHMYQMSA-N 295.255 -0.112 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 291104930 GCLWFUWOKJIAQC-IUCAKERBSA-N 270.245 -0.679 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c3nonc23)CCO1 299472679 SFFGJYLYBNYUSS-MRVPVSSYSA-N 293.239 -0.179 5 20 CBBD Cn1c(C(=O)NCCc2nnc(N)o2)ccc1[N+](=O)[O-] 355119245 VLMXNERCAGMWHK-UHFFFAOYSA-N 280.244 -0.129 5 20 CBBD NC(=O)c1cc(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)on1 489618662 OCJXNZAMNLDMRQ-UHFFFAOYSA-N 279.212 -0.060 5 20 CBBD COCCNCC(=O)NCCn1cc([N+](=O)[O-])cn1 583629711 YQMHPRXCKNTQPH-UHFFFAOYSA-N 271.277 -0.857 5 20 CBBD O=C1CN(CCCNc2ccnc(O)c2[N+](=O)[O-])CCN1 596173365 USSGVDRYUASPLU-UHFFFAOYSA-N 295.299 -0.071 5 20 CBBD O=C1CC(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)=NN1 732290875 GKBSRMXZQRIGRM-UHFFFAOYSA-N 292.251 -0.034 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1CN(C(=O)O)C1 740229529 UWUOCPNYATUENT-UHFFFAOYSA-N 297.271 -0.032 5 20 CBBD CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])n1C 761055378 PGTGNTFBUHOHDE-LURJTMIESA-N 298.255 -0.066 5 20 CBBD C[C@@H]1NCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1C 923344755 IIYNARTXNAMHSO-HOSYDEDBSA-N 283.332 -0.166 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ncc[nH]1 974104048 GGSPMAMWOBQKQT-BZNPZCIMSA-N 293.283 -0.548 5 20 CBBD O=C(NCC1CN(Cc2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031661015 JYKAVPXGUBLMDC-GHMZBOCLSA-N 280.284 -0.112 5 20 CBBD O=C(CNC(=O)c1c[nH]nc1[N+](=O)[O-])NCC(F)F 1325278088 QYRMPSRFACFELR-UHFFFAOYSA-N 277.187 -0.571 5 20 CBBD C[C@@](O)(CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)O 1603256467 QPGYSDWCPIFGKQ-BXKDBHETSA-N 298.251 -0.420 5 20 CBBD CC(C)(CCC(=O)N1CC[C@](O)(C(=O)O)C1)[N+](=O)[O-] 1603592345 ZBEJYYFWEFDNCT-LLVKDONJSA-N 274.273 -0.130 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1nccc1[N+](=O)[O-] 48706118 PRLNKMXXNDMNCL-ZETCQYMHSA-N 285.260 -0.348 5 20 CBBD CN(C)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 143071952 SCHUGFZRJNOROY-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])s1 193689175 KSIYUCDJSXWBAQ-UHFFFAOYSA-N 279.299 -0.325 5 20 CBBD CN(CC(N)=O)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 264584361 MENGSMXGCYFFQY-UHFFFAOYSA-N 295.251 -0.270 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NCC(=O)NCCO 288287423 BLXSGTJLEWEMMU-UHFFFAOYSA-N 271.277 -0.360 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CCO1 330827022 QRQVHWLVHMQGMU-VIFPVBQESA-N 296.283 -0.480 5 20 CBBD O=C(CNC(=O)c1n[nH]cc1[N+](=O)[O-])NCc1ccco1 343109521 UJBZZOLAQDILCU-UHFFFAOYSA-N 293.239 -0.043 5 20 CBBD O=C(CN1CCCNC1=O)NCCn1cc([N+](=O)[O-])cn1 532680955 HLQJQBLMFPSBBB-UHFFFAOYSA-N 296.287 -0.677 5 20 CBBD CC(C)(C)[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(N)=O 566690635 DKLNXFMGJBEIHX-ZCFIWIBFSA-N 269.261 -0.052 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](CO)C1 699456810 FNKNRNGZCSFTLK-VIFPVBQESA-N 282.300 -0.318 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC(=O)N1CCC1 746953420 JTHYBZPZPCPRSK-UHFFFAOYSA-N 268.229 -0.433 5 20 CBBD COCCOCC(=O)OCCn1ccc([N+](=O)[O-])n1 748118760 PDQUTVDWCUYIMF-UHFFFAOYSA-N 273.245 -0.003 5 20 CBBD Nc1ccc(C(=O)NCCn2cnnn2)cc1[N+](=O)[O-] 807918605 XFDNGJSAVDIHTP-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD Cc1cc(C(=O)NCCn2cnnn2)c(N)c([N+](=O)[O-])c1 816288852 KKAWWWKNMGJLEI-UHFFFAOYSA-N 291.271 -0.098 5 20 CBBD COCC(=O)N1[C@H]2CC[C@H]1CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 968294855 MOJNQQPYTGOYMV-UKKRHICBSA-N 297.311 -0.500 5 20 CBBD O=C(NC[C@@H](O)C1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1116413640 RQSRQQKTCAORRA-SECBINFHSA-N 284.272 -0.165 5 20 CBBD CON1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1118713700 QUHSNFKUAQTAHJ-UHFFFAOYSA-N 255.234 -0.363 5 20 CBBD NC(=O)N1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1257428319 QUSCQNUGLXVULH-UHFFFAOYSA-N 282.260 -0.456 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1335382600 PCWBMSLQFKPHBM-ZETCQYMHSA-N 299.287 -0.225 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@]1(C)CNCCO1 1579869197 UPRPDLRVGAOASB-LBPRGKRZSA-N 297.315 -0.406 5 20 CBBD CCCNC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603076 CQTWXBZQEDQCPG-UHFFFAOYSA-N 256.222 -0.578 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NN1CCOCC1 114876709 VKDGPEAYCYBDHL-UHFFFAOYSA-N 283.288 -0.147 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)Cn1ccc([N+](=O)[O-])n1 188486165 MLDCUCOWEFGXPM-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD NC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 227830011 YLRROQWZILPVSO-MRVPVSSYSA-N 270.201 -0.239 5 20 CBBD COC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 234843455 IMSAAWCTXOLFNL-ZCFIWIBFSA-N 271.229 -0.568 5 20 CBBD Cn1c(C(=O)NC[C@@H]2COCCN2)ccc1[N+](=O)[O-] 236080186 CGQPICITYHTLDE-MRVPVSSYSA-N 268.273 -0.349 5 20 CBBD COC(=O)[C@@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247498736 LMMJMIXODWYVBG-MNOVXSKESA-N 298.299 -0.210 5 20 CBBD COC(=O)[C@H](C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 263796382 KWBNNJHHSJYUCG-SSDOTTSWSA-N 270.245 -0.283 5 20 CBBD O=C(NCCN1CCCOCC1)c1cc([N+](=O)[O-])[nH]n1 286781092 MKVQPWSQCLSGGB-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD CCc1nn(C)c(N2CCN[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 288178482 QXERBONBHXDVFR-MRVPVSSYSA-N 282.304 -0.846 5 20 CBBD COC(=O)Cn1cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 350660368 NBTAGSPKKSILMQ-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD NC(=O)CNC(=O)CNc1ccccc1[N+](=O)[O-] 354168536 YOSYWLYTEPSJBO-UHFFFAOYSA-N 252.230 -0.392 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@H](O)C[C@H]1CO 364316188 RSVORMCKAUDIHQ-DTWKUNHWSA-N 282.252 -0.132 5 20 CBBD CN1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C(=O)N1 393943978 CMXFABMMNSTIFZ-SSDOTTSWSA-N 279.256 -0.748 5 20 CBBD COCCN1CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 564188825 PUQHZCLKJOXOKF-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN([C@@H]3COC[C@H]3O)CC2)cn1 564668670 ISJDTDANNNCHKG-VXGBXAGGSA-N 294.311 -0.129 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H]2CNC[C@@H]21 564957088 YVSTVQZRNGRVCV-ZJUUUORDSA-N 279.300 -0.080 5 20 CBBD CCOC(=O)[C@@](C)(O)CNc1ccc(N)c([N+](=O)[O-])n1 596198890 NCVMLZLOKMDFMT-NSHDSACASA-N 284.272 0.298 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CNC[C@H]3C2)c1 610336111 KHAMQPCWBTWWGP-JBLDHEPKSA-N 281.316 -0.697 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cn1 617711177 HZIHRLHDFCHZMB-SECBINFHSA-N 281.224 -0.085 5 20 CBBD CCS(=O)(=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 741118578 LUCOXHBQEUHJKM-UHFFFAOYSA-N 276.274 -0.353 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)O[C@@H]1CCCNC1=O 767289973 AWKYNICWAZXWCR-SSDOTTSWSA-N 268.229 -0.387 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1C 798128535 YPBOLGJREGVEAH-NSHDSACASA-N 295.295 -0.331 5 20 CBBD CC[C@H](CNS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783926 MXGZZIMDYSOPTB-BWZBUEFSSA-N 279.318 -0.904 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 863018300 SRZQAYCZAKGRPB-QMMMGPOBSA-N 297.267 -0.169 5 20 CBBD COCCCN(CC[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 929970363 JVCAXCQBKJBERX-JTQLQIEISA-N 280.346 -0.211 5 20 CBBD O=C(NCC1=CCN(CCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1000675836 WRMYRCJPZRBKJY-VXGBXAGGSA-N 283.328 -0.218 5 20 CBBD O=C(NCCC1(O)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1117456255 GSORCIQNMCIEBD-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD CCc1noc(COC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1317941850 KPVJCRBZCCSHJO-UHFFFAOYSA-N 282.216 -0.125 5 20 CBBD O=C(CNC(=O)c1ccccc1[N+](=O)[O-])NCCO 1319262636 IFPQREZAQRPNLF-UHFFFAOYSA-N 267.241 -0.567 5 20 CBBD Cc1nn(C)c(C(=O)N[C@]2(CCO)CCOC2)c1[N+](=O)[O-] 1320993780 IKOSUZXRQJRVCC-GFCCVEGCSA-N 298.299 -0.092 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCn2cnnc2C1 1326776609 MEXYCNULDFACSS-UHFFFAOYSA-N 277.244 -0.575 5 20 CBBD COc1ccc(CC(=O)N[C@H](CO)C(=O)O)cc1[N+](=O)[O-] 1607241994 SWDHZYVDQNYRRO-MRVPVSSYSA-N 298.251 -0.292 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C(N)=O)O1 122593995 FOIZAYJWQZUHNX-SCZZXKLOSA-N 283.288 -0.634 5 20 CBBD NC[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 160353235 CVYVBYQYCSEILE-SECBINFHSA-N 280.284 -0.294 5 20 CBBD CC(C)(C)[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 173343301 KQGGEECLPNTXGR-UWVGGRQHSA-N 299.331 -0.358 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCCNC1 178392263 CRBUHRYIRSHQPL-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD C[C@@]1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 267225414 JXWYYFBFELMUEK-GFCCVEGCSA-N 281.268 -0.260 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 341748475 QYVOIZOKXWHFBO-MRVPVSSYSA-N 293.239 -0.953 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C(F)F 355133035 AXQWGGNYNRCLAG-SSDOTTSWSA-N 278.215 -0.076 5 20 CBBD O=C(N[C@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])cnc1O 359445006 WCVMEEIHJAYYKA-INMOSUBGSA-N 285.281 -0.054 5 20 CBBD CCN1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 452992352 NWMSYTFVZZUHFY-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD C[C@@H](C(=O)NCC(=O)NCCO)c1cccc([N+](=O)[O-])c1 583237866 IIRTXVVGNFMTSJ-SECBINFHSA-N 295.295 -0.077 5 20 CBBD COC[C@H]1C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 593067056 SLWRDLKAOZRQJO-NXEZZACHSA-N 270.289 -0.127 5 20 CBBD CCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H](C)C(=O)O 595999950 IVJVTZFACHANEV-LURJTMIESA-N 271.233 -0.492 5 20 CBBD NC(=O)NCCNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 738441503 XSBVSINUJITXGU-UHFFFAOYSA-N 296.239 -0.309 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)[C@@H]1CCCO1 862656473 DNYYZXADZZJZBK-ZJUUUORDSA-N 296.283 -0.158 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@H](O)C1 863832800 FGBUOEXPMTVGOH-VIFPVBQESA-N 295.299 -0.632 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CC[C@H](C2)N3)c1 923410084 FDGWHEFTOKSZPA-JFGNBEQYSA-N 281.316 -0.412 5 20 CBBD NC(=O)C(=O)NC/C=C\CNc1ncccc1[N+](=O)[O-] 1107480654 PPHWVSZEGYIFPT-UPHRSURJSA-N 279.256 -0.441 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC(N)=O 1318834096 WMISJZPIBQPFOR-UHFFFAOYSA-N 255.234 -0.909 5 20 CBBD CC(C)N(C)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1327322287 NXENDVNXCZULRV-UHFFFAOYSA-N 283.288 -0.226 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCN2CC[C@H]1C2 1329321530 OBMOUUCAOXSFCK-JTQLQIEISA-N 292.295 -0.327 5 20 CBBD C[C@@](O)(CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)O 1603256469 QPGYSDWCPIFGKQ-JOYOIKCWSA-N 298.251 -0.420 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCS(=O)CC2)c1 75720693 KPGOPLAPFRQCHW-JTQLQIEISA-N 288.329 -0.784 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 103950213 FNVZANLUGUGQLW-LLVKDONJSA-N 295.299 -0.226 5 20 CBBD CCCNCCNC(=O)Cn1cc([N+](=O)[O-])cn1 179267661 LTWFAXSFIFUXOK-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CCC(=O)NC1 264153718 SPMRPAJLCMPMIX-ZCFIWIBFSA-N 279.256 -0.221 5 20 CBBD NC(=O)[C@]1(O)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1 277108988 XSLXWGYGAWVLAM-NSHDSACASA-N 293.239 -0.443 5 20 CBBD Cn1c(C(=O)N2CC[C@H](C(N)=O)C2)ccc1[N+](=O)[O-] 339672623 YVCUEVJNRNPRFA-ZETCQYMHSA-N 266.257 -0.119 5 20 CBBD NC(=O)[C@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1F 341747974 OJLUBRJMQKXILV-VIFPVBQESA-N 285.231 -0.761 5 20 CBBD COCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 343289634 CHGRJJGVGUUUQK-QMMMGPOBSA-N 296.283 -0.203 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 354343873 DEKHSTICKVOAQR-SSDOTTSWSA-N 283.240 -0.559 5 20 CBBD COC(=O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 357327014 RKPVWSFCVFLOAD-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD O=C1NC[C@@H]2[C@H]1CCCN2C(=O)Cn1cc([N+](=O)[O-])cn1 366895401 XCTSDNRDDNVISA-NXEZZACHSA-N 293.283 -0.472 5 20 CBBD NCC1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 428807293 ZSMDDPBLLJCAHX-UHFFFAOYSA-N 267.289 -0.011 5 20 CBBD COC(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 494300530 UQCVRRKPPFGJFQ-UHFFFAOYSA-N 283.244 -0.158 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O 566460407 KELZZIZTRONPNX-MRVPVSSYSA-N 293.235 -0.213 5 20 CBBD CN(CC(C)(C)N)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 595961387 LGHOPYWJPONODT-UHFFFAOYSA-N 282.300 -0.048 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H](C)C(=O)NC(N)=O 744661372 HFKDEIABZWLVPU-YFKPBYRVSA-N 299.243 -0.774 5 20 CBBD C[C@H](OC(=O)c1c(N)cccc1[N+](=O)[O-])C(=O)NC(N)=O 778145086 NZTGEKGPSANERU-YFKPBYRVSA-N 296.239 -0.083 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 782881837 KVYCWJMAKIHUOA-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](c2nc[nH]n2)C1 819722689 QYHCYGFGEPVHIA-BWZBUEFSSA-N 251.246 -0.214 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@@H]1O 824999988 LYXYBFKZBCJCDO-RCOVLWMOSA-N 291.271 -0.013 5 20 CBBD O=C(O)[C@@H]1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 833188897 JTBLLPQIBMAMPA-KOLCDFICSA-N 298.299 -0.051 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C[C@H]2CCCO2)CC1 840242650 ZWBBDQWKYVBBPM-IJLUTSLNSA-N 283.328 -0.025 5 20 CBBD Cc1[nH]nc(C(=O)NN2CCOC2=O)c1[N+](=O)[O-] 862700635 YIFMUUBWTXPTOH-UHFFFAOYSA-N 255.190 -0.277 5 20 CBBD Cc1nc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 1030293495 MIJOVBFWJZSKHF-RKDXNWHRSA-N 280.288 -0.921 5 20 CBBD CNC(=O)CC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093567776 FLVICTZVEBXUPB-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD NC(=O)C[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1323419340 PELVHHJSYUFTEA-GXSJLCMTSA-N 297.315 -0.651 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1325431964 OIFQGWGXYKJZNO-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H](C(=O)O)C1 1600918423 QTMKBFUCBBUGNU-ZCFIWIBFSA-N 255.234 -0.497 5 20 CBBD CN1CCC(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 37887435 IXETXFGYNFLXPR-GFCCVEGCSA-N 283.332 -0.164 5 20 CBBD CCc1nn(C)c(N2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 91731335 MXHFMYDVGHSKPC-OCAPTIKFSA-N 256.262 -0.568 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCCC[C@@H]2CO)c1 159734115 HLLCNTBHELPHFV-PWSUYJOCSA-N 284.316 -0.001 5 20 CBBD COCCOCCC(=O)NCCn1cc([N+](=O)[O-])cn1 164420926 SHHIKTJCAFHLGP-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD C[C@@](O)(CO)CNc1ncc(C(=O)O)cc1[N+](=O)[O-] 235377591 PYOOGPMEUVRNIC-JTQLQIEISA-N 271.229 -0.157 5 20 CBBD NC[C@@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 237954567 GGMNLKMOXPLZRK-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNc1ncc([N+](=O)[O-])c(N)n1 279165671 UICIZHNWIALGLR-WKEGUHRASA-N 269.261 -0.081 5 20 CBBD COCCN1CCN(c2ncc([N+](=O)[O-])cn2)CC1=O 302212195 HDZKUGPSYVVMQF-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD CC(C)(C(=O)N[C@H]1CCCNC1=O)n1cc([N+](=O)[O-])cn1 330441521 PCVCDGZIEMVBAK-VIFPVBQESA-N 295.299 -0.079 5 20 CBBD NC(=O)[C@@H](O)CNc1ncnc2sc([N+](=O)[O-])cc12 336811829 OQAVAGQNXFSDMK-YFKPBYRVSA-N 283.269 -0.142 5 20 CBBD NC(=O)Cn1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)n1 342213309 ZZRNREVFEKGCTK-UHFFFAOYSA-N 289.251 0.529 5 20 CBBD CCOC(=O)C[C@@H](C)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 343490824 FZXVWMKWEHOTGV-MRVPVSSYSA-N 299.287 -0.014 5 20 CBBD CC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 408062351 NTBVUGDZBZDYDB-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD C[C@@H]1NCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 434707104 PTKGJDNDSUQESQ-JGVFFNPUSA-N 268.277 -0.557 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@@H](O)C1 600530568 IAALENBUQMWFGC-SNVBAGLBSA-N 282.300 -0.270 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 763256569 AOVRDUOZPMSWFF-VIFPVBQESA-N 283.240 -0.559 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](O)C1 839792209 INARNDWFGVLATB-IAQIWYKVSA-N 252.230 -0.175 5 20 CBBD O=C1CNC(=O)N1CCCn1cnc([N+](=O)[O-])c1 1115862038 RIANMHXXPJLQMJ-UHFFFAOYSA-N 253.218 -0.267 5 20 CBBD O=C(NCCCN1C(=O)CCC1=O)c1n[nH]cc1[N+](=O)[O-] 1116412828 LQYBOORMOFDXSH-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD O=C(NC[C@@H]1COCCO1)c1c[nH]nc1[N+](=O)[O-] 1116932298 MJKBDGFMEYRLSR-ZCFIWIBFSA-N 256.218 -0.537 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@](F)(CO)C1 1116956896 PFSJVHOZEKMDEP-JTQLQIEISA-N 272.236 -0.125 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCS(=O)CC1 1320948175 BPRQNQRKJPAKKT-UHFFFAOYSA-N 258.259 -0.478 5 20 CBBD CNC[C@H]1CCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1326584298 VOQJFHDOAJATLD-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD COC[C@H](O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1344717318 IXQUTWYOLIKGCU-SSDOTTSWSA-N 272.261 -0.626 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)NCCn1cc([N+](=O)[O-])cn1 1589001250 INFAQTPMXIIQST-ZETCQYMHSA-N 285.260 -0.046 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)c1cnc(C(=O)O)cn1 1589076741 BGKRXCCEJOIXBN-RXMQYKEDSA-N 255.186 -0.003 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nc[nH]n1 37921095 KIPMJDAHSVUKHI-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cc1nnc(NC(=O)Cn2ccc([N+](=O)[O-])n2)[nH]1 112703229 LZUZUFJUBRBVDL-UHFFFAOYSA-N 251.206 -0.143 5 20 CBBD COC(=O)CNC(=O)Cn1cc([N+](=O)[O-])c(C)n1 143223952 VYAOPYMLVGHOQI-UHFFFAOYSA-N 256.218 -0.611 5 20 CBBD CC[C@@H]1C(=O)NCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247201857 CCDKOQRGAVWUJF-GHMZBOCLSA-N 297.315 -0.637 5 20 CBBD CCN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 273285794 JZTSDECJOBYCKE-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD CCNC(=O)CN(CC)C(=O)c1cc([N+](=O)[O-])[nH]n1 285224650 XTXIHEVZSDRWMW-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD O=C(NCCn1ccccc1=O)c1n[nH]cc1[N+](=O)[O-] 343496537 IFGNDPKVOLKTTK-UHFFFAOYSA-N 277.240 -0.090 5 20 CBBD O=[N+]([O-])c1cnc(NCCS(=O)(=O)NC2CC2)nc1 354530237 WRZKXFGXLGTCJU-UHFFFAOYSA-N 287.301 -0.122 5 20 CBBD N=c1nc(COc2ccc([N+](=O)[O-])c(CO)c2)[nH]c(=N)[nH]1 428083933 FTWGBTXHRBTQSV-UHFFFAOYSA-N 292.255 -0.324 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1 436641075 LHZDAPGJLKOPKS-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])cn1C 539706568 HNKILDRRCTVDOB-UHFFFAOYSA-N 283.288 -0.066 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(c2c([N+](=O)[O-])ncn2C)C1 592003593 ITKYBBXTMRJIBY-HTQZYQBOSA-N 284.272 -0.312 5 20 CBBD Cc1ncc([N+](=O)[O-])n1[C@H]1CCN(CC(=O)O)C1=O 596015251 ZPSAQMJZSZWPPO-ZETCQYMHSA-N 268.229 -0.042 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nn2cnnc2s1 603502618 NSQMFGXUQNQTAF-UHFFFAOYSA-N 294.256 -0.071 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1N 720820565 JKQCBOHPLFGUBW-MRVPVSSYSA-N 267.289 -0.013 5 20 CBBD O=C1CC(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)=NN1 732258046 KMPIDWMIAPWBPC-UHFFFAOYSA-N 291.267 -0.001 5 20 CBBD C[S@](=O)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 742300523 WOEVKOPDEOQACF-KRWDZBQOSA-N 293.326 -0.353 5 20 CBBD COCC(=O)N(C)CCNc1ncc([N+](=O)[O-])c(N)n1 1101474640 JYOLUIXXFKGBNN-UHFFFAOYSA-N 284.276 -0.516 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](CO)[C@@H](O)C1 1116789014 VOKOFTISOSADOI-APPZFPTMSA-N 284.272 -0.856 5 20 CBBD C[C@H]1CNCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118195582 ODXWZEAGNSWALH-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD Cc1nn(C)c(C(=O)N2CCCN(C=O)CC2)c1[N+](=O)[O-] 1324618384 OZUDRGLPJASTED-UHFFFAOYSA-N 295.299 -0.059 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCOCCF 1328857759 AGAMZLPDFLCOBI-UHFFFAOYSA-N 261.213 -0.711 5 20 CBBD CNCCN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1349419155 YJVFUMGRAZACEI-UHFFFAOYSA-N 268.273 -0.566 5 20 CBBD O=[N+]([O-])c1nccn1Cc1ncc(-c2nn[nH]n2)cn1 1593487262 GMVBUFIPHPGFHM-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C(=O)O)C1 1594664871 CSLHYDYMJXLOAU-MRVPVSSYSA-N 296.239 -0.502 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCCCNC1=O 48702546 LTJRVRXVTLKIIC-MRVPVSSYSA-N 281.272 -0.424 5 20 CBBD CN(CC(=O)NC1CC1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173501274 DRADBXSIQGBFMK-NSHDSACASA-N 297.315 -0.637 5 20 CBBD Cn1ccsc1=NC(=O)Cn1cnc([N+](=O)[O-])n1 254967063 WPMNLFKKWSEWQR-UHFFFAOYSA-N 268.258 -0.286 5 20 CBBD C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCS1(=O)=O 351991429 UTZGIAZZHZNGDS-NTSWFWBYSA-N 288.285 -0.377 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCc2nnnn2C)c1[N+](=O)[O-] 357100635 ORRPJWAOVQQQKS-UHFFFAOYSA-N 294.275 -0.105 5 20 CBBD NCC(F)(F)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 417914983 SAJOKMFCLFYRGV-UHFFFAOYSA-N 292.246 -0.316 5 20 CBBD COCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(N)=O 436690983 SMXXFVMXCASWMN-MRVPVSSYSA-N 297.267 -0.079 5 20 CBBD CNc1nccc(C(=O)N(CCO)CCOC)c1[N+](=O)[O-] 574099649 WYHOGIDRQWZJBW-UHFFFAOYSA-N 298.299 0.112 5 20 CBBD Nc1ccc(N2CC[C@H](CO)[C@H](O)C2)nc1[N+](=O)[O-] 596207976 UDFSAPXFGRWXCG-VXNVDRBHSA-N 268.273 -0.249 5 20 CBBD CSCC[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 599135859 XUAWBWORLFLWAY-YFKPBYRVSA-N 286.317 -0.014 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 600459206 PSMCEDNERNFTFI-ZETCQYMHSA-N 297.267 -0.169 5 20 CBBD CNC(=O)CCOC(=O)Cn1cc([N+](=O)[O-])cn1 749047049 PXGQUSRSFBXCRU-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD CC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 969001843 YDZZKFCSUJHYLK-LMLFDSFASA-N 267.285 -0.127 5 20 CBBD O=C(NC[C@H](CO)[C@@H]1CCOC1)c1c[nH]nc1[N+](=O)[O-] 1256721296 WFAARAFVLAMFLZ-HTQZYQBOSA-N 284.272 -0.307 5 20 CBBD C[C@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCS(=O)(=O)C1 1323197906 UIAAZYKFECWGGQ-VIFPVBQESA-N 288.285 -0.375 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCNC1 1331942943 JJAVQTYGUNQPMT-SSDOTTSWSA-N 254.250 -0.993 5 20 CBBD C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1CCC(=O)O 1594487171 QCTUATYQWUYBHW-OPRDCNLKSA-N 285.300 -0.341 5 20 CBBD CN1CCN(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 44684497 HCDLBSKVVHRQNZ-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CCN(C3CC3)C2)c1 44721347 DQZBFELZIMSSQJ-ZWNOBZJWSA-N 295.343 -0.022 5 20 CBBD CNC[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 179170170 JNDAKVDYQBEPHK-QMMMGPOBSA-N 255.278 -0.237 5 20 CBBD CCc1[nH]nc(C(=O)N2CCNC(=O)[C@H]2C)c1[N+](=O)[O-] 192500615 ZJDRKCKXCYWYHH-ZCFIWIBFSA-N 281.272 -0.159 5 20 CBBD COC[C@@H](O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 231619970 UKSWXIFPUIADJZ-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD CN[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 269133905 PMFNBKGYUDHGAP-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H](C)C(=O)NC)c1[N+](=O)[O-] 346811603 RYJUKDGSZZRPBX-YFKPBYRVSA-N 269.261 -0.255 5 20 CBBD CCO[C@@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 456788920 DZCUULNPLZVWGP-NXEZZACHSA-N 284.272 -0.289 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CC[C@@H](CO)[C@@H](O)C2)n1 578466856 UTZNJPLECJCDRB-UWVGGRQHSA-N 270.289 -0.534 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCCC1=O 582068950 PEDJZSUGMYFJBL-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(N2CC[C@@H](O)C2)C1 593854731 CUIIURHKFJPPJG-MRVPVSSYSA-N 281.272 -0.791 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC(N2CC[C@@H](O)C2)C1 593857147 UDFHBQRMXLJCJM-MRVPVSSYSA-N 281.272 -0.791 5 20 CBBD O=[N+]([O-])c1cnn(CN2CCS(=O)(=O)CC2)c1 728711815 XMJHCHDYPFPQJU-UHFFFAOYSA-N 260.275 -0.521 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCOC(=O)N(C)C 855650800 VOOPPFANKQJCFS-UHFFFAOYSA-N 299.287 -0.086 5 20 CBBD O=C(N[C@@H]1CCn2cncc2C1)[C@@H]1C[C@H]1[N+](=O)[O-] 857942556 XOMQDDROJOOKLK-SZEHBUNVSA-N 250.258 -0.021 5 20 CBBD Cn1ccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932448 YGXUORCTKZDEIF-NXEZZACHSA-N 267.289 -0.709 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](CO)C1 1319526946 HTPAAZIROLDGJT-VIFPVBQESA-N 268.273 -0.059 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1319851772 XFSFEPOBZNHPMY-NSHDSACASA-N 298.255 -0.390 5 20 CBBD Cc1cncc([N+](=O)[O-])c1N1CCO[C@H](C(N)=O)C1 1320712015 MXHVELNSRDGWDP-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@]12CCOC2 1322625335 HAVUELMDVKQOFW-GFCCVEGCSA-N 296.283 -0.040 5 20 CBBD CC[C@@H](C(=O)O)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1350847554 PUOGBBVGWHOIDP-UWVGGRQHSA-N 286.288 -0.053 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NCC(N)=O 8162334 SBJWZZVMZBWPMD-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD O=C(NCCN1CCNCC1)c1ccc([N+](=O)[O-])o1 36278531 AKQJPANPDUOOCJ-UHFFFAOYSA-N 268.273 -0.177 5 20 CBBD CNC(=O)CN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 48381245 WHQDMQDHNJKIBT-UHFFFAOYSA-N 282.304 -0.804 5 20 CBBD Cn1cc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])cn1 196747513 QGGKPWZCHCTHRT-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 227884824 VAVBKZFQNJBFFT-UHFFFAOYSA-N 267.245 -0.562 5 20 CBBD Cc1nn(CCN2C(=O)CN=C2O)cc1[N+](=O)[O-] 331241126 PWFMZBQGBXMZTH-UHFFFAOYSA-N 253.218 -0.144 5 20 CBBD Cn1c(C(=O)N2C[C@H](O)C[C@H]2CO)ccc1[N+](=O)[O-] 347735678 RMEHIISGWDNKGA-JGVFFNPUSA-N 269.257 -0.499 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1C[C@H]2CNC[C@@H]2C1 359310417 SBBYTNHPRQIGPH-RKDXNWHRSA-N 251.290 -0.021 5 20 CBBD O=C1C[C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])CN1 444191271 IRUWKJZLSVQEFB-VIFPVBQESA-N 299.308 -0.097 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@]2(CO)CCOC2)c1[N+](=O)[O-] 444371669 MSEZJEHGLPVYQJ-LLVKDONJSA-N 284.272 -0.239 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 600458557 MUOMNQSPIONLSM-ZETCQYMHSA-N 299.239 -0.651 5 20 CBBD CC(C)[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 725930389 XIMAVQDHFUKAAU-LLVKDONJSA-N 297.267 -0.190 5 20 CBBD CC(=O)N[C@@H](C)C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 801186757 XOHDLBHFJDLTQI-QMMMGPOBSA-N 297.267 -0.176 5 20 CBBD CNC(=O)[C@@H](O)CN=c1c(Cl)c[nH]cc1[N+](=O)[O-] 853534780 MFBQSZJEHRQUNT-ZETCQYMHSA-N 274.664 -0.416 5 20 CBBD CS(=O)(=O)N1CCC[C@H](C(=O)OCCC[N+](=O)[O-])C1 860923191 PVKIZQKGENORID-VIFPVBQESA-N 294.329 -0.132 5 20 CBBD Cc1nn(C)c(NCCN(C)CCO)c1[N+](=O)[O-] 884823797 FOTXBOUXHRCQLM-UHFFFAOYSA-N 257.294 -0.027 5 20 CBBD COCCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1332493916 VAVNDUQPQOLUBE-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD C[C@](NC[C@@H](O)CO)(C(=O)O)c1cccc([N+](=O)[O-])c1 1593285412 DPKNWPABDZOZMK-ZYHUDNBSSA-N 284.268 -0.163 5 20 CBBD O=C(O)c1cnc(N2CCOCN2)c([N+](=O)[O-])c1 1608975092 JJPFAQLFNPOQLX-UHFFFAOYSA-N 254.202 -0.013 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC(=O)N1CCCC1 65693852 JFZRPBJCLCUFDD-UHFFFAOYSA-N 295.299 -0.162 5 20 CBBD CNC(=O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 172687642 GUBPGNLLIMKHTM-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)CSc1ccc([N+](=O)[O-])cc1 228508558 OGSSEMPZDZMWQL-VIFPVBQESA-N 299.308 -0.351 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)C1CC1 272967317 RFAKKAHWUJWYJY-UHFFFAOYSA-N 252.230 -0.113 5 20 CBBD O=C(NC(CO)CO)c1ccc([N+](=O)[O-])cc1O 274837342 SUPIOYJPPVQOGS-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD O=C(NCCN1CCNCC1)c1ccc(O)c([N+](=O)[O-])c1 285790042 UMSDRHULQJPRBO-UHFFFAOYSA-N 294.311 -0.065 5 20 CBBD CN1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 304332689 OFGQFOJJKOKJTP-NSHDSACASA-N 269.305 -0.600 5 20 CBBD C[C@@H]1CC(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 371340392 DUSUATDIVDORCW-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD Nc1ccc(N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)nc1[N+](=O)[O-] 596013649 ITVYQHDBMIGKBY-APPZFPTMSA-N 292.299 -0.680 5 20 CBBD CCc1[nH]nc(C(=O)NCc2cnn[nH]2)c1[N+](=O)[O-] 610494627 UFTKLIWZMZCWIJ-UHFFFAOYSA-N 265.233 -0.072 5 20 CBBD O=C(COC(=O)Cn1cc([N+](=O)[O-])ccc1=O)NC1CC1 748916137 FLOYLNNCUBGMCK-UHFFFAOYSA-N 295.251 -0.422 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCn1cnnn1 844772784 IOGIBNAKVLROSZ-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1 923285410 BJAWIUBBGPUIBC-MWLCHTKSSA-N 269.305 -0.554 5 20 CBBD O=C(CNC(=O)c1n[nH]cc1[N+](=O)[O-])NCC(F)(F)F 1319701012 KQBLANNCZYBSEL-UHFFFAOYSA-N 295.177 -0.274 5 20 CBBD CCN(CC(=O)NC)C(=O)c1c([N+](=O)[O-])cnn1C 1319984100 OURBQYFAWWAFAW-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)CCF 1326893566 NUTJWOGWYWZSPY-MRVPVSSYSA-N 274.252 -0.064 5 20 CBBD O=C(c1ccc(O)nc1)N1CCN(CC[N+](=O)[O-])CC1 1332695127 KDXPGHAEAXNGFC-UHFFFAOYSA-N 280.284 -0.178 5 20 CBBD CN1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 78020997 LVPBZCDPADCKMY-RXMQYKEDSA-N 252.234 -0.390 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 129987775 SXTUWEBTNJZEPT-HTQZYQBOSA-N 283.288 -0.057 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 135531743 ASKJGPBMODVBMB-SECBINFHSA-N 283.240 -0.063 5 20 CBBD NC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 165599181 HOVZBSGWFBRDBU-ZETCQYMHSA-N 255.230 -0.013 5 20 CBBD Cc1c(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cnn1C 226382641 LEIVTMZGWVGGTD-GFCCVEGCSA-N 294.315 -0.016 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCOC1 266564195 YXLBUENQGHFVFL-GXSJLCMTSA-N 270.289 -0.127 5 20 CBBD NC(=O)N[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 342798886 YFRGKPIQQXGARJ-MRVPVSSYSA-N 293.283 -0.059 5 20 CBBD CN(CCC(N)=O)CCn1cc([N+](=O)[O-])ccc1=O 353193938 CPTLPPAIKMTYHS-UHFFFAOYSA-N 268.273 -0.436 5 20 CBBD CCn1cc(S(=O)(=O)N2CC[C@@H](N)C2)c([N+](=O)[O-])n1 353220702 VRFOOJHMXWOBMH-SSDOTTSWSA-N 289.317 -0.467 5 20 CBBD CCN(C)C(=O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357452783 IFHHZSFEEAFCRH-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])nn1C 360753986 KNIFEHLVNTYFEH-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD COC[C@H](CO)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 589302314 XIEZFVNRECMTAM-ZETCQYMHSA-N 291.285 -0.725 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@H]1COCCN1 599614956 WPIQFYQSCJRZIB-QMMMGPOBSA-N 281.272 -0.478 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NN1CCCNC1=O 779446077 BKQQNHGGGIRJRG-UHFFFAOYSA-N 295.255 -0.797 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1COC(=O)C1 854555125 AAGUMQMUSFWAIS-YFKPBYRVSA-N 266.213 -0.383 5 20 CBBD O=C(NC1CN(C(=O)C2CCOCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991296095 MNQHBENTHLOKGY-GHMZBOCLSA-N 297.311 -0.595 5 20 CBBD CN(CC(N)=O)c1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] 1604717596 KGRISANEOIJCIG-UHFFFAOYSA-N 277.244 -0.304 5 20 CBBD Cc1ccc(NC(=O)CNC(=O)CN)cc1[N+](=O)[O-] 37623289 SEWGLEVZBLPGCE-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD CC(C)N(CCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 174658996 RSKRPQLCJZKAAY-NSHDSACASA-N 272.305 -0.145 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCO 193119780 ZNOXTFPWWKEHQX-QMMMGPOBSA-N 281.268 -0.178 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)NCCO 276477421 FNDAIRVNPZWMDB-UHFFFAOYSA-N 282.256 -0.985 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC1(O)CCOCC1 351036927 ZULRDLDHWLFVFZ-UHFFFAOYSA-N 296.283 -0.157 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1nncn1C 355064203 ILKABDUTBFPVAW-ZCFIWIBFSA-N 279.260 -0.020 5 20 CBBD NC(=O)N[C@@H](CO)C(=O)Nc1cc([N+](=O)[O-])ccc1O 356320615 LHDGFYVPROWSQN-ZETCQYMHSA-N 284.228 -0.732 5 20 CBBD CN1CC[C@@](O)(CNc2ncc([N+](=O)[O-])cn2)C1 358324665 UUEDIVCJUNDTAM-SNVBAGLBSA-N 253.262 -0.137 5 20 CBBD CC[C@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)CCO1 362684187 OFQPEHGVOLAAHF-VIFPVBQESA-N 296.331 -0.088 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCN2CCOC[C@@H]2C1 368820014 ZZWWXIQJTHNTAN-JTQLQIEISA-N 281.316 -0.155 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](O)C[C@H]1CO 370329024 YJGKOJNTYXWYNO-WDEREUQCSA-N 296.279 -0.072 5 20 CBBD Cn1c(C(=O)NC2(C(N)=O)CC2)ccc1[N+](=O)[O-] 426935397 VAMILGFYJKLKBE-UHFFFAOYSA-N 252.230 -0.319 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@@H](C)N 429045510 LJHHGXJEAVKHEZ-SSDOTTSWSA-N 255.278 -0.047 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)c1c([N+](=O)[O-])cnn1C 435957055 UJGQIPADDRXLQD-ZCFIWIBFSA-N 270.245 -0.038 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cnc1O 439318730 HIJAIAILOWETCU-YFKPBYRVSA-N 268.229 -0.311 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC(=O)N1 447754836 BPEZKQOOYNRAHL-ZETCQYMHSA-N 293.283 -0.030 5 20 CBBD O=C(NC[C@@H]1CNCCO1)c1cc([N+](=O)[O-])cnc1O 565891023 GLFGGWIEOPSWSX-QMMMGPOBSA-N 282.256 -0.586 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NCc2nnn(C)n2)n1 592973902 HJPZPTCMVKPXRY-UHFFFAOYSA-N 293.243 0.132 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCOC[C@@H]1CCOC1 609463618 OUJNFXSOKVDLKI-SNVBAGLBSA-N 298.299 -0.039 5 20 CBBD C=CC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 732101647 GDNNTEYWBCZOGJ-UHFFFAOYSA-N 252.230 -0.045 5 20 CBBD COC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(N)=O 760886654 CMWRPFGZIFYEMX-SSDOTTSWSA-N 283.240 -0.470 5 20 CBBD CN1C(=O)CN(NC(=O)c2cccc([N+](=O)[O-])c2O)C1=O 770535587 LNWVVLPVNOKZBX-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2[C@H]3CCNC[C@H]2CC3)c1 923333519 XGVKHOUPTIZWAK-NQBHXWOUSA-N 295.343 -0.022 5 20 CBBD C[C@@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 928892610 INYJYHXBDATSAJ-VXNVDRBHSA-N 254.246 -0.058 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1cnnc1 1118768815 ZVIYGRNXZYXHEZ-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD Cc1nc(NC(=O)Cn2cnc([N+](=O)[O-])n2)nn1C 1324580083 JPILYULDXIUEBC-UHFFFAOYSA-N 266.221 -0.738 5 20 CBBD COc1cc([N+](=O)[O-])cn(CC(=O)NCCC(=O)O)c1=O 1599461772 FJNIVCPNFBLUQO-UHFFFAOYSA-N 299.239 -0.644 5 20 CBBD Cn1cc(NC(=O)Cn2cnc([N+](=O)[O-])n2)cc1C(=O)O 1608118824 OZZCMVCWOHTNBK-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)NCC(=O)O 35098569 YAQGYCHNRVPTSL-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC1[C@@H]2CNC[C@@H]12 102505614 LLBFREDKXCDSKD-HTQZYQBOSA-N 250.258 -0.119 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 195469066 FJKHMTRXNSCOPA-UHFFFAOYSA-N 283.288 -0.239 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(=O)O 262572339 CUGUVVQNDWGAIY-ZETCQYMHSA-N 295.251 -0.086 5 20 CBBD COCCN(CC(=O)OC)c1c([N+](=O)[O-])ncn1C 270387336 RLPHDORMQPELES-UHFFFAOYSA-N 272.261 -0.046 5 20 CBBD Cc1cc(C(=O)NCc2nnnn2C)c(N)c([N+](=O)[O-])c1 276580653 JKLGVNLLJLYKJW-UHFFFAOYSA-N 291.271 -0.061 5 20 CBBD C[C@@H](CN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1)c1nn[nH]n1 354790731 NUSSICPGIZSAGI-YFKPBYRVSA-N 280.248 -0.293 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362604342 SCTCETFSHWSWKV-LURJTMIESA-N 271.233 -0.635 5 20 CBBD N[C@H]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])o3)CCN2C1=O 594873900 QOMRCZFUNIBJMN-YUMQZZPRSA-N 294.267 -0.428 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCc2nn[nH]n2)c1[N+](=O)[O-] 610923049 NCBWUEUJGVXGAU-UHFFFAOYSA-N 280.248 -0.116 5 20 CBBD Nc1ccc(C(=O)Nn2cnnc2O)cc1[N+](=O)[O-] 777769726 XSQLNJHWFVCDIE-UHFFFAOYSA-N 264.201 -0.142 5 20 CBBD CC(C)(C(=O)NOCCO)n1cc([N+](=O)[O-])cn1 787300234 WRQZGAYOYPBOIA-UHFFFAOYSA-N 258.234 -0.434 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C)S1(=O)=O 839773975 KLSQWFGOBAGHDB-RBXMUDONSA-N 276.314 -0.314 5 20 CBBD C[C@@H](O)CCN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345310 OUABCBOHYZUETO-SECBINFHSA-N 283.284 -0.014 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCc2nn[nH]c2C1 1116722053 DCUSTCGQFXRCDU-UHFFFAOYSA-N 277.244 -0.355 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@H](S(C)(=O)=O)C1 1120040483 YVTLNNIRBXEFJV-ZETCQYMHSA-N 274.302 -0.048 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H](O)COCC1CC1 1319651810 NGCDXWFYUZTGQW-SECBINFHSA-N 298.299 -0.154 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)OC 1320409206 NVFVFXMZDQLRIV-JTQLQIEISA-N 297.267 -0.100 5 20 CBBD N[C@H](CO)Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 1326919751 XGYKMEIYSJSAPP-ZETCQYMHSA-N 264.245 -0.567 5 20 CBBD C[C@H](N)C[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 1329518839 CMJGZYGSHIBLSG-NKWVEPMBSA-N 256.266 -0.572 5 20 CBBD Cn1cc(C[S@](=O)CCn2cc([N+](=O)[O-])cn2)nn1 1336067989 TVABSZYAXLHOKL-LJQANCHMSA-N 284.301 -0.131 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C(F)F 1592938038 YHTKLWVORBLOMZ-UHFFFAOYSA-N 273.159 -0.194 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@H](C(=O)O)C1 1598618401 DIXYQSHSXLYEHN-SNVBAGLBSA-N 297.315 -0.261 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H]2CNCCO2)c1 1602299923 WBOXCDPGSTYONG-QMMMGPOBSA-N 283.240 -0.557 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)Cn1cnc([N+](=O)[O-])c1 48599362 LMVZXLOBENHHCL-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCN1CCOCC1 67285695 YHUMTGCGOJQGJG-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD CN1C(=O)CC[C@H](Nc2c([N+](=O)[O-])ncn2C)C1=O 90031360 AZZBTVQQSZBIDS-LURJTMIESA-N 267.245 -0.112 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 142808435 UEZWMEITXZQIIN-QMMMGPOBSA-N 298.251 -0.133 5 20 CBBD C[C@H](O)[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 183150801 URSZEJVXCWYOGT-UMNHJUIQSA-N 284.316 -0.145 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](CO)O[C@H](C)C1 187877169 PKFRAGCDVXSVIF-SCZZXKLOSA-N 298.299 -0.292 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](CO)C2)n1 316920424 VJHRVYLALHTHSH-MUWHJKNJSA-N 283.240 -0.523 5 20 CBBD CCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 336808831 DCUXHDKPNDYRKR-MRVPVSSYSA-N 269.261 -0.439 5 20 CBBD CCOC(=O)c1ccnc(N[C@@H](CO)C(N)=O)c1[N+](=O)[O-] 343247805 ARJPVGMHTRONPA-ZETCQYMHSA-N 298.255 -0.575 5 20 CBBD O=C(NC[C@H]1CC[C@H](CO)O1)c1cc([N+](=O)[O-])n[nH]1 349696854 RAZRBQDYXPOKHM-RNFRBKRXSA-N 270.245 -0.412 5 20 CBBD CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 360968393 GVCYFPQVDHQQNF-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD NC(=O)[C@H]1CCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 362476696 MFAUVDZCPNHTJX-JGVFFNPUSA-N 296.287 -0.653 5 20 CBBD CN1C(=O)CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 425278018 DHHNRDGCCOAKMA-YFKPBYRVSA-N 280.244 -0.474 5 20 CBBD Cn1c(C(=O)NCCOCC(N)=O)ccc1[N+](=O)[O-] 433026323 DTLUYQIYZUAORG-UHFFFAOYSA-N 270.245 -0.835 5 20 CBBD O=[N+]([O-])c1ccn(CCN[C@H](CO)[C@@H]2CCCO2)n1 447921929 NBGJUSNCGNQWIC-ZJUUUORDSA-N 270.289 -0.079 5 20 CBBD CCN1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 452971882 YWXHPSLYCKFWKN-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD Cn1c(C(=O)N2CC[C@@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-] 545283566 RGLZVUHYNDUGGL-WCBMZHEXSA-N 283.284 -0.251 5 20 CBBD Cc1nn(C)c(NC[C@@](C)(O)C(=O)O)c1[N+](=O)[O-] 576469293 PBSCAZWZXPVAHM-SECBINFHSA-N 258.234 -0.116 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 577624067 DVFKVFZTULLQES-GFCCVEGCSA-N 298.299 0.089 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2cccc([N+](=O)[O-])c2O)n1 590551148 KJVMFWAULKQAQT-UHFFFAOYSA-N 292.255 -0.027 5 20 CBBD C[C@H](CC(=O)NCCn1cc([N+](=O)[O-])cn1)NC(N)=O 594322014 JUDJLOXIHTZNNL-SSDOTTSWSA-N 284.276 -0.646 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCCN(C(=O)O)C1 739362432 VSBIJFYLMUMNRB-ZETCQYMHSA-N 298.259 -0.555 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)N(C)C[C@H]1C 782867171 JDRHSIIWMKQKBA-MRVPVSSYSA-N 295.299 -0.211 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 788177220 QOLQYGMDUFZENU-VIFPVBQESA-N 283.240 -0.863 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C[C@H]2CCOC2)CC1 839702494 XICYSMDIZUPVRF-IJLUTSLNSA-N 283.328 -0.168 5 20 CBBD O=C(O)[C@H](O)CNS(=O)(=O)c1csc([N+](=O)[O-])c1 849220299 CLFUWXVEHOCHMO-RXMQYKEDSA-N 296.282 -0.620 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1=CCOCC1 990966850 JSSFFBJOGXZHSU-GHMZBOCLSA-N 295.295 -0.675 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@H]2CC(=O)O)n1 1323454811 NVCBBPJLEIMMGO-SSDOTTSWSA-N 298.255 -0.356 5 20 CBBD C[S@](=O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 1327083322 AAJABQNQNAPFKA-SFHVURJKSA-N 272.286 -0.320 5 20 CBBD CN(Cc1cn(C)nn1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1333616576 PVMKFUDTOQWBNX-LLVKDONJSA-N 295.303 -0.587 5 20 CBBD O=C1NC(=O)N2CCN(c3ncc([N+](=O)[O-])cn3)C[C@H]12 1342482315 FPIODLIVXQZVDG-SSDOTTSWSA-N 278.228 -0.875 5 20 CBBD O=C(O)CCC(=O)OCCn1cnc([N+](=O)[O-])n1 1594998470 QGEIKSAWOLQRCZ-UHFFFAOYSA-N 258.190 -0.406 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])c(O)c1 1601419495 KLPNJFFJSOROLR-LURJTMIESA-N 270.197 -0.524 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](O)[C@@H]2C(=O)O)n1 1610607365 XCUSVXCSFDNDIK-IONNQARKSA-N 298.255 -0.622 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCN1CCOC1=O 44954556 FBYLTKXKRXFBPN-UHFFFAOYSA-N 284.228 -0.213 5 20 CBBD NCC(=O)NCC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 124861154 ILZMXHNAXKKRBZ-UHFFFAOYSA-N 292.295 -0.446 5 20 CBBD NC(=O)[C@H]1CCCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173504013 DTQWTBJGORLVGS-GHMZBOCLSA-N 297.315 -0.508 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 186844680 CDJVFJSHIXSVPO-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD O=c1[nH]cnc2cc(N3C[C@H](O)[C@H](O)C3)c([N+](=O)[O-])cc12 236555688 SDKCEAZUTHGKRK-PHIMTYICSA-N 292.251 -0.627 5 20 CBBD COC(=O)C[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 264985287 IPBCUIXYOVNHIG-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD COC(=O)C[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 265041733 WOEDLFQECREMAX-QMMMGPOBSA-N 297.267 -0.176 5 20 CBBD Nc1c(C(=O)NCC(=O)NCCO)cccc1[N+](=O)[O-] 268563906 BOVBKOCLDSHOAT-UHFFFAOYSA-N 282.256 -0.985 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)C2COC2)c1 276991084 GNSYYVXBEOTABX-UHFFFAOYSA-N 276.274 -0.891 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])s1 343707525 OPCAMXRTOJUJHR-UHFFFAOYSA-N 286.269 -0.029 5 20 CBBD Cc1nn(C)c(C(=O)NCC(F)(F)CN)c1[N+](=O)[O-] 427312231 IEDVNRGGCMTBSE-UHFFFAOYSA-N 277.231 -0.039 5 20 CBBD CN(C)CCOCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 572972946 IFYBFNDRSXBHND-UHFFFAOYSA-N 297.315 -0.120 5 20 CBBD CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)[C@H](CN)C1 578235911 JEYUXNAOKCTFFL-MRVPVSSYSA-N 282.304 -0.957 5 20 CBBD C[C@@H]1CC[C@H](C(=O)O)N1C(=O)Cn1cnc([N+](=O)[O-])n1 593920914 IRKIERCVVVOCFA-RNFRBKRXSA-N 283.244 -0.350 5 20 CBBD CN1C(=O)CN(NC(=O)c2c(N)cccc2[N+](=O)[O-])C1=O 779542304 YEHNWRWNBODWMU-UHFFFAOYSA-N 293.239 -0.284 5 20 CBBD C[C@@H](CO[C@H]1CCOC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839701651 YONXEMAVWRAOQB-AXTSPUMRSA-N 258.274 -0.038 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])c1)C(=O)N(C)C 1319112328 BVWICYYMYPIPJV-ZETCQYMHSA-N 269.261 -0.616 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1c([N+](=O)[O-])cnn1C 1320418887 USIPGNLUXOSUGN-UHFFFAOYSA-N 283.288 -0.170 5 20 CBBD CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H]1CCNC1 1326274937 DVRRVWOIEQQPQG-SECBINFHSA-N 280.284 -0.423 5 20 CBBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CO)C(N)=O)c1 1346025847 BOWILCOSHSYDBZ-QMMMGPOBSA-N 299.308 -0.107 5 20 CBBD Nc1c([N+](=O)[O-])ccc(N2CC(CO)C2)c1-c1nn[nH]n1 1592758241 XJYLRJLMHFJRNE-UHFFFAOYSA-N 291.271 -0.214 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@@H]2C(=O)O)n1 1605501410 PDGSMXUIBXZJAL-SSDOTTSWSA-N 284.228 -0.746 5 20 CBBD C[C@@]1(C(=O)O)CN(CCn2cc([N+](=O)[O-])cn2)CCO1 1776507310 UNMVKSOLVXILTN-NSHDSACASA-N 284.272 -0.033 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H](O)C(=O)O 136283782 KEMNSJZDSDHFFS-VIFPVBQESA-N 268.225 -0.301 5 20 CBBD CCN[C@H](C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 262506465 ZZYYKWDZOKFGGI-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD C[C@](O)(CNC(=O)c1cccc([N+](=O)[O-])c1N)C(=O)O 262557364 VGUPVSCRALJATQ-NSHDSACASA-N 283.240 -0.258 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 341504542 VICRDANLTBRNAK-QMMMGPOBSA-N 296.287 -0.679 5 20 CBBD O=C(NC[C@@H]1COCCO1)c1cc([N+](=O)[O-])cnc1O 342054430 GIHDSQJMASLJOQ-MRVPVSSYSA-N 283.240 -0.159 5 20 CBBD CN(C)C(=O)COC1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 353565041 FIABQSLRYQMALD-UHFFFAOYSA-N 297.271 -0.753 5 20 CBBD O=C1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)N1 355511235 XCKWINNMDKOXET-LURJTMIESA-N 267.245 -0.284 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCN2CCOC[C@H]2C1 356746886 QIFNKTGWNXPNJI-SECBINFHSA-N 295.299 -0.515 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2[C@@H]3CNC[C@@H]32)c1[N+](=O)[O-] 495112990 VOTIJAKPEGGBNS-ZMONIFLSSA-N 251.246 -0.426 5 20 CBBD CN1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 540528870 BPLVYEVHTAAPTO-UHFFFAOYSA-N 279.256 -0.514 5 20 CBBD CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@H](CO)O1 562948021 WPRSUUIZNYJECC-SSDOTTSWSA-N 284.272 -0.070 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1O 579709872 MCTUMOLXQQDTKM-SECBINFHSA-N 295.299 -0.671 5 20 CBBD CN(C[C@H](O)C1CC1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 610669906 JJVRSUFXUBTUDV-NSHDSACASA-N 295.295 -0.014 5 20 CBBD Cc1cc(C(=O)NCCNC(N)=O)c(N)c([N+](=O)[O-])c1 749397443 UGDUYBWGEMWSCZ-UHFFFAOYSA-N 281.272 -0.116 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 763696960 HUILLRZZFDZJDB-JTQLQIEISA-N 281.268 -0.640 5 20 CBBD Cc1ncc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1030292775 VFIIIXSNTIANGW-VXGBXAGGSA-N 291.311 -0.249 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@H]3CNC[C@@H]32)c1 1119682765 UOFYRBJDFQPFDY-USWWRNFRSA-N 281.316 -0.554 5 20 CBBD CNC(=O)CN(C)c1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591208242 HNTIXZGQKHLHIU-UHFFFAOYSA-N 292.259 -0.648 5 20 CBBD COC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1599277710 OWJDUSWJGWEPLK-SSDOTTSWSA-N 272.213 -0.538 5 20 CBBD CC(C)(C(=O)O)C(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1603242715 XJSJYPLGQNYXKG-PHDIDXHHSA-N 259.214 -0.125 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@]1(C(=O)O)CCOC1 262097863 MKNORFAILQLWMI-NSHDSACASA-N 298.255 -0.459 5 20 CBBD NC(=O)[C@]1(O)CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 276563217 ZYYDVMZWGHTQPV-NSHDSACASA-N 296.239 -0.071 5 20 CBBD O=C1NC(=O)N2CCN(CCn3cc([N+](=O)[O-])cn3)C[C@@H]12 332196440 CAJUZYCIEVZZLK-VIFPVBQESA-N 294.271 -0.973 5 20 CBBD CCOC[C@H](O)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 355759499 RNSOWWNIQXVLOW-ZCFIWIBFSA-N 257.250 -0.802 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@H](CO)[C@H](O)C1 565929259 IXYFJRVCZPOZPQ-MWLCHTKSSA-N 298.299 -0.617 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NOC1CCOCC1 773919561 GWHRAGFHUXZLAK-UHFFFAOYSA-N 297.267 -0.017 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 819258228 WTTGVOMSINLLHD-QMMMGPOBSA-N 297.271 -0.093 5 20 CBBD C[C@H]1C[C@H](N2CCOCC2)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839762580 SMSGCLMWHYFIJJ-NNYUYHANSA-N 283.328 -0.027 5 20 CBBD CSCC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(N)=O 862716628 MVIGJTFHTDRBFU-DSYKOEDSSA-N 261.303 -0.625 5 20 CBBD CC(=O)N1CC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2 965373886 CWGRTOSKIKZOBY-NXEZZACHSA-N 283.284 -0.889 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](CF)C(=O)O 1608276489 BBJPUSZSTBAXPF-LURJTMIESA-N 272.192 -0.276 5 20 CBBD C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(N)=O 55214470 UAIDCGBGJQRAPK-YFKPBYRVSA-N 291.260 -0.114 5 20 CBBD NS(=O)(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 79269980 FCOHJSJEOIBRET-UHFFFAOYSA-N 286.313 -0.080 5 20 CBBD CC(=O)N1CC(NC(=O)Cn2cc([N+](=O)[O-])nc2C)C1 173035565 HKTFAZHWOBFODK-UHFFFAOYSA-N 281.272 -0.553 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCCNC1 178388636 QGXPXMBXHMLMMW-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](C)O[C@@H](CO)C2)c1[N+](=O)[O-] 187881435 KECDIBWWQSLZLQ-IONNQARKSA-N 298.299 -0.141 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@@H](C(N)=O)C1 192546573 IMJAZVXKGZBNHJ-MRVPVSSYSA-N 283.288 -0.190 5 20 CBBD Cc1nn(C)c(N(C)CC(=O)N2CCOCC2)c1[N+](=O)[O-] 265332470 UETHFLJLSFZBOI-UHFFFAOYSA-N 297.315 -0.068 5 20 CBBD CN(CCC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 286327824 YNQZARGJBIUNLT-UHFFFAOYSA-N 255.234 -0.875 5 20 CBBD CCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 343428359 LSZXVKCMLFJJDA-MRVPVSSYSA-N 283.288 -0.130 5 20 CBBD CN(C)C(=O)CCCNC(=O)c1cc([N+](=O)[O-])nn1C 356453360 CQXUWJYWPZTQRA-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CC(C)[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 594467937 ORSQKHVCMIKCDP-SSDOTTSWSA-N 285.260 -0.341 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1 596619280 GFDBJYRQIJLZNL-IJLUTSLNSA-N 294.263 -0.054 5 20 CBBD COc1ccc(CC(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 597582402 BVIZWZXTXOPZKR-VIFPVBQESA-N 297.267 -0.892 5 20 CBBD COC[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC 774760816 XWSZPFGVXPVWCJ-QMMMGPOBSA-N 287.228 -0.478 5 20 CBBD C=CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 796310062 OGDXGWMIIJYBSQ-UHFFFAOYSA-N 253.218 -0.650 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839675658 HNTGTUJKAKPRSI-HRDYMLBCSA-N 255.274 -0.269 5 20 CBBD CC(=O)NCC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 1122668041 UMZNKCDUHQZXMP-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NC[C@H]1CC(C(N)=O)=NO1 1324052286 ANMCZAPAYYHINR-SSDOTTSWSA-N 279.256 -0.238 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1325235038 ZSDZSIGBQADDIG-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)c1c([N+](=O)[O-])cnn1C 1330746399 VMTCMVUJWVMPMX-YFKPBYRVSA-N 256.218 -0.079 5 20 CBBD CO[C@H](C(=O)O)C(=O)Nc1c([N+](=O)[O-])cnn1C 1574104508 HSANUEXLUDCCKU-YFKPBYRVSA-N 258.190 -0.634 5 20 CBBD O=C(NCCCNCc1cnn[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 1578009471 JRWUSKNHSPTPRU-RKDXNWHRSA-N 268.277 -0.934 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCNC[C@H]1O 1580562414 RRZXPXRIIDIEGL-VXGBXAGGSA-N 295.295 -0.187 5 20 CBBD C[C@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)C(=O)O 1593600975 BXYIWYZCUSNQPZ-BYPYZUCNSA-N 271.185 -0.473 5 20 CBBD Cc1nn(C)c(N2CCO[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 50955827 QKXSTXAJQPSNIW-SSDOTTSWSA-N 269.261 -0.673 5 20 CBBD NC(=O)[C@H](O)CNc1ncnc2ccc([N+](=O)[O-])cc12 228604087 GLLJYWBBBGSTSA-SECBINFHSA-N 277.240 -0.204 5 20 CBBD C[C@@H](CO)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 268841926 MRSYVIGSSBJQTK-MRVPVSSYSA-N 269.257 -0.499 5 20 CBBD CCNC(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 270748453 HXYNPJZCGQVNOT-UHFFFAOYSA-N 296.287 -0.195 5 20 CBBD C[C@@H](O)C(=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273695596 BYXDWJLNQLWUMW-MRVPVSSYSA-N 281.272 -0.586 5 20 CBBD NS(=O)(=O)CCOCCNc1ncccc1[N+](=O)[O-] 289191338 SYXJEOBIWGPFMV-UHFFFAOYSA-N 290.301 -0.293 5 20 CBBD C[C@](O)(CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 338620519 JVIDGTKRZYCYPX-SNVBAGLBSA-N 270.245 -0.955 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](C)[C@H](O)C1 351871536 UEDKOSSOFNCSRO-IONNQARKSA-N 268.273 -0.061 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 358349662 CURUBXZCAIYLCG-LLVKDONJSA-N 281.272 -0.485 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CCO1 543845241 IUDBZIPJLDPCPA-SNVBAGLBSA-N 296.283 -0.480 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592368928 SJPIAGBVUMNDAX-ZCFIWIBFSA-N 270.201 -0.757 5 20 CBBD CO[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 597540262 KRZFJBXEXXUBKX-MRVPVSSYSA-N 282.256 0.017 5 20 CBBD CC1(C)COCN1C(=O)Cn1cnc([N+](=O)[O-])n1 597617196 LBVWRRUPMFBOHB-UHFFFAOYSA-N 255.234 -0.219 5 20 CBBD CN(C)C(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748918453 WYMYZIABGSIZMM-UHFFFAOYSA-N 283.240 -0.612 5 20 CBBD CCc1nn(C)c(NC[C@@H](O)C(=O)NC)c1[N+](=O)[O-] 808048154 KGGNFRYSGXSFTM-SSDOTTSWSA-N 271.277 -0.591 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]21 839777408 RRDBYGKSVQJDAL-ZEBDFXRSSA-N 254.242 -0.471 5 20 CBBD C[C@@H](N)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 858643001 UCGDIPFKNMCNFL-SSDOTTSWSA-N 274.302 -0.043 5 20 CBBD CC1CN(CC[N+](=O)[O-])CCN(CC[N+](=O)[O-])C1 930654950 FKMDJFMALKEGHF-UHFFFAOYSA-N 260.294 -0.207 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](CC(N)=O)C1 1117572993 AJDONKOXHRLCAS-SECBINFHSA-N 295.299 -0.176 5 20 CBBD CS(=O)(=O)[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1321811135 OVPSJSPAPHUUJP-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CN1CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 1322764268 ACDXUZIQMUNNAJ-LURJTMIESA-N 267.245 -0.332 5 20 CBBD O=C(O)c1cc(NC(=O)C2(O)COC2)cc([N+](=O)[O-])c1 1602280985 WIVAHPSBJQVVAF-UHFFFAOYSA-N 282.208 -0.007 5 20 CBBD CCNC(=O)CN(CC)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75598041 KZJSVSZXWWWBNB-NSHDSACASA-N 299.331 -0.390 5 20 CBBD C[C@H]1C(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C(=O)[C@@H]1C 83976288 XMANCOFWGLSFCC-NQMVMOMDSA-N 296.283 -0.207 5 20 CBBD O=C(NC(CO)CO)c1cc([N+](=O)[O-])ccc1F 87750096 SSDRENRIOUYGJW-UHFFFAOYSA-N 258.205 -0.183 5 20 CBBD COc1ccc(C(=O)NC(CO)CO)cc1[N+](=O)[O-] 87751837 GKOPNGAATWIGIZ-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD CN1CC[C@H](CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 225270210 VVGGSNMPQYJIFO-ZYHUDNBSSA-N 283.332 -0.307 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cn1C 228748627 BSWHYYOBMLFVTM-GFCCVEGCSA-N 284.316 -0.024 5 20 CBBD CC(CO)(CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 273158681 JWVVHMDSQGEKKW-UHFFFAOYSA-N 269.257 -0.350 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(CCO)CC2)c1[N+](=O)[O-] 330594659 BEKACVAQTVGGLY-UHFFFAOYSA-N 297.315 -0.613 5 20 CBBD CCOC1CC(O)(CNC(=O)c2c([N+](=O)[O-])cnn2C)C1 331945766 HZBGTFJKELSRJD-UHFFFAOYSA-N 298.299 -0.012 5 20 CBBD CC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362578450 FDOPFZFUFFCMIV-RXMQYKEDSA-N 257.206 -0.834 5 20 CBBD Cc1nc(O)nc(O)c1NC(=O)Cn1ccc([N+](=O)[O-])n1 427137710 UBAYVIIASLJESW-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C(N)=O)C1 522266980 OMYAETLRLAQATF-ZETCQYMHSA-N 281.272 -0.184 5 20 CBBD O=C(CNC(=O)c1c[nH]nc1[N+](=O)[O-])NCc1ccco1 558732932 XEMIFENTERJHOH-UHFFFAOYSA-N 293.239 -0.043 5 20 CBBD CCc1[nH]nc(C(=O)NCCN2CC[C@H](O)C2)c1[N+](=O)[O-] 600806790 GEBAQHCHRCPPNB-QMMMGPOBSA-N 297.315 -0.323 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 763723941 KJUQJZWHMZAWLR-VIFPVBQESA-N 267.241 -0.569 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(=O)N(C)C[C@H]2C)c1[N+](=O)[O-] 782888685 YCRVWLVBZCJRLB-SSDOTTSWSA-N 295.299 -0.061 5 20 CBBD CC(C)[C@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC(N)=O 840672979 UTSOWYFLAUSSBM-QYNIQEEDSA-N 273.245 -0.586 5 20 CBBD CCOC(=O)[C@@H]1CN(CC[N+](=O)[O-])CC12COC2 930599808 ZJMWGEVCXHZWFJ-VIFPVBQESA-N 258.274 -0.225 5 20 CBBD COC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116347488 MVCJAQVYEMVHPC-UHFFFAOYSA-N 270.197 -0.527 5 20 CBBD CC(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)[C@H](C)C1 1121297532 BQLSYKDIHFNOHW-MRVPVSSYSA-N 282.304 -0.351 5 20 CBBD CCCNC(=O)[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1262648665 NPLWXZOKGDHPAP-LURJTMIESA-N 269.261 -0.038 5 20 CBBD CN(Cc1nncn1C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1322942960 RAGTUFOTTQJLRU-JTQLQIEISA-N 295.303 -0.587 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCCNC1=O 1336738606 YPVFVRPMZXQEMQ-SSDOTTSWSA-N 281.272 -0.273 5 20 CBBD COC[C@]1(C(=O)O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1599189826 AERFYCJGVHPXCZ-XLDPMVHQSA-N 272.257 -0.256 5 20 CBBD O=C(O)[C@@H]1C[C@H](F)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1602197119 OCAHCKYOTHAAKW-WHFBIAKZSA-N 272.192 -0.045 5 20 CBBD Nc1ncc(C(=O)N2CCO[C@H](C(=O)O)C2)cc1[N+](=O)[O-] 1605655329 MFZAEAPBHHHLIP-QMMMGPOBSA-N 296.239 -0.502 5 20 CBBD Cc1nn(C)c(C(=O)NCCN(C)CC(=O)O)c1[N+](=O)[O-] 1610569414 XDZLLNYEFSCOOV-UHFFFAOYSA-N 299.287 -0.617 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 1610735125 DYPKJBGOTXZVHZ-PSASIEDQSA-N 284.272 -0.441 5 20 CBBD COC(=O)COc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 66779898 RBJZDZOGSSHYTK-UHFFFAOYSA-N 290.253 -0.206 5 20 CBBD CN1CCO[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)C[C@@H]21 120926042 HOZBFMHIENUTSA-NWDGAFQWSA-N 281.316 -0.194 5 20 CBBD C[C@@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 132960987 OZFZTGIYSMVMKZ-WPRPVWTQSA-N 258.278 -0.487 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCN(CCO)CC2)n1 176190227 KPJCPVARSIPKSR-UHFFFAOYSA-N 269.305 -0.599 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1 179069380 XOSMUAYPKKKCSA-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD NC(=O)CONC(=O)Cc1cccc([N+](=O)[O-])c1 180375340 PJOKBGMLTLOZLF-UHFFFAOYSA-N 253.214 -0.330 5 20 CBBD CN(C)C(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 193524732 GHSGOFLMDDTEOH-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD C[C@H](C[S@@](C)=O)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228984977 XHOUQTVUWXGGTF-UGAFFITFSA-N 290.345 -0.491 5 20 CBBD CN(CCN1CCOCC1)C(=O)Cn1ccc([N+](=O)[O-])n1 263890465 URAIMOKKLKVCJA-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD O=C(NCCC(=O)N1CC(O)C1)c1ccc([N+](=O)[O-])cc1 268860260 DLTJBYQYAGVWKN-UHFFFAOYSA-N 293.279 -0.082 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)C1 276304963 UEJWTQSHJSBJNA-YFKPBYRVSA-N 282.212 -0.452 5 20 CBBD CN(CCOCCO)C(=O)c1cnc(O)c([N+](=O)[O-])c1 282047399 CJZBPJMMZRDNCA-UHFFFAOYSA-N 285.256 -0.224 5 20 CBBD CN1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285076690 MCBSDKLYQVMCSX-SSDOTTSWSA-N 253.262 -0.001 5 20 CBBD NC(=O)NC(=O)CCn1cccc([N+](=O)[O-])c1=O 338635832 DIFKESRNHWMUPD-UHFFFAOYSA-N 254.202 -0.659 5 20 CBBD COc1nc(NC(=O)c2c([N+](=O)[O-])cnn2C)n[nH]1 352646883 NLPAIQFOUJOGIP-UHFFFAOYSA-N 267.205 -0.293 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356498220 PKHAKKUUTMQJKA-LURJTMIESA-N 269.261 -0.417 5 20 CBBD Cc1cnc(OCC(=O)NC(N)=O)c([N+](=O)[O-])c1 360719565 FUWMSDGVMJIWSM-UHFFFAOYSA-N 254.202 -0.128 5 20 CBBD N[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 428370841 CBGONQOMLCSXSB-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD O=C(NC[C@@H]1CCCN1CCCO)c1cc([N+](=O)[O-])n[nH]1 452349306 BLVGFSPULJCFTI-VIFPVBQESA-N 297.315 -0.106 5 20 CBBD COC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])cnc2O)C1 492411872 KVZYRQZQSJXZAE-UHFFFAOYSA-N 296.239 -0.124 5 20 CBBD CN(CCN1CCOCC1)C(=O)c1c[nH]nc1[N+](=O)[O-] 548085615 KNYVTBVOIMNMTH-UHFFFAOYSA-N 283.288 -0.278 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1O 552155268 NUUPVMCDYZWMIH-QWRGUYRKSA-N 280.284 -0.263 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(=O)N(C2CC2)C1 559050805 ZMNCAHVIVDLKJS-UHFFFAOYSA-N 265.229 -0.278 5 20 CBBD CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1=O 573299927 NWFFRKOKXATUDQ-UHFFFAOYSA-N 280.240 -0.626 5 20 CBBD C[C@H]1CN(C2CC2)C[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 610714622 ZZTGSHMQWFOHBW-WCBMZHEXSA-N 294.315 -0.215 5 20 CBBD C[S@@](=O)CCN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 760548599 GYUUAJAQNNAJES-HXUWFJFHSA-N 299.356 -0.115 5 20 CBBD COC(=O)CCC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 782674717 TYTXWQONSQLOBP-UHFFFAOYSA-N 299.239 -0.143 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccc([N+](=O)[O-])c(O)c1 816731595 XSKBNEOUQJVBBO-UHFFFAOYSA-N 281.184 -0.313 5 20 CBBD O=C(O)[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 819281566 WHAGJLWIFHXFLF-WPRPVWTQSA-N 284.272 -0.441 5 20 CBBD CCn1ncn(NC(=O)c2cc([N+](=O)[O-])cn2C)c1=O 854631697 RDWRORHMDGAVPV-UHFFFAOYSA-N 280.244 -0.305 5 20 CBBD CN1C(=O)CN(CC(=O)OCC(C)(C)[N+](=O)[O-])C1=O 860868559 WBRMVFVRFFSEMD-UHFFFAOYSA-N 273.245 -0.521 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCN1CCC1 1253507120 DZNYECFNNQIPNE-UHFFFAOYSA-N 280.284 -0.422 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCn3cnnc3C2)c1 1340794866 ITPJOCDXLWGWML-JTQLQIEISA-N 293.287 -0.741 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)C(=O)O 1594586673 WGAHYFFRAMVOBD-UHFFFAOYSA-N 257.158 -0.861 5 20 CBBD C[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)O1 1599930739 WEFUTRGKODJMCR-CBAPKCEASA-N 270.245 -0.077 5 20 CBBD CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](O)C(N)=O 228492408 WAQULCGMQVEPNC-QMMMGPOBSA-N 297.267 -0.431 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)C2)c1 236607475 VRXWDOWEIYOXSK-AOOOYVTPSA-N 268.225 -0.165 5 20 CBBD CS(=O)(=O)[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 337412280 PJQDPDGIQPKSNG-VIFPVBQESA-N 288.329 -0.090 5 20 CBBD C[C@H](CCO)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340553247 LPJZMFVMDHCQER-SECBINFHSA-N 283.284 -0.109 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 345296356 FTSKEYZGBWHXJH-LURJTMIESA-N 274.254 -0.080 5 20 CBBD Cc1c(CNC(=O)[C@H](CO)NC(N)=O)cccc1[N+](=O)[O-] 360523677 BDBKERGVQZSDSF-VIFPVBQESA-N 296.283 -0.451 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCc1nnc(N)o1 560664686 PYZFVWRXNAVYIL-UHFFFAOYSA-N 280.244 -0.129 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 567927475 GCLWFUWOKJIAQC-RKDXNWHRSA-N 270.245 -0.679 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NC1[C@H]2CNC[C@H]12 592390497 YPAFMABQTMIRAB-BQBZGAKWSA-N 284.297 -0.514 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CCN2CCNCC2)c1[N+](=O)[O-] 592468669 CXVSKSVEEYEKEC-UHFFFAOYSA-N 296.331 -0.396 5 20 CBBD CCO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H]1CN 593917059 UUMXGWHMGIYERQ-VXNVDRBHSA-N 283.288 -0.246 5 20 CBBD Cc1noc(Cn2c(=O)ccn(C)c2=O)c1[N+](=O)[O-] 596014421 PLBLTCCMZYUCTE-UHFFFAOYSA-N 266.213 -0.200 5 20 CBBD COC(=O)c1ccnc(N2C[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 598629048 BFRNTEONNGPMEN-APPZFPTMSA-N 297.267 -0.434 5 20 CBBD COC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 600405297 JVRCCTJBGGLXOH-UHFFFAOYSA-N 271.229 -0.158 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@@H]2C[C@H]1CO2 600775015 IVCVFXRFNWWCJJ-BQBZGAKWSA-N 253.218 -0.814 5 20 CBBD O=[N+]([O-])c1ccc(NC(CO)CO)c(-c2nn[nH]n2)c1 738368265 BEGWHDOWOOHMFX-UHFFFAOYSA-N 280.244 -0.460 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCn2ncnc2C1 1116658974 DIIIKDITTYFNEU-UHFFFAOYSA-N 277.244 -0.575 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CC(N)=O)C1 1325236656 MLSTZMUJPIIZRZ-ZETCQYMHSA-N 281.272 -0.334 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)CC(N)=O 1328148957 FKKLYBARIYASJD-LURJTMIESA-N 269.261 -0.520 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCc1nc[nH]n1 1329426064 CDHUECVVGFUEKG-UHFFFAOYSA-N 252.190 -0.197 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@]12CCC[C@H]1CNC2 1580578179 AOYLWICWCMTWKY-KWQFWETISA-N 280.288 -0.555 5 20 CBBD CC(C)(CCC(=O)NC[C@@](C)(O)C(=O)O)[N+](=O)[O-] 1593400461 GAZRUCBDVSDFRW-SNVBAGLBSA-N 262.262 -0.226 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1 22216275 KAVPRMRVGHWEKH-QMMMGPOBSA-N 254.198 -0.230 5 20 CBBD Cc1nn(CCC(=O)NC(N)=O)c(C)c1[N+](=O)[O-] 71817742 PMHOIKSLEUVMDZ-UHFFFAOYSA-N 255.234 -0.007 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@H](F)CN1 188960554 MYQJHCKHNDYUIQ-IONNQARKSA-N 271.252 -0.393 5 20 CBBD CNC(=O)c1ccc(NC[C@H](O)C(N)=O)c([N+](=O)[O-])c1 227830676 PFBUIEGSMHWHQD-VIFPVBQESA-N 282.256 -0.788 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])cc1 268639440 OGAJWWDTLGKNEA-UHFFFAOYSA-N 267.241 -0.174 5 20 CBBD CN1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C1=O 270604081 XOSQOSXAWAJPCE-LLVKDONJSA-N 294.311 -0.081 5 20 CBBD CCc1[nH]nc(C(=O)NCCNC(=O)N(C)C)c1[N+](=O)[O-] 272480324 AWSORSAVTMQMCH-UHFFFAOYSA-N 298.303 -0.119 5 20 CBBD COC(=O)[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 276506460 YVEGYALLLOLGFO-MNOVXSKESA-N 298.299 -0.307 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2CNC[C@@H]2C1 359310413 SBBYTNHPRQIGPH-DTORHVGOSA-N 251.290 -0.021 5 20 CBBD CNC(=O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1O 412395760 SQMOZXNXLQTOPL-ZCFIWIBFSA-N 282.256 -0.050 5 20 CBBD CCC[C@@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 412516368 FVMMEQPNFNTVPK-VHSXEESVSA-N 298.299 -0.176 5 20 CBBD COC(=O)CCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 519545380 VEYCOSGLYYGMBQ-JTQLQIEISA-N 286.288 -0.305 5 20 CBBD C[C@@H](N)[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 562978092 WVNOVWIAHJUKJF-HTQZYQBOSA-N 255.278 -0.109 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(C)(CO)CO 575097136 VEWXPOOHTHGCTB-UHFFFAOYSA-N 286.288 -0.793 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])o2)CC1=O 577418226 LTGRMRIYENDFEA-UHFFFAOYSA-N 267.197 -0.371 5 20 CBBD Cc1nc(O)[nH]c1C(=O)NCCn1cc([N+](=O)[O-])cn1 583821993 YNXMUZBBINORQQ-UHFFFAOYSA-N 280.244 -0.042 5 20 CBBD CC[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 592953649 XNOXJIMQJJHWCR-QMMMGPOBSA-N 297.267 -0.017 5 20 CBBD Nc1nccc(C(=O)N2CCC[C@H](O)C2)c1[N+](=O)[O-] 594347502 CFSSIBIVVGYQGB-ZETCQYMHSA-N 266.257 0.169 5 20 CBBD CCN(CC)C(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 766825647 XHTLBVWBIQUUHV-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CCN(CCS(C)(=O)=O)C(=O)c1c[nH]nc1[N+](=O)[O-] 801638659 XSUNYUUFFJBEGC-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-] 1116910293 CIIRYSGSZRZEQJ-POYBYMJQSA-N 295.299 -0.109 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 1328702804 CHIWROYBDXNYBZ-SECBINFHSA-N 281.272 -0.472 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1ccc([N+](=O)[O-])[nH]1 85847357 UWCYOXONPDPXFM-SNVBAGLBSA-N 269.213 -0.104 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1CCS(=O)(=O)C1 176195627 LFHPNFFRBWWBOI-VIFPVBQESA-N 288.329 -0.090 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCC(F)(F)CO)c1 228745452 HNTPTRRNGKOYBA-QMMMGPOBSA-N 280.231 -0.631 5 20 CBBD O=C(CNC(=O)COc1ccccc1[N+](=O)[O-])NCCO 269495785 DDKWQEDVXYTQQY-UHFFFAOYSA-N 297.267 -0.802 5 20 CBBD CNC(=O)c1ccc(N(C)C[C@H](O)CO)c([N+](=O)[O-])c1 271253827 HZFXHHJNNCYAIV-VIFPVBQESA-N 283.284 -0.256 5 20 CBBD CNC(=O)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 342444173 FKLWGVSPMGGUQM-UHFFFAOYSA-N 294.267 -0.214 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCc2nn[nH]c2C1 351010569 QZGVKUBJASEGFP-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD Nc1nc(N2CC(O)(C(F)F)C2)ncc1[N+](=O)[O-] 425274188 KUTZTLHMXAPYTH-UHFFFAOYSA-N 261.188 -0.217 5 20 CBBD CO[C@@H]1COC[C@@H]1NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 459468229 BRTORPXMSSRCKU-WCBMZHEXSA-N 282.256 -0.053 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN(CCO)CC1 547754501 WNOIYUPCOYYTQY-UHFFFAOYSA-N 269.261 -0.932 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCc2nn[nH]c2C1 558749832 XXLPXECTANWSOQ-UHFFFAOYSA-N 263.217 -0.366 5 20 CBBD CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 597540944 PSKPSVBDVHYTRI-QMMMGPOBSA-N 256.218 -0.237 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nn2cnnc2s1 603835869 XFOWGUSCLNHJMO-UHFFFAOYSA-N 294.256 -0.071 5 20 CBBD COC[C@@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 609564109 HVRALLDLKZYHDX-VIFPVBQESA-N 257.250 -0.224 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NOC[C@@H]1CCOC1 788573585 GPLUGZIFKCHJER-MRVPVSSYSA-N 270.245 -0.124 5 20 CBBD C[C@@H]1[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 806060402 DNRYVVYGJFODMS-HTQZYQBOSA-N 282.256 -0.046 5 20 CBBD COC(=O)[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839653112 VFCBDXWSMHPJDU-BWZBUEFSSA-N 258.230 -0.948 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 863630898 TWNOIOQTZUCJHC-YFKPBYRVSA-N 271.233 -0.544 5 20 CBBD Cc1nc2n(n1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1116415421 UUTAJIMMDXYKHE-SSDOTTSWSA-N 291.271 -0.037 5 20 CBBD NC(=O)C(=O)NCCNCc1csc([N+](=O)[O-])c1 1133206328 LXTQYEUFUJIBGR-UHFFFAOYSA-N 272.286 -0.653 5 20 CBBD CN(CCNS(C)(=O)=O)CCn1cc([N+](=O)[O-])cn1 1323485662 MNRWDEOXMOEJBS-UHFFFAOYSA-N 291.333 -0.728 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC/C=C/CO 1330922332 SZWCNQHVOLSBCK-OWOJBTEDSA-N 254.246 -0.154 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)NCCn1cc([N+](=O)[O-])cn1 1344041762 VPKYACCHGUPUPN-UHFFFAOYSA-N 294.275 -0.249 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cc(O)cc([N+](=O)[O-])c1 1601523310 CJGDAKAEGUATJT-QMMMGPOBSA-N 270.197 -0.524 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 44680509 DDZVDTCBGLCCGB-ZETCQYMHSA-N 269.261 -0.568 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC(=O)NC1=O 230716821 SWLQMNANNJHOKU-ZETCQYMHSA-N 293.239 -0.893 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(C)(C)N 237575998 LYJMRINZDCZTAV-UHFFFAOYSA-N 255.278 -0.047 5 20 CBBD CN1CC[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 278034941 BMLHWBVASRPUSM-SSDOTTSWSA-N 280.240 -0.344 5 20 CBBD CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1COC[C@H]1O 285413367 BMXMJGBYFJMYQJ-VXGBXAGGSA-N 295.295 -0.115 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCN(CC(N)=O)CC1 288069327 GUJTWLABXUGKQK-UHFFFAOYSA-N 296.331 -0.273 5 20 CBBD CNC(=O)Cn1cc(Nc2ncc([N+](=O)[O-])c(N)n2)cn1 341799167 MYSMPFJHUGGQIL-UHFFFAOYSA-N 292.259 -0.347 5 20 CBBD CCN1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 364543152 LREHHKCYDAGBRU-RKDXNWHRSA-N 255.274 -0.268 5 20 CBBD CCNS(=O)(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 376151417 OMUBJTGCUMENDW-IWSPIJDZSA-N 291.329 -0.808 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])o1 394069281 BHPFYJMYODMZQL-MRVPVSSYSA-N 268.273 -0.179 5 20 CBBD CC1(C)NC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 438795295 UOXLKOTZPFVWDQ-MRVPVSSYSA-N 297.271 -0.517 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@@H](CO)[C@H]2CCCO2)c1 447901870 CWXKKFBJSDQPMO-WDEREUQCSA-N 270.289 -0.079 5 20 CBBD O=C(NC[C@H]1CCCN1CCCO)c1cc([N+](=O)[O-])n[nH]1 452349301 BLVGFSPULJCFTI-SECBINFHSA-N 297.315 -0.106 5 20 CBBD CN(C)[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1O 569150769 ISOWMEXDERZZPG-QWRGUYRKSA-N 297.315 -0.685 5 20 CBBD CO[C@@H]1COC[C@H]1NCc1c([N+](=O)[O-])ncn1C 571043818 SXWDUTWWPULCAS-VXNVDRBHSA-N 256.262 -0.168 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NC[C@H](O)C(F)F 575978312 LPIAIKAMVFZYHW-YFKPBYRVSA-N 297.239 -0.106 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCC2(CO)CCC2)c1 592430191 HQRDXYWLNXCYGF-LLVKDONJSA-N 284.316 -0.096 5 20 CBBD COC(=O)CN(CC(=O)O)Cn1cc([N+](=O)[O-])cn1 737618862 UMXAVAQIHWRIIW-UHFFFAOYSA-N 272.217 -0.692 5 20 CBBD CCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 757867119 RFFZJWXCMQKVSN-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cccc(C)c1[N+](=O)[O-] 763705436 FKQXNMHYLBYELS-SECBINFHSA-N 281.268 -0.260 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NOC/C=C/Cl 794304981 KHPWTXZZGWBXNU-OWOJBTEDSA-N 261.625 -0.013 5 20 CBBD Cn1nnc(COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 799481374 TZUZPKOZYPLZNK-UHFFFAOYSA-N 294.227 -0.977 5 20 CBBD Nc1ccc(NC(=O)N2C[C@@H](O)[C@H](CO)C2)cc1[N+](=O)[O-] 823926990 KACPMDUJTCDSKT-WRWORJQWSA-N 296.283 -0.006 5 20 CBBD O=[N+]([O-])c1ccn(CCn2ccnc2-c2nn[nH]n2)n1 826500599 DOJVAQIPWWYTLC-UHFFFAOYSA-N 275.232 -0.132 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(Cc2nn[nH]n2)c1 833306902 GBSIPOZLJREGMK-UHFFFAOYSA-N 266.173 -0.984 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840375027 CLSOREUKJYJURF-BWZBUEFSSA-N 258.230 -0.948 5 20 CBBD C[C@H](O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)C1 840424860 FGGHTEINJIJZNI-LMLFDSFASA-N 271.317 -0.435 5 20 CBBD C[C@H](c1nncn1C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590054816 NEBIHBQXPCXFTA-RXMQYKEDSA-N 290.247 -0.291 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1599926364 XXMKBTDJRDGBIC-FSPLSTOPSA-N 284.228 -0.368 5 20 CBBD CN(CC(=O)N1CCOCC1)c1c([N+](=O)[O-])ncn1C 8338017 HSEGGWXIBZVFAE-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD CNC(=O)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 184063093 FUONVQOOUGCMQM-VIFPVBQESA-N 283.288 -0.762 5 20 CBBD CN1CC[C@H](N(C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 352657297 GCMHBXPWGNENKT-MNOVXSKESA-N 297.315 -0.685 5 20 CBBD C[C@@H](CS(C)(=O)=O)N(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 352972164 GTHNJDWUHHXZDG-LURJTMIESA-N 290.301 -0.177 5 20 CBBD O=C(NC[C@@H](O)C(F)F)c1cc([N+](=O)[O-])n[nH]1 354059765 WLFBXSGCEVCHMK-SCSAIBSYSA-N 250.161 -0.326 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 445211580 KPTWYPIQQGOSIO-ZETCQYMHSA-N 299.239 -0.651 5 20 CBBD CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O 519711847 PQWYOTQUPIRSRO-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD CN(C)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 533534699 JUKLENRRNFQOCX-UHFFFAOYSA-N 274.302 -0.170 5 20 CBBD CCS(=O)(=O)NCCn1cc([N+](=O)[O-])cc(F)c1=O 563128459 PYBHGHGBYLZGFF-UHFFFAOYSA-N 293.276 -0.165 5 20 CBBD CCc1[nH]nc(C(=O)NCC(C)(CO)CO)c1[N+](=O)[O-] 566346522 WXGCGGAYVKPIJS-UHFFFAOYSA-N 286.288 -0.399 5 20 CBBD NC(=O)[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590575944 ZKACELHQKNCKIB-SSDOTTSWSA-N 267.245 -0.738 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1cc([N+](=O)[O-])n[nH]1 595997517 NSPMDVZSVHUSKH-VIFPVBQESA-N 270.201 -0.709 5 20 CBBD Cc1cc(C(=O)NC2=NCC(=O)N2)c(N)c([N+](=O)[O-])c1 729523728 IZIFWMOIOVCELR-UHFFFAOYSA-N 277.240 -0.299 5 20 CBBD O=C(O)[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 738550299 APSDJVCSRCJHDV-MRVPVSSYSA-N 256.218 -0.466 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 819889439 OPXYBYUICUAJHZ-ZETCQYMHSA-N 283.240 -0.312 5 20 CBBD O=C(NCCn1cnnn1)[C@H](O)c1cccc([N+](=O)[O-])c1 845794278 QCRZALZRGOFDOT-SNVBAGLBSA-N 292.255 -0.569 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C(N)=O)n1 1094079411 FSYUJSKWZIIPDM-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD CCc1nnc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)s1 1324024111 ODHUQSPTRSZSDZ-UHFFFAOYSA-N 297.300 -0.083 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](C)C(=O)NCCF)c1[N+](=O)[O-] 1325190408 SHSKGMKFVTZNRK-ZCFIWIBFSA-N 287.251 -0.170 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N[C@H]1C=CCC1 1328465614 BRXJTKFFETUDNF-VIFPVBQESA-N 293.283 -0.258 5 20 CBBD C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1607474309 XHDIBLHONZZJEU-FSPLSTOPSA-N 284.228 -0.368 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C)CO1 49090214 NVQBXAOKSDSRLV-SFYZADRCSA-N 269.261 -0.178 5 20 CBBD Cc1c(C(N)=O)cc(S(N)(=O)=O)cc1[N+](=O)[O-] 83756985 VOWRVDPMQJNGLJ-UHFFFAOYSA-N 259.243 -0.350 5 20 CBBD NC[C@@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCO1 165009644 MERJKXGJYSIHOL-LLVKDONJSA-N 294.311 -0.147 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@]1(CO)CCOC1 182840687 MWIMNBBEOHJPRS-LBPRGKRZSA-N 298.299 -0.243 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 236561246 AUHNCIFEVZJSRK-QWRGUYRKSA-N 266.253 -0.299 5 20 CBBD COC[C@@H](O)CCNc1ncc([N+](=O)[O-])cc1C(N)=O 270765644 FOBGBXWRDMJUBO-QMMMGPOBSA-N 284.272 -0.102 5 20 CBBD CN1C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC1=O 290467339 ACCYDVFLIXYDRU-LURJTMIESA-N 279.256 -0.269 5 20 CBBD O=C(O)c1cnc(N2C[C@@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 316877535 POADTLJEYNEZND-VXNVDRBHSA-N 283.240 -0.523 5 20 CBBD CC(=O)NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 330830032 QGNCSILJEJPAHL-JTQLQIEISA-N 296.283 -0.100 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 345283836 JYISFRHSZILELY-QMMMGPOBSA-N 283.240 -0.559 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)[C@H]2C)c1[N+](=O)[O-] 408100630 ZLUIRQOMSPPCCB-SSDOTTSWSA-N 281.272 -0.403 5 20 CBBD COC(=O)[C@H]1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 412762077 WIGOOKAVENPAKU-OCAPTIKFSA-N 282.256 -0.141 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)NCCN(C)C 567178650 MPNYDJZBSRPNBX-ZETCQYMHSA-N 298.303 -0.886 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@@]12CCNC2 574037255 JSAVBXOPMYYDJF-CMPLNLGQSA-N 279.300 -0.093 5 20 CBBD CCN1C[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 576530339 NBUPVJIXQGFYIG-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD CC(C)(C(=O)N1CCOCCN1)n1cc([N+](=O)[O-])cn1 597706881 CJQCLRHAYYVKSK-UHFFFAOYSA-N 283.288 -0.110 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)O[C@H]1CCCNC1=O 767289974 AWKYNICWAZXWCR-ZETCQYMHSA-N 268.229 -0.387 5 20 CBBD COCC(=O)N[C@H](C(=O)OCCC[N+](=O)[O-])C(C)C 860915879 YLGCNUWGVFYBAY-JTQLQIEISA-N 276.289 -0.016 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)C2CC2)C1 954239718 FALOWCZIZZFMOV-NXEZZACHSA-N 267.285 -0.269 5 20 CBBD CCOCC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116666151 CIDZHVSQFDTMBO-UHFFFAOYSA-N 298.251 -0.095 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1nnnn1C 1120799821 SHXBWKTUNCGSGL-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD CC(C)[C@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(N)=O 1320011537 BVEXOKIQNNAVCH-NSHDSACASA-N 297.267 -0.190 5 20 CBBD NC[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 1328243614 PFPSSKQOFIGXQN-LURJTMIESA-N 255.234 -0.882 5 20 CBBD CCn1cc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])nn1 1328795834 KKRRWEPCLMSSPH-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCC(O)(CO)CC1 1333616669 RMTRBOHJEZPKNX-UHFFFAOYSA-N 297.311 -0.424 5 20 CBBD O=C(CNCC[N+](=O)[O-])NCCN1CCCCC1 1335454863 ZJESROOSMLYXBR-UHFFFAOYSA-N 258.322 -0.545 5 20 CBBD CN(CCn1cccn1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75722017 KBQSDJNKQWLULL-GFCCVEGCSA-N 294.315 -0.019 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C2CCOCC2)CC1 81035498 UDBMVQSVNDNUIZ-VXGBXAGGSA-N 283.328 -0.025 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](CN)C1 124292287 WUPMWRWTDSUVJH-VIFPVBQESA-N 281.316 -0.352 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)Cn1nccc1[N+](=O)[O-] 128010807 HHKDNZDHMIPPJA-MRVPVSSYSA-N 281.272 -0.342 5 20 CBBD Cc1cc(C(=O)NCC(=O)N2CC(O)C2)ccc1[N+](=O)[O-] 183898281 GCCMIRZZBFESIC-UHFFFAOYSA-N 293.279 -0.164 5 20 CBBD NC(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 247714404 MJUXRSNHXQPQRB-LURJTMIESA-N 266.261 -0.331 5 20 CBBD C[C@]1(CN)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 262078757 SZQHHHXSUUWZTB-LLVKDONJSA-N 267.289 -0.011 5 20 CBBD Cc1cc(N2CCN[C@@H](C(N)=O)C2)ncc1[N+](=O)[O-] 266806265 DPSFKZCDNBZWFY-MRVPVSSYSA-N 265.273 -0.438 5 20 CBBD C[C@@H](O)CN(CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 289375894 BUCFEXQGDCWEKL-SECBINFHSA-N 297.311 -0.131 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCCNC1 290075371 WFRAYBXOCGDQKK-SECBINFHSA-N 267.289 -0.093 5 20 CBBD Nc1ccc(N2CCN3C(=O)NC[C@H]3C2)nc1[N+](=O)[O-] 312486200 JHZMTZFVXTXJNM-ZETCQYMHSA-N 278.272 -0.214 5 20 CBBD COC(=O)[C@H]1CNC(=O)CN1C(=O)c1ccc([N+](=O)[O-])o1 344912304 LELIXVMNDFVIRC-ZCFIWIBFSA-N 297.223 -0.699 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@@H](C)C(N)=O)c1[N+](=O)[O-] 344952070 CTSOXDZPGHPBIM-YFKPBYRVSA-N 269.261 -0.126 5 20 CBBD O=C(NC[C@@H](O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])cnc1O 347098458 ZCZVVVXJWDSFMC-GMSGAONNSA-N 297.267 -0.177 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC1(O)CCC1 353476710 AOHKSUCXMMFOHC-LLVKDONJSA-N 284.316 -0.001 5 20 CBBD CC[C@@]1(O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 495194073 NNGSRXUOCYYIJJ-VXGBXAGGSA-N 284.316 -0.001 5 20 CBBD CCn1cc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)nn1 598141160 QSTMSZIADGXMMM-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)[C@@H]1C[C@H]1[N+](=O)[O-] 840670219 DCROEYKTMCARSD-RNFRBKRXSA-N 270.201 0.000 5 20 CBBD COC(=O)[C@@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 843065201 KEPWPBNNIROSSD-MNOVXSKESA-N 284.268 -0.248 5 20 CBBD Cn1ccc(N2CCC[C@H](NCC[N+](=O)[O-])C2=O)n1 905135680 JGEOKDUHFOVVPZ-VIFPVBQESA-N 267.289 -0.218 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NS(=O)(=O)C(F)F 1116122408 VQTGMNPRQJJXLT-UHFFFAOYSA-N 298.227 -0.150 5 20 CBBD CCCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 1120797299 DQGOAOHQZVBDLK-LURJTMIESA-N 269.261 -0.038 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 1321590505 UBEOXCGVNNGXPY-LURJTMIESA-N 267.245 -0.426 5 20 CBBD NC(=O)[C@@H]1CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])CCO1 1610635072 BKGKWMHBWBPCAR-QMMMGPOBSA-N 296.239 -0.622 5 20 CBBD NC(=O)C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 28273683 NOOKUVKXAVIVOE-UHFFFAOYSA-N 281.272 -0.485 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 88373844 LDBROEUHTXAHRY-ZETCQYMHSA-N 269.213 -0.152 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 110707608 RJHAXXJLVRQURF-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD CN[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 134202596 UZFSHWNICVLDPK-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD CNC(=O)CCN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 171505128 HAQAZWBBARNCBJ-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NCCn1ccc([N+](=O)[O-])n1 193582974 CLNPGVMBYWRBEK-SCZZXKLOSA-N 267.289 -0.095 5 20 CBBD CO[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 227263772 SMBPVZIJEXINSE-SSDOTTSWSA-N 257.202 -0.248 5 20 CBBD C[C@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C(N)=O 272160651 DLOVIDQZIOGZFE-YFKPBYRVSA-N 281.224 -0.073 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2)C1 276163891 AJSIBTIFHLMIBQ-VIFPVBQESA-N 292.251 -0.045 5 20 CBBD CCc1nn(C)c(N2CCN[C@H](C(N)=O)C2)c1[N+](=O)[O-] 288178484 QXERBONBHXDVFR-QMMMGPOBSA-N 282.304 -0.846 5 20 CBBD CC(=O)N1CC(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 346481884 GNWDIXOVADOEIQ-UHFFFAOYSA-N 267.245 -0.413 5 20 CBBD CCN(CCOCCO)c1nccc(C(N)=O)c1[N+](=O)[O-] 357691881 PEFQLAFUEHCTKU-UHFFFAOYSA-N 298.299 -0.076 5 20 CBBD Cn1nnnc1CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 445212031 LGTWZDNKFRABRF-UHFFFAOYSA-N 279.216 -0.851 5 20 CBBD O=C(CCNC(CO)CO)Nc1ccc([N+](=O)[O-])cc1 515069670 KNLGUIDSWFUAQM-UHFFFAOYSA-N 283.284 -0.134 5 20 CBBD Cn1cnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 562186729 QLRRILJVWZIMGW-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 563381165 LHKIPKDGLTVVGY-SSDOTTSWSA-N 295.299 0.238 5 20 CBBD O=C(NCCCn1cncn1)c1cc([N+](=O)[O-])n[nH]1 586407930 DXYKQEVVMAHNCM-UHFFFAOYSA-N 265.233 -0.271 5 20 CBBD NC(=O)C1(CNc2ccc(N)c([N+](=O)[O-])n2)CCOCC1 590577903 KVPDXBGLEYFPLB-UHFFFAOYSA-N 295.299 0.266 5 20 CBBD Cc1noc(CN2CCOC[C@H]2CC(N)=O)c1[N+](=O)[O-] 595524103 XREMQHFDHRHLOE-MRVPVSSYSA-N 284.272 -0.033 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@H](COC)C(N)=O)c1[N+](=O)[O-] 760077275 OWQSUTXLUVZOKS-SSDOTTSWSA-N 299.287 -0.500 5 20 CBBD Cc1cc(N2CC[C@H](NCC[N+](=O)[O-])C2=O)n(C)n1 905137450 TVFYIAFOICEESF-VIFPVBQESA-N 267.289 -0.300 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1C[C@@H](CO)[C@H](CO)C1 1118837857 OYQFLHPNLCXBMA-QWRGUYRKSA-N 297.311 -0.711 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])c1)C(=O)N(C)C 1319112327 BVWICYYMYPIPJV-SSDOTTSWSA-N 269.261 -0.616 5 20 CBBD CN(C)c1nc(N)nc(Cn2ccc(=O)c([N+](=O)[O-])c2)n1 1319268823 UIXYVQHJSLJHGR-UHFFFAOYSA-N 291.271 -0.362 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322774305 PSJBBJQLUDFJNG-LHLIQPBNSA-N 270.245 -0.412 5 20 CBBD CC[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@@H]1O 1324550295 LSIKHEUEEZANOO-CABZTGNLSA-N 295.295 -0.014 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1326995728 FQGTXRHCDCLGTM-YUMQZZPRSA-N 284.272 -0.558 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(n2cncn2)C1 1341457226 VCMMQWKSWVCGMR-UHFFFAOYSA-N 277.244 -0.383 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCN1CCCCC1 48892497 TUCNTFHYTYUHEJ-UHFFFAOYSA-N 282.304 -0.212 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(CCO)CC1 105888038 XUUMCEYHYNLKSV-UHFFFAOYSA-N 297.315 -0.764 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H]1C(N)=O 195456159 QDKXSWAIUPMVSK-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD Nc1nc(N2CCC[C@H](OCCO)C2)ncc1[N+](=O)[O-] 265181887 DXLPATVVLVMVFX-QMMMGPOBSA-N 283.288 -0.055 5 20 CBBD COC(=O)c1cnc(N2CCNC(=O)C2)c([N+](=O)[O-])c1 276496285 BNNDNHINQPTZRL-UHFFFAOYSA-N 280.240 -0.287 5 20 CBBD COCCN1CC[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1 330588364 YPTNLUSBWOLVGR-SECBINFHSA-N 297.315 -0.221 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1COC1 451289438 WDGSRGJFHBFCJQ-NSHDSACASA-N 270.289 -0.127 5 20 CBBD C[C@@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])CCN1 568761088 JRLLEZIMTBKREF-MRVPVSSYSA-N 286.313 -0.028 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCN1CC[C@@H](O)C1 600537125 XXJRRXHFNDSYHZ-SECBINFHSA-N 294.311 -0.027 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1 793898275 IZJIYEITVSRULN-ZETCQYMHSA-N 293.239 -0.650 5 20 CBBD CCc1[nH]nc(C(=O)NC2CN(C(=O)O)C2)c1[N+](=O)[O-] 827551531 PWHPTCGZTVMBDV-UHFFFAOYSA-N 283.244 -0.028 5 20 CBBD CC1(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 991290831 PHYYWCXUGNAGQV-RKDXNWHRSA-N 267.285 -0.221 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CCN(CCO)C2)CC1 1035186426 DWZVMWMTJAYYKM-VXGBXAGGSA-N 297.355 -0.042 5 20 CBBD COC[C@H](O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1116940594 OFUPRYVCYWQKEA-ZCFIWIBFSA-N 258.234 -0.637 5 20 CBBD C[C@H](c1nnc(N2CCN(C)C(=O)C2)n1C)[N+](=O)[O-] 1121296276 HABLNJRCGHFMPY-SSDOTTSWSA-N 268.277 -0.569 5 20 CBBD COc1cc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])on1 1157767106 HQPUXLZRTQVOJI-NXEZZACHSA-N 298.299 -0.056 5 20 CBBD C[C@@H](CCS(C)(=O)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1253838187 AGEIVSDSMJYRNL-LURJTMIESA-N 290.301 -0.129 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@@H](CN)C1 1326597331 BCFBKNHRMRFJOA-VIFPVBQESA-N 283.288 -0.714 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CNCCO2)c1[N+](=O)[O-] 1326936239 GDBHWVPAUTWETD-SSDOTTSWSA-N 269.261 -0.655 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1(CO)CC1 1329310458 DTVZMTQNPZSGLC-UHFFFAOYSA-N 255.234 -0.830 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](F)C(=O)O)n1 1600971383 ZVLVILVZYBWZLL-BYPYZUCNSA-N 296.236 -0.971 5 20 CBBD O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1n[nH]cc1[N+](=O)[O-] 131395716 ZAPHKMGFPIPQPH-ZCFIWIBFSA-N 279.256 -0.189 5 20 CBBD C[C@@H](CN)CNC(=O)CCn1cc([N+](=O)[O-])cn1 237330694 BAJWLSRVNOSSKQ-QMMMGPOBSA-N 255.278 -0.108 5 20 CBBD NS(=O)(=O)c1ccc(N2CC[C@@H](O)C2)c([N+](=O)[O-])c1 264065879 ALXGZTRJDKPYPV-SSDOTTSWSA-N 287.297 -0.187 5 20 CBBD COC(=O)c1cc(C(=O)NCCC(N)=O)cc([N+](=O)[O-])c1 266105877 RFETYBMRJFDNFA-UHFFFAOYSA-N 295.251 -0.013 5 20 CBBD CN(C)C(=O)NCCNc1ncc([N+](=O)[O-])cc1C(N)=O 271403265 XMKHCXZLFZWLRE-UHFFFAOYSA-N 296.287 -0.228 5 20 CBBD COC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 279963810 JVTLZFCKXUPRMX-ZETCQYMHSA-N 269.257 -0.086 5 20 CBBD COCC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])cn1 336804760 KAJZHLLCJVZQBP-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@H](C)O)c([N+](=O)[O-])n1 339039477 IJTWZJGPGZRLCJ-LURJTMIESA-N 278.290 -0.530 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCOC[C@]12CCOC2 367010903 OHKTZPWWIGWEKH-FXPVBKGRSA-N 256.258 -0.331 5 20 CBBD CN1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1=O 530624164 VUGFWBSOIFHVQC-UHFFFAOYSA-N 253.262 -0.398 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)C1 593900197 LFSBYXWKQQRNCX-OLQVQODUSA-N 280.240 -0.311 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](O)C1 598530923 ZVQRTNDRLKFURI-HOMQSWHASA-N 293.279 -0.036 5 20 CBBD CC[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 727002411 PVGYFOMCJOENNL-QMMMGPOBSA-N 283.240 -0.436 5 20 CBBD CC(C)NC(=O)NC(=O)[C@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672199 NTKPRWWJXUWHMS-XLPZGREQSA-N 287.272 -0.183 5 20 CBBD COCCn1nnc2c1CCN(CC[N+](=O)[O-])C2 930568678 ADTJGEXNBHUYCJ-UHFFFAOYSA-N 255.278 -0.441 5 20 CBBD O=C(Cn1ncnn1)NCCNc1ncccc1[N+](=O)[O-] 1093889353 BILYRLCBICTJGD-UHFFFAOYSA-N 292.259 -0.795 5 20 CBBD NC(=O)[C@@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 1261648061 QRKDTPPLGPNZOP-ZETCQYMHSA-N 268.229 -0.614 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1nc[nH]n1 1319883620 DQYOHRUIEVZBBA-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD C[S@](=O)CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1335229654 VTOSQYIEDRGAKE-KRWDZBQOSA-N 260.275 -0.184 5 20 CBBD COC(=O)[C@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2CC[N+](=O)[O-] 1598737103 HXRVSFTYTSZFAN-FNCVBFRFSA-N 272.257 -0.400 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])c1 26123591 XYFSACWCTPCQFS-QMMMGPOBSA-N 281.272 -0.342 5 20 CBBD CN1C(=O)CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)C1=O 90031849 GHFCJHAPOZOXGJ-SSDOTTSWSA-N 265.229 -0.056 5 20 CBBD CNC(=O)CCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285493722 IUJOSPQMBPRNNJ-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CCN1C[C@@H](C)O 285820549 WJXDPPKRODUBKK-DTWKUNHWSA-N 297.315 -0.155 5 20 CBBD CC(C)N1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1=O 285922153 CKKUSPUIKOQPEI-SSDOTTSWSA-N 295.255 -0.416 5 20 CBBD CN(C[C@H]1CCC[C@H]1O)C(=O)Cn1cnc([N+](=O)[O-])n1 330460488 QXOWMNNTVSUGFX-RKDXNWHRSA-N 283.288 -0.194 5 20 CBBD COCCN1CC[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1 330588365 YPTNLUSBWOLVGR-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CN1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 330867516 SIYVQPPJELIIJB-MRVPVSSYSA-N 267.245 -0.862 5 20 CBBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)N1CCOCC1 345073839 KPIMISSIQFRWDX-MRVPVSSYSA-N 296.283 -0.100 5 20 CBBD O=C1CN(CC(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C(=O)N1 346891386 RZOGHLPTBOIXAJ-UHFFFAOYSA-N 294.223 -0.209 5 20 CBBD CN(C)CCN(C)C(=O)c1cc([N+](=O)[O-])nn1C 356748321 TXADOPBQZSTBGA-UHFFFAOYSA-N 255.278 -0.038 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(CC(N)=O)C2)c1[N+](=O)[O-] 358137214 NVHFQLJERPGYEL-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD CCC[C@@H](O)[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 565785240 OBLWQTXGBBQOHS-DTWKUNHWSA-N 298.299 -0.176 5 20 CBBD O=[N+]([O-])c1c(N2CCOCC2)ncnc1N1CC[C@@H](O)C1 598594023 DXYOPMADSTVAQR-SECBINFHSA-N 295.299 -0.208 5 20 CBBD NC(=O)[C@H]1CN(c2cccnc2[N+](=O)[O-])CCO1 604520325 MYLPSKFWDLEGRN-MRVPVSSYSA-N 252.230 -0.320 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](O)C(=O)NC 808048165 KPSRJLMBPLWGJI-SSDOTTSWSA-N 271.277 -0.362 5 20 CBBD C[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC(=O)N1 836853464 QFGWWBRZNQKNFH-PELKAZGASA-N 293.279 -0.025 5 20 CBBD CC1(C)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1CCO 839731695 UIWZALUTPFCWKG-NXEZZACHSA-N 271.317 -0.433 5 20 CBBD CN(CCCNc1ccc([N+](=O)[O-])cn1)C(=O)C(N)=O 1109601030 BTJVGPUOEDJDSO-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 1319983522 HSPNPURTJPECBI-NSHDSACASA-N 284.272 -0.482 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 1321966747 JFJHYUVOKYYRSG-VIFPVBQESA-N 298.251 -0.046 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCCCN1 1323401773 BLYARLUYKKEWEO-UHFFFAOYSA-N 266.257 -0.117 5 20 CBBD C[C@H](CS(C)(=O)=O)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1324864020 BGKIHEVXDLAZDU-ZCFIWIBFSA-N 290.301 -0.177 5 20 CBBD NC(=O)[C@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 1326236787 NZUHRFVQWGAZKI-NXEZZACHSA-N 269.257 -0.936 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCNC1CC1 1327074426 VNFZELLGCYETDK-UHFFFAOYSA-N 280.284 -0.375 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@@H](CO)[C@H](CO)C2)c1[N+](=O)[O-] 1330116224 WZKLOBCYTCUKGB-YUMQZZPRSA-N 298.299 -0.447 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCn1cncn1 1338606289 VHIKRZRXANGRTG-UHFFFAOYSA-N 292.255 -0.836 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](C)c2nnnn2C)c1[N+](=O)[O-] 1514766842 HULKCVACPAFNIS-LURJTMIESA-N 294.275 -0.349 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CCNCC1 1579411231 SNLWOOHPLVRPGO-MRVPVSSYSA-N 282.304 -0.309 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](F)[C@H](N)C2)n1 1579969093 CPCWKQHBZUNYJD-RNFRBKRXSA-N 271.252 -0.160 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 112668993 RDBCBPUPOPFMAW-QMMMGPOBSA-N 283.240 -0.063 5 20 CBBD Cc1cc(=O)n(CCC(=O)NC(N)=O)cc1[N+](=O)[O-] 123382690 CEUQQTZYYUDROJ-UHFFFAOYSA-N 268.229 -0.350 5 20 CBBD NC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])s2)CCO1 350486834 ZDQJAERFQLMIIQ-RXMQYKEDSA-N 258.259 -0.258 5 20 CBBD Cn1cc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1C(N)=O 357710047 TWIHVXSIONNIQX-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD Nc1nc(N2CC[C@@H](c3nc[nH]n3)C2)ncc1[N+](=O)[O-] 425278608 DPFQOUULJZUUMY-ZCFIWIBFSA-N 276.260 0.079 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N=c1nc[nH]n1C 531890257 VKLFBHZHESKXBX-UHFFFAOYSA-N 250.218 -0.264 5 20 CBBD Cc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 540874401 UOKFSWJSPRBLIC-SECBINFHSA-N 278.268 -0.022 5 20 CBBD Nc1nccc(C(=O)NC[C@H]2COCCO2)c1[N+](=O)[O-] 567121712 NDUMJFFTJJFGPD-ZETCQYMHSA-N 282.256 -0.283 5 20 CBBD Cn1cncc1CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 573770230 YLWXTHKTDCMBLH-UHFFFAOYSA-N 290.283 0.477 5 20 CBBD Nc1ccc(N2C[C@@H](CO)[C@H](CO)C2)nc1[N+](=O)[O-] 599127610 JBRZPPFFWWRNOJ-YUMQZZPRSA-N 268.273 -0.391 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1nnnn1C1CC1 610303595 VDWPYWJWRGZALM-UHFFFAOYSA-N 292.259 -0.571 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)OCc2nc(O)n[nH]2)n1 755575315 MGRZCIRGQMFCDG-UHFFFAOYSA-N 282.216 -0.008 5 20 CBBD CNc1c(C(=O)NN2CC(=O)NC2=O)cccc1[N+](=O)[O-] 765372572 QLLURURAGLPQLZ-UHFFFAOYSA-N 293.239 -0.167 5 20 CBBD C[C@@H]1C[C@@H](N2CCOCC2)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839762578 SMSGCLMWHYFIJJ-DDHJBXDOSA-N 283.328 -0.027 5 20 CBBD O=C(NCC1CN(C(=O)c2cnco2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001795655 JFMCQDXMSQOPCF-RKDXNWHRSA-N 294.267 -0.472 5 20 CBBD CC(C)(F)C(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001797064 VIPLVPRKQZHHOA-RKDXNWHRSA-N 287.291 -0.026 5 20 CBBD Cn1ccnc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020139040 OCZVDOLBSBLCTQ-GWOFURMSSA-N 293.327 -0.178 5 20 CBBD O=C(N[C@H]1C[C@@H](NCCn2cncn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022063840 MKYULPGVVYHAAN-LMLFDSFASA-N 294.315 -0.820 5 20 CBBD CN[C@@H](C)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1118260758 HXQKIWGPYLEXOE-VIFPVBQESA-N 282.300 -0.129 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@H]2[C@H](C1)C2(F)F 1329611839 CUUOVVXVMXKIDK-WDSKDSINSA-N 273.199 -0.090 5 20 CBBD C[C@@]1(C(=O)O)CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 1776508530 LFNRHXTZOZDWMA-JTQLQIEISA-N 283.244 -0.353 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 186934177 RPWNIWADJOUSQK-KOLCDFICSA-N 297.315 -0.685 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1cc([N+](=O)[O-])c[nH]1 229620970 AVAJBTBCENWDQU-SNVBAGLBSA-N 255.230 -0.196 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@@H](CO)O1 230007573 LESXYHMDAANYGA-CBAPKCEASA-N 254.246 -0.029 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 264159452 JBHYSEFUTYNNSM-UHFFFAOYSA-N 271.233 -0.792 5 20 CBBD C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@H](O)C1 278556870 BFKUKUQKNZCIGM-FXAINCCUSA-N 295.295 -0.041 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1CCn1cc([N+](=O)[O-])cn1 305129915 MMWMSGRCCFTIIA-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c1 344067564 PVEHDEWHQRQEBL-SQNXGDPESA-N 296.327 -0.145 5 20 CBBD Cn1c(C(=O)N2C[C@@H](O)C[C@H]2CO)ccc1[N+](=O)[O-] 347735683 RMEHIISGWDNKGA-YUMQZZPRSA-N 269.257 -0.499 5 20 CBBD O=C1NC(=O)N2CCN(CCn3ccc([N+](=O)[O-])n3)C[C@@H]12 352772475 QSFGTDCFADVIIB-QMMMGPOBSA-N 294.271 -0.973 5 20 CBBD CN1CC[C@@](O)(CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1 358043415 HOEPZCGMFVLZGN-GFCCVEGCSA-N 297.315 -0.636 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](O)[C@@H](CO)C2)n1 396812933 QSYXDWXGYLHESU-GMSGAONNSA-N 297.267 -0.133 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])o1 443803773 QHADXTRRUYGUNU-UHFFFAOYSA-N 257.202 -0.581 5 20 CBBD Cn1c(C(=O)N2CC[C@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-] 545283564 RGLZVUHYNDUGGL-PSASIEDQSA-N 283.284 -0.251 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1COC[C@H]1O 563137187 ASSBVRXVFYNERZ-HOSYDEDBSA-N 298.295 -0.316 5 20 CBBD C[C@@]1(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])CCC(=O)N1 576051285 CHEZJJDKQDIHOC-LBPRGKRZSA-N 293.283 -0.030 5 20 CBBD NCCN(CCOc1ccccc1[N+](=O)[O-])C[C@@H](O)CO 595903714 ZYJYNWLCPUODQV-LLVKDONJSA-N 299.327 -0.413 5 20 CBBD CO[C@@]1(C(=O)O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 600869430 JWYKDVQVDKFJMD-NSHDSACASA-N 298.255 -0.507 5 20 CBBD CC(CO)(CO)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 820281221 UEDYJYAUYHOUAE-UHFFFAOYSA-N 294.271 -0.070 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@H](S(C)(=O)=O)C1 1327046002 FOMKZFAITDCZEB-ZETCQYMHSA-N 274.302 -0.048 5 20 CBBD O=Cc1ccc(OCC(=O)N[C@@H]2CNOC2)c([N+](=O)[O-])c1 1580858521 PCIXQCWLIPJPPB-SECBINFHSA-N 295.251 -0.194 5 20 CBBD CC1(C(=O)O)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1593807571 GBEACHFSLMCXPS-VIFPVBQESA-N 284.272 -0.441 5 20 CBBD Cn1c(C(=O)N2CCC[C@@H](O)[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 1600899001 COTQLZXMOUMDGS-PSASIEDQSA-N 297.267 -0.017 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCN2CCOCC2)c1 1608862936 IZKZTZKQLNOYDY-UHFFFAOYSA-N 297.267 -0.213 5 20 CBBD N[C@@H]1C[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 36263987 SZRJTELTEBDRFJ-BDAKNGLRSA-N 257.271 -0.027 5 20 CBBD CCCc1[nH]nc(C(=O)N(C)CC(N)=O)c1[N+](=O)[O-] 264664966 JMIBYTZTMQNXMV-UHFFFAOYSA-N 269.261 -0.172 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H]2CNC[C@@H]2C1 290073546 IJYSUAOJNZQNQO-NXEZZACHSA-N 279.300 -0.141 5 20 CBBD CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CC(=O)NC1=O 299512864 JECMXZWVCOUOOZ-ZETCQYMHSA-N 295.255 -0.945 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1 456076308 YZBAYDJZPFERTN-LURJTMIESA-N 281.272 -0.104 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H](C)O 527195586 HXKGEBJWSFVVNW-RCOVLWMOSA-N 283.240 -0.358 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592308400 LIUIEOGZDDNTNE-SVRRBLITSA-N 269.261 -0.494 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592368927 SJPIAGBVUMNDAX-LURJTMIESA-N 270.201 -0.757 5 20 CBBD O=C(N[C@H]1CCNC[C@H]1O)c1cc([N+](=O)[O-])c[nH]1 710372248 BMDDVJIVKYZFLU-IONNQARKSA-N 254.246 -0.625 5 20 CBBD COC(=O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840460383 SDMNHHMMDOHGIS-DJLDLDEBSA-N 272.257 -0.558 5 20 CBBD Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(=O)NCCO 843827546 WYLMPMDRKUESJB-UHFFFAOYSA-N 299.258 -0.119 5 20 CBBD Cc1cc(N(C)CCNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1100294653 HKMQETMXWMKCPX-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@](C)(O)CN(C)C)c1[N+](=O)[O-] 1116367166 SJULYJPRFRYHKH-LBPRGKRZSA-N 299.331 -0.321 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@@H]([C@@H](C)N)C2)c1[N+](=O)[O-] 1118139947 DBUAKYRRZQNGHY-VXNVDRBHSA-N 297.315 -0.175 5 20 CBBD Cc1nc(N2CC(NS(C)(=O)=O)C2)ncc1[N+](=O)[O-] 1331325874 OUJOZONMXUIKLT-UHFFFAOYSA-N 287.301 -0.569 5 20 CBBD NC(=O)c1cc(N2C[C@H](O)C[C@H]2CO)ccc1[N+](=O)[O-] 1347231529 PWDKUFDPBLCIDO-DTWKUNHWSA-N 281.268 -0.374 5 20 CBBD O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCNC[C@@H]1CO 1580474956 CYFBVZBNIYAJRW-VXGBXAGGSA-N 295.295 -0.579 5 20 CBBD C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1593406493 CJLHTJSJUYARDV-NSHDSACASA-N 284.224 -0.134 5 20 CBBD CN1C[C@@H](C(=O)O)N(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 1606199472 FXLJAUPQLQWYMZ-QMMMGPOBSA-N 296.239 -0.710 5 20 CBBD O=C(O)c1cn(C2CN(Cn3nccc3[N+](=O)[O-])C2)nn1 1610860834 YGSGMWPHFGDZCH-UHFFFAOYSA-N 293.243 -0.405 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCOCCO 49933938 RJMALERGRWTIEQ-UHFFFAOYSA-N 257.246 -0.328 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1c1ncc([N+](=O)[O-])cn1 129620278 FROZAAWGEMNPHI-VXNVDRBHSA-N 254.246 -0.029 5 20 CBBD CCC[C@H](O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 134409364 ZJAQLZIMRZKXND-WDEREUQCSA-N 272.305 -0.097 5 20 CBBD CCCCN(CC(N)=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173537844 XVTQNVMAPZYHRG-LLVKDONJSA-N 299.331 -0.260 5 20 CBBD C[C@@H]1CCNC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 186820327 BUCRDJPIUVKGFK-RKDXNWHRSA-N 267.289 -0.095 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCN3CCC[C@H]3C2)c1 246818811 CCJMQDKFHNTXMF-AAEUAGOBSA-N 295.343 -0.068 5 20 CBBD CN(CCN1CCCC1)C(=O)Cn1cnc([N+](=O)[O-])n1 332359764 SWDWUKQFJNAWKA-UHFFFAOYSA-N 282.304 -0.260 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 343264095 QIUGYRQGRXCHON-ZETCQYMHSA-N 284.228 -0.668 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H](O)[C@H]1CCOC1 346418500 KQDLCWJWTLHCRS-XVKPBYJWSA-N 296.283 -0.102 5 20 CBBD COC[C@@H](CO)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 357708169 OFSAHQZUAVBNLD-MRVPVSSYSA-N 286.288 -0.350 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@H](CO)[C@H](O)C1 546693804 RNUWGOPCRAZIKD-GMSGAONNSA-N 297.267 -0.489 5 20 CBBD CC1=NNC(=O)[C@H]1CCNc1ncc([N+](=O)[O-])cn1 546886134 FYMMQYIHWUTUTB-QMMMGPOBSA-N 264.245 0.309 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 593816578 ZUPYLPZLPFLMCE-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCc3c[nH]nc3C2)c1 611008717 HVDPGCFPDHQASA-LLVKDONJSA-N 292.299 -0.066 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCNC1=O 619867683 FOZIXVABXQZSAO-QMMMGPOBSA-N 281.272 -0.566 5 20 CBBD CCN(CCNc1ncccc1[N+](=O)[O-])C(=O)C(N)=O 1106943588 RLOWYVXHILKWHK-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD O=C(NCCNCCOCC1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126939420 XTMQZUHGYAXNFT-GHMZBOCLSA-N 271.317 -0.216 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@H]2CNC(=O)C2)c1 1261595408 SCZJFKGHTQQHCK-SSDOTTSWSA-N 295.251 -0.321 5 20 CBBD O=C(NCCCN1CCC(O)CC1)c1n[nH]cc1[N+](=O)[O-] 1319616247 OZTWYBLYUFXAKM-UHFFFAOYSA-N 297.315 -0.106 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCC(O)(CO)CC2)c1 1327548645 JTYOXXAHHCYKSK-UHFFFAOYSA-N 270.289 -0.390 5 20 CBBD CS(=O)(=O)N1CCC(NCC[N+](=O)[O-])CC1 1336136597 RNAJSYSDNNYEDI-UHFFFAOYSA-N 251.308 -0.723 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(C(=O)O)CC1 203657172 BKLPOLPIPLDGGL-UHFFFAOYSA-N 254.202 -0.475 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCNCC1 262227858 PWUUQYXCXKIACG-UHFFFAOYSA-N 293.327 -0.188 5 20 CBBD COC[C@](C)(N)CNc1ncc([N+](=O)[O-])c(N)n1 265078982 ZOZQRGCWYFWXRH-SECBINFHSA-N 256.266 -0.257 5 20 CBBD O=C1CN(CCNc2ncc([N+](=O)[O-])s2)CCN1 282050784 XVXBNEPYVYJNKN-UHFFFAOYSA-N 271.302 -0.105 5 20 CBBD O=C(NCCNC(=O)C1CC1)c1n[nH]cc1[N+](=O)[O-] 343097182 MTLSZYQDTCKSQK-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 343174029 FZYUKYRDFKYMRJ-RXMQYKEDSA-N 253.218 -0.592 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCn2c(O)nnc2C1 354790963 OTQKUKRSVBVZTN-UHFFFAOYSA-N 279.216 -0.729 5 20 CBBD CC(C)[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 355743552 CLJIIRKCOXOVGI-JTQLQIEISA-N 283.284 -0.110 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCCc1nc(O)n[nH]1 361600691 HHWJVPMEMPVKJG-UHFFFAOYSA-N 295.259 -0.485 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 412429866 VXYVHAGROOHHRO-HZGVNTEJSA-N 270.241 -0.228 5 20 CBBD COC[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(=O)OC 445133818 IXFAOUDCPABEOC-ZETCQYMHSA-N 299.239 -0.387 5 20 CBBD CNc1ccc(C(=O)NC(CO)CO)cc1[N+](=O)[O-] 527195463 ZRJPYMZRDOHKMI-UHFFFAOYSA-N 269.257 -0.281 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(c2c([N+](=O)[O-])c(C)nn2C)C1 592003994 JPAHNHZCMUKIIG-DTWKUNHWSA-N 298.299 -0.003 5 20 CBBD O=C1CCC(C(=O)OCCn2ccc([N+](=O)[O-])n2)=NN1 748104297 ZSOUJXDEALFDFP-UHFFFAOYSA-N 281.228 -0.400 5 20 CBBD CN1CCN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1(C)C 839757262 HWBKAKBELURTON-GHMZBOCLSA-N 284.360 -0.206 5 20 CBBD COC(CN(CCCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])OC 840423420 BFWSBOMIFCPZHU-RKDXNWHRSA-N 276.289 -0.519 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](N2CC[C@H](O)C2)C1 861720317 XVDNSIFNMFJXHP-UKKRHICBSA-N 269.301 -0.681 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ncn(C)n1 1338598643 RRFYFFFIANRIPN-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD C[C@@H]1[C@H](C(=O)O)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1594166602 YOASSKKSCBJOTA-DVVUODLYSA-N 298.299 -0.053 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1601770882 ZXYIKEVCHCWFNA-PHDIDXHHSA-N 284.228 -0.775 5 20 CBBD COC(=O)[C@H](CF)NC(=O)c1cc([N+](=O)[O-])nn1C 360495111 FWLWXBWYIDFAFB-YFKPBYRVSA-N 274.208 -0.431 5 20 CBBD Nc1nc(Sc2n[nH]c(CO)n2)ncc1[N+](=O)[O-] 530352590 GPTGNWPSZVZTFG-UHFFFAOYSA-N 269.246 -0.271 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 548082307 NWFUXEGZMNHEKR-ZETCQYMHSA-N 267.245 -0.202 5 20 CBBD COCC(=O)NC1CN(c2c([N+](=O)[O-])ncn2C)C1 548448051 NDRRWEICYGFOSE-UHFFFAOYSA-N 269.261 -0.721 5 20 CBBD CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](CO)O1 562948022 WPRSUUIZNYJECC-ZETCQYMHSA-N 284.272 -0.070 5 20 CBBD Cn1ccc(=NCCN=c2ccc(N)c([N+](=O)[O-])[nH]2)[nH]1 596212442 GZKFIHWIHJACFJ-UHFFFAOYSA-N 277.288 -0.327 5 20 CBBD CNc1nccc(C(=O)NC/C=C\CO)c1[N+](=O)[O-] 597990997 CJKNJGYSYWTISM-IHWYPQMZSA-N 266.257 0.310 5 20 CBBD CN(CCNC(=O)Cn1cnc([N+](=O)[O-])n1)CC(F)F 600801339 FGMZWSRDFRQVSA-UHFFFAOYSA-N 292.246 -0.501 5 20 CBBD Nc1nc(NCc2nnnn2C2CC2)ncc1[N+](=O)[O-] 610282291 KMXRWJKPFIYFFU-UHFFFAOYSA-N 277.248 -0.100 5 20 CBBD CC(C)[C@@H](CO)ONC(=O)c1c[nH]nc1[N+](=O)[O-] 857286253 VZZGRWINYOHCJS-SSDOTTSWSA-N 258.234 -0.004 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@H](O)CC1 1324332004 NGGXJOOCRSQYEK-QMMMGPOBSA-N 269.261 -0.440 5 20 CBBD Cc1noc(Cn2nnc3c(cnn3C)c2=O)c1[N+](=O)[O-] 1327951237 FZPRJOOUSPIRAJ-UHFFFAOYSA-N 291.227 -0.222 5 20 CBBD CNC(=O)[C@@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1329426493 FCVKEUXMLHPVTD-GHMZBOCLSA-N 283.284 -0.675 5 20 CBBD COC(=O)C1CC2(C1)CN(CC[N+](=O)[O-])C[C@H]2C(=O)O 1593824647 QWEJLNQDWGGTLA-XEVUQIKYSA-N 286.284 -0.151 5 20 CBBD NC(=O)NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 153653439 ITUYVUIGSGZUGD-UHFFFAOYSA-N 274.620 -0.395 5 20 CBBD Cc1cc(=O)n(C[C@H](O)CC(=O)O)cc1[N+](=O)[O-] 166915242 OEHREEMORRKGIM-SSDOTTSWSA-N 256.214 -0.099 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2CCO[C@H](C(=O)O)C2)n1 231664582 OBSXFKLYYSFUOI-ZETCQYMHSA-N 256.218 -0.382 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC(=O)O 262140895 NJOINDMTIVCDAG-UHFFFAOYSA-N 256.218 -0.309 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 354068166 LOMHOSOZZPWIKV-ZCFIWIBFSA-N 269.261 -0.119 5 20 CBBD COC(=O)c1n[nH]cc1NC(=O)Cn1cnc([N+](=O)[O-])n1 356895963 NKNPDAQXAHJZCC-UHFFFAOYSA-N 295.215 -0.665 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 440964164 NLPBFMHJEJIQKK-QWRGUYRKSA-N 297.315 -0.637 5 20 CBBD CCN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 452971883 YWXHPSLYCKFWKN-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD CN([C@H]1CCNC1)S(=O)(=O)c1cccnc1[N+](=O)[O-] 576703373 PXEYQXGNZVOIFP-QMMMGPOBSA-N 286.313 -0.028 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCO 603824335 DFGPRBQLJNXLBE-VIFPVBQESA-N 256.258 -0.084 5 20 CBBD CC(C)(C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 610845378 DICJOFVYJPSWLH-SSDOTTSWSA-N 285.260 -0.198 5 20 CBBD Nc1nc(N2CCCN(CC(=O)O)CC2)ncc1[N+](=O)[O-] 738453412 IQLMVCQVTYWETP-UHFFFAOYSA-N 296.287 -0.436 5 20 CBBD COC(=O)CCC(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672616 DIUONWZVYBHLMO-HTQZYQBOSA-N 259.214 -0.283 5 20 CBBD O=C(NCCNCCOCC(F)F)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936815 SJULPYQQQDHGIX-HTQZYQBOSA-N 281.259 -0.361 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NS(=O)(=O)C(F)F 1248746900 LKTNREIKYQPXPH-UHFFFAOYSA-N 284.200 -0.540 5 20 CBBD COC(=O)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1252901695 LNFGXRFKSJCTPI-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD O=C(NC[C@@H]1CCCS1(=O)=O)c1c[nH]nc1[N+](=O)[O-] 1328618915 NUAONINJWQZHDK-LURJTMIESA-N 288.285 -0.375 5 20 CBBD C[C@@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCNC1 1350422922 LCHBWFHVEPWPEY-SECBINFHSA-N 254.250 -0.946 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1 1610802324 CEJQDYGTRBLATE-ZJUUUORDSA-N 296.235 -0.040 5 20 CBBD O=C1NC[C@@H]2CN(CCn3ccc([N+](=O)[O-])n3)CCN12 175934941 KQGRXNXFZKRUKB-SECBINFHSA-N 280.288 -0.499 5 20 CBBD CC(C)(NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262438224 NKGOZICJSAPWNL-UHFFFAOYSA-N 283.240 -0.264 5 20 CBBD CC[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 263315111 YTBZZNWMYHYONW-RXMQYKEDSA-N 256.218 -0.079 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CC1=O 273290633 LALQCJXCGDVFTP-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CCCNC1=O 330707511 UWAMMSFRPIHEAO-SSDOTTSWSA-N 267.245 -0.814 5 20 CBBD COCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 337058903 QXESFVBSIHPHGN-UHFFFAOYSA-N 269.261 -0.176 5 20 CBBD N=C(O)OCCNC(=O)c1cc([N+](=O)[O-])cnc1O 495235882 DRPRUJKKYBFBNP-UHFFFAOYSA-N 270.201 -0.065 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H]1[C@@H]2CNC[C@@H]21 583630902 YPAFMABQTMIRAB-QMSLJYSESA-N 284.297 -0.514 5 20 CBBD CC(=O)N[C@H]1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 594372468 DOIIGDPJKXFVMO-QMMMGPOBSA-N 293.283 -0.077 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(c2ccc(N)c([N+](=O)[O-])n2)C1 596289391 OSYSVCNFPWHZPT-YUMQZZPRSA-N 296.283 -0.068 5 20 CBBD CC(=O)NC[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 609802869 WESLEDOWJRMEIM-SECBINFHSA-N 283.288 -0.330 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(C)(C)CO 610369761 UNSFKTMFVVZCOC-JTQLQIEISA-N 272.305 -0.145 5 20 CBBD NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 702037911 SQMUTVCUVLGLAM-MRVPVSSYSA-N 253.262 -0.402 5 20 CBBD CN(C)C(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 766625439 NEFONOCNAWZHDM-UHFFFAOYSA-N 256.218 -0.427 5 20 CBBD COC(=O)CCCONC(=O)c1c([N+](=O)[O-])cnn1C 811562310 MIPNFLLKOUCATM-UHFFFAOYSA-N 286.244 -0.057 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]n1 973041168 WAHFDLOKVJIOIH-FDDDBJFASA-N 293.283 -0.548 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 1325038308 QKNLPAMHTSOGJQ-YFKPBYRVSA-N 253.218 -0.755 5 20 CBBD Cn1cc([C@H](O)CNC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 1345100328 PEZFARPTXLIWRS-MRVPVSSYSA-N 280.244 -0.485 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCOC[C@H]1C(=O)O 1594665041 MUCKQMYIQHVJST-QMMMGPOBSA-N 296.239 -0.502 5 20 CBBD O=C(O)C[C@@H](O)CNc1ccnc(O)c1[N+](=O)[O-] 1601913242 ZSLDGFUXJMZPKP-RXMQYKEDSA-N 257.202 -0.057 5 20 CBBD CCNC(=O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 5038987 FFANZZPPOQHGOX-UHFFFAOYSA-N 268.229 -0.398 5 20 CBBD COC(=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 72022818 YAXOITHEPLNWEN-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CNC(=O)[C@@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O 90519162 IYVMZOYMNZWXCF-NSHDSACASA-N 294.311 -0.033 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)O 167329333 UPUPIJCWNSDUJK-ZCFIWIBFSA-N 271.229 -0.237 5 20 CBBD CNC(=O)c1ccc(NC[C@H](O)CO)c([N+](=O)[O-])c1 211243305 ZMEVVKVYKNQVLL-QMMMGPOBSA-N 269.257 -0.281 5 20 CBBD CCOC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 312377257 MTXUCADGPXBJMU-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)NCCF 337073759 ZQCXDCUDISTFIH-SSDOTTSWSA-N 287.251 -0.618 5 20 CBBD Cc1cnc(OCC(=O)NCC(=O)O)c([N+](=O)[O-])c1 516467670 HTHBSMJULUGYJP-UHFFFAOYSA-N 269.213 -0.122 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN([C@@H]2CCOC2)CC1 586796862 WEJJWWXRYQQTFI-SECBINFHSA-N 295.299 -0.135 5 20 CBBD C[C@H](CO)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 611019429 MSGIJUVZLJODSQ-ZETCQYMHSA-N 275.286 -0.104 5 20 CBBD COCC(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 795575291 RSXKSCLSNZRPTA-UHFFFAOYSA-N 257.202 -0.299 5 20 CBBD C=CC(=O)N(C)CC(=O)NCCn1cc([N+](=O)[O-])cn1 860245357 CFKDGVMHNFPLFC-UHFFFAOYSA-N 281.272 -0.448 5 20 CBBD Cc1nc(CN2CC(N(C)C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 1042710830 LIOUGDNQCGDAAG-NXEZZACHSA-N 294.315 -0.579 5 20 CBBD NC(=O)C(=O)NC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 1057932991 WGPYVPVMLFCCDQ-UHFFFAOYSA-N 293.283 -0.440 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](CO)[C@H](O)C1 1117121226 CATPCJSFKRMFOD-HTRCEHHLSA-N 270.245 -0.867 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1327076568 ZIXCLFFBNGVPQW-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD CN(CCN1CCOCC1)c1nnc(C[N+](=O)[O-])n1C 1338205033 CRROUQDQNISBNO-UHFFFAOYSA-N 284.320 -0.640 5 20 CBBD C[C@@H]1[C@@H](C(=O)O)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1594166604 YOASSKKSCBJOTA-IEBDPFPHSA-N 298.299 -0.053 5 20 CBBD NC(=O)c1ccnc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c1[N+](=O)[O-] 1608246951 KXXRKBSSVLTYLI-JIGDXULJSA-N 292.251 -0.145 5 20 CBBD O=C(O)[C@@H](CO)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 22162068 FYHXCZGDBVUGTI-MRVPVSSYSA-N 290.253 -0.681 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCN1 155010694 YIIYDRNPVXPTFP-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CN(CC(=O)N1CCOCC1)C(=O)c1ccc([N+](=O)[O-])[nH]1 298889134 USJBLWCYKAXUTF-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD CNC(=O)N1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 347407913 HZHBFCVHQRXMNJ-UHFFFAOYSA-N 296.287 -0.575 5 20 CBBD NC(=O)COCCNC(=O)c1ccccc1[N+](=O)[O-] 353161529 GNSJIMAJXKBSQA-UHFFFAOYSA-N 267.241 -0.174 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 358366067 FMPOOMYEQXNSNL-JTQLQIEISA-N 267.245 -0.345 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@H](O)[C@@H]1CCOC1 359017440 JOQYCTAAZPSJEZ-KCJUWKMLSA-N 296.283 -0.069 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])nn1C 362045367 FYKMXQMUKDQSAO-LURJTMIESA-N 270.245 -0.038 5 20 CBBD CN(Cc1nc[nH]n1)c1ncc([N+](=O)[O-])cc1C(N)=O 432927844 OSWDSLGQPZVTIQ-UHFFFAOYSA-N 277.244 -0.157 5 20 CBBD CNC(=O)[C@H](C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 489760694 QWYZXEICLOPMMO-ZETCQYMHSA-N 284.276 -0.775 5 20 CBBD COC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1O 496496188 ZEQLZTWYWLXDLH-UHFFFAOYSA-N 284.228 -0.219 5 20 CBBD COCC(COC)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 517960718 NCLVURURUIXTJL-UHFFFAOYSA-N 284.272 -0.037 5 20 CBBD Cc1nn(C)c(N2CCCNC(=O)C2)c1[N+](=O)[O-] 726787060 MDVGSXSQPVNQBA-UHFFFAOYSA-N 253.262 -0.037 5 20 CBBD CS(=O)(=O)NCCOC(=O)c1ccc([N+](=O)[O-])o1 730597758 KOUZCGNRTYLLDE-UHFFFAOYSA-N 278.242 -0.106 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)NC(N)=O 761977682 ZHQXDCKWFOZWGK-RXMQYKEDSA-N 282.212 -0.270 5 20 CBBD O=C(NOCCO)c1cc2c(c([N+](=O)[O-])c1)OCO2 787296528 ZIFAMQKVIJPDSR-UHFFFAOYSA-N 270.197 -0.023 5 20 CBBD Cn1nccc1[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 887588794 SLAFJMFKMVHMDQ-IEBDPFPHSA-N 280.284 -0.015 5 20 CBBD CC(=O)NCC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-] 1093455874 ZIQVPYHLJUXRKF-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD NC(=O)c1cc(NC[C@@H](O)CO)ccc1[N+](=O)[O-] 1350473992 JGVXLCRUTSTGSM-SSDOTTSWSA-N 255.230 -0.541 5 20 CBBD C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1356533418 DECWMAAWRAUMRP-VXNVDRBHSA-N 296.291 -0.974 5 20 CBBD O=C(N[C@]1(C(=O)O)C[C@H](O)C1)c1cc([N+](=O)[O-])c[nH]1 1608493794 DMTPRXSAIPZEER-XGAOUMNUSA-N 269.213 -0.369 5 20 CBBD NC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3383650 NQQIEYCHYLZMIS-UHFFFAOYSA-N 267.197 -0.054 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1 188521005 QDSALYMFLDKFBB-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCCCO)c1 236497733 JWUYMJGABAQLLV-SNVBAGLBSA-N 258.278 -0.486 5 20 CBBD CC(C)[C@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 236752465 RGKVJIUYUFWUCH-VIFPVBQESA-N 255.278 -0.109 5 20 CBBD CC(C)c1[nH]nc(C(=O)N(C)CC(N)=O)c1[N+](=O)[O-] 269376002 NPJFAEJSYOAUPK-UHFFFAOYSA-N 269.261 -0.001 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NCCOCC(N)=O 277183040 SJUMNHSYBMMUOL-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD NC(=O)[C@@H]1C[C@@H](F)CN1CCn1cc([N+](=O)[O-])cn1 284732870 IJYDZDJLLDRMRU-APPZFPTMSA-N 271.252 -0.311 5 20 CBBD CN1C(=O)C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 290826771 UBNVEXGCEBAUIU-ZCFIWIBFSA-N 293.239 -0.742 5 20 CBBD CN(C)S(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 292088697 XTFPNXXGSQEDPV-UHFFFAOYSA-N 290.301 -0.456 5 20 CBBD C[C@H]1COCCN1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 330627723 XRAVNQGMDZGYOX-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1CCNC1=O 340455587 VROGWPOSGJPSIM-ZETCQYMHSA-N 252.230 -0.117 5 20 CBBD CN(Cc1nnnn1C)c1ncc([N+](=O)[O-])cc1C(N)=O 342221068 ARIGJUDPXHYMBW-UHFFFAOYSA-N 292.259 -0.751 5 20 CBBD O=C(NCCN1C(=O)CCCC1=O)c1n[nH]cc1[N+](=O)[O-] 343300067 PTDKHZDOTSIGRX-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CO)[C@H]1CCCO1 344923211 PSCXYZWZEZVMPZ-NXEZZACHSA-N 298.299 -0.244 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CC[C@@H](CO)O2)c1[N+](=O)[O-] 356542886 GOLSUXUUIZOMMC-SFYZADRCSA-N 284.272 -0.104 5 20 CBBD COC(=O)[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])OC 489044098 OZZLAZNSHIOXRT-SSDOTTSWSA-N 298.255 -0.311 5 20 CBBD CNc1nccc(C(=O)N2CCN(C)C(=O)C2)c1[N+](=O)[O-] 561257274 NRQPQXXOQJRLHR-UHFFFAOYSA-N 293.283 -0.054 5 20 CBBD CC[C@H](NC)C(=O)NCCn1cc([N+](=O)[O-])cn1 595925616 ADLBFJGQMHMIOA-VIFPVBQESA-N 255.278 -0.095 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3C[C@]3(CO)C2)c1 782616048 LRGCNRLVKUOYHX-MVWJERBFSA-N 282.300 -0.534 5 20 CBBD CCc1[nH]nc(C(=O)O[C@@H](C)C(N)=O)c1[N+](=O)[O-] 790072986 GTOBDBHIOFSRBX-BYPYZUCNSA-N 256.218 -0.089 5 20 CBBD O=C(N[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 978794034 DSIQTOFQMLVONH-ULAWRXDQSA-N 291.254 -0.072 5 20 CBBD CN1CCC(ONC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1118701082 ZGJXPIMATGNSFF-UHFFFAOYSA-N 284.276 -0.672 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)CC[C@@H]2C1 1319757509 BXUQIDJNZXMUJH-MRVPVSSYSA-N 293.283 -0.225 5 20 CBBD Cn1nncc1C[S@@](=O)CCn1cc([N+](=O)[O-])cn1 1325940662 PTNHCDDVLDZBBK-IBGZPJMESA-N 284.301 -0.131 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1(CO)CC1 1329385101 ZEGLINAMBHRJQC-ZETCQYMHSA-N 269.261 -0.537 5 20 CBBD COC[C@H](NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(=O)O 1610249833 GXJZMJLBISDEMY-ZETCQYMHSA-N 286.244 -0.684 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])NC(=O)NC1CC1 47169704 LRLPIYOUGZWNCI-UHFFFAOYSA-N 253.218 -0.221 5 20 CBBD COCC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 49245348 CNUSCQMHVODDGA-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD NC(=O)CONC(=O)Cc1ccccc1[N+](=O)[O-] 89463363 RJBMNSRHYHHLSE-UHFFFAOYSA-N 253.214 -0.330 5 20 CBBD CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 163457306 GPSYNUDONDGPQK-JTQLQIEISA-N 298.299 -0.210 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)N1CCCC1 281088579 OTNMVKKWJUKOKZ-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CC(=O)NC1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 331839642 ZKGRIRDBAJMFGF-UHFFFAOYSA-N 295.299 -0.127 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@H](O)COC)c1[N+](=O)[O-] 338680153 JWMZKFUFLRHMFJ-LURJTMIESA-N 272.261 -0.383 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC2(O)CCC2)c1=O 341526421 QOSMSJVKJZXZEA-UHFFFAOYSA-N 267.241 -0.230 5 20 CBBD COCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 343289629 CHGRJJGVGUUUQK-MRVPVSSYSA-N 296.283 -0.203 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1 358080971 QSKLAPISBDDRLF-LBPRGKRZSA-N 295.299 -0.632 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1nc[nH]n1 360686694 ZKGFTYHCLGDRQG-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD CN(CCNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 479135285 VZEMQZZFTGMAKN-UHFFFAOYSA-N 268.277 -0.603 5 20 CBBD CO[C@@](C)(C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 595990478 VOYPHFGTPURZOH-SNVBAGLBSA-N 286.244 -0.603 5 20 CBBD CCc1ccc(C(=O)NC[C@@H](O)C(=O)NC)cc1[N+](=O)[O-] 763726779 TYMWJXKZZAAMNH-LLVKDONJSA-N 295.295 -0.006 5 20 CBBD C[C@@H]1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C[C@H]1O 825000313 OLGHSYYWSQEUNN-HTRCEHHLSA-N 291.271 -0.013 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CO)C1CC1 1320549409 HUKFAWABFFXCIZ-ZETCQYMHSA-N 254.246 -0.171 5 20 CBBD CN1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 1324084950 ILNXSZZWKYMJFS-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1ncc[nH]1 1341457792 YUGXWZZSTIUKCL-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCNC[C@@H]1CO 1580449075 ARPAIJHXTDJWNV-SECBINFHSA-N 280.284 -0.417 5 20 CBBD O=C(O)C[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCOC1 1601930718 NZTXLNUAKZJRHT-SOCHQFKDSA-N 272.257 -0.208 5 20 CBBD NCCNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 20001376 GOEJDMNHBVKVLX-UHFFFAOYSA-N 259.287 -0.027 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](O)C1 127933930 NEMNXBSDDAHWNZ-MRVPVSSYSA-N 287.297 -0.187 5 20 CBBD CO[C@@H](C)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 224205284 BATXTIORLAMSPX-WCBMZHEXSA-N 258.278 -0.223 5 20 CBBD NC(=O)[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 247714405 MJUXRSNHXQPQRB-ZCFIWIBFSA-N 266.261 -0.331 5 20 CBBD CC[C@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 292638742 POFSSXYIMWLGLH-VIFPVBQESA-N 271.277 -0.139 5 20 CBBD O=C(N[C@@H](CO)CN1CCCCC1)c1n[nH]cc1[N+](=O)[O-] 293554258 HHVVCOCKTVCSDC-SECBINFHSA-N 297.315 -0.106 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1cc([N+](=O)[O-])cnc1O 298241694 CTSMHOKFGVOOQX-HTQZYQBOSA-N 269.213 -0.815 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 299467838 MFQIUWPEOHMSPB-ZETCQYMHSA-N 268.229 -0.751 5 20 CBBD CN(C)CCN(C)C(=O)c1c([N+](=O)[O-])cnn1C 330580913 UHLLGGPUYRUMEP-UHFFFAOYSA-N 255.278 -0.038 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 356432400 WAAGOHAZXROJOQ-ZETCQYMHSA-N 282.256 -0.037 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC(O)(C2CC2)C1 408081956 OJTVABVSYHAZGA-UHFFFAOYSA-N 252.230 -0.085 5 20 CBBD NC(=O)[C@H](CO)NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 492840081 OCCSDCAFIIZINL-YVGDHZEHSA-N 279.252 -0.430 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cn1 531633055 JOTNFRRJVPHHJO-UHFFFAOYSA-N 281.228 -0.695 5 20 CBBD O=C(Nc1nnc2nc[nH]n12)c1cnc(O)c([N+](=O)[O-])c1 590379718 NTTBXAGTBXXAIQ-UHFFFAOYSA-N 290.199 -0.287 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CSCN1 592564073 DLJGXDWLGPMYLG-QMMMGPOBSA-N 271.302 -0.430 5 20 CBBD Nc1ccc(N[C@@H]2C[C@@H](C(=O)O)C[C@@H]2O)nc1[N+](=O)[O-] 595981991 ZOWOQWRWVYVMHO-NJUXHZRNSA-N 282.256 0.208 5 20 CBBD CCn1nncc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 600156420 NZIDJYUGZWYZOF-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@H]1CO2 600777514 QNBUIEQACHGWFM-CBAPKCEASA-N 252.230 -0.209 5 20 CBBD O=C(O)NCCOC(=O)CCn1cc([N+](=O)[O-])cn1 739971970 CCQRKKPMBHHHQX-UHFFFAOYSA-N 272.217 -0.008 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc([N+](=O)[O-])c(N)c1F 808047860 BEBQVSRGPQTYLI-ZETCQYMHSA-N 272.236 -0.165 5 20 CBBD O=C(NOCCN1CCCC1=O)c1c[nH]nc1[N+](=O)[O-] 856043512 UVWMJVFEMMZUNU-UHFFFAOYSA-N 283.244 -0.398 5 20 CBBD Cn1nccc1C(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 1327197977 RGOZMWDAZDOMEZ-UHFFFAOYSA-N 294.227 -0.654 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H](O)C[C@@H](C(=O)O)C1 1608158702 CQGBPKWPMPFROK-RQJHMYQMSA-N 298.255 -0.764 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 35174863 VJEDHDAAKFWVTK-LURJTMIESA-N 271.229 -0.803 5 20 CBBD C[C@@H](N)C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 40834912 DNKGUWVWYZALEV-SECBINFHSA-N 279.300 -0.014 5 20 CBBD CC(C)(C)[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 106415404 XPSRQCDYOGLNHK-VIFPVBQESA-N 283.288 -0.193 5 20 CBBD CCCc1[nH]nc(C(=O)N(C)C[C@H](O)CO)c1[N+](=O)[O-] 271313892 WAPCXBGDJMVXJF-ZETCQYMHSA-N 286.288 -0.304 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1(CO)CCC1 292270524 ZPAZPEYWTHOYGT-LLVKDONJSA-N 284.316 -0.001 5 20 CBBD C[C@H]1CN(C)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 331256443 WKMZPVSXSYSIOG-CMPLNLGQSA-N 283.332 -0.212 5 20 CBBD C[C@H](NC(=O)Cn1nccc1[N+](=O)[O-])C(=O)N(C)C 339216471 ZLARRCYEYCAALM-ZETCQYMHSA-N 269.261 -0.616 5 20 CBBD NC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 339451690 VIYPXIZKEIRRMC-UHFFFAOYSA-N 288.285 -0.459 5 20 CBBD Cc1cc(C(=O)N[C@H](CO)C(N)=O)cc([N+](=O)[O-])c1 341748309 PUJRTYQRJNWJLK-SECBINFHSA-N 267.241 -0.521 5 20 CBBD O=C(NCC1(O)CCOCC1)c1cnc(O)c([N+](=O)[O-])c1 445023801 SNARFRWQTJJAJK-UHFFFAOYSA-N 297.267 -0.033 5 20 CBBD CNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cn1C 516382983 UJWOGWOSZYJQOU-UHFFFAOYSA-N 254.246 -0.249 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 567914436 UMTRTEIQQOPMFL-ZCFIWIBFSA-N 294.223 -0.818 5 20 CBBD CC(C)[C@@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)C(=O)O 594541422 UNCBDJSTHCGYMG-ZCFIWIBFSA-N 269.261 0.158 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(C(N)=O)CCC1 610976719 BRWVFUDDVVTQEZ-UHFFFAOYSA-N 281.272 -0.376 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](C)C(=O)O)c1[N+](=O)[O-] 740245395 WVGDKCFELRHZPQ-YFKPBYRVSA-N 256.218 -0.160 5 20 CBBD CC(C)COC[C@H](O)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839696593 NYQHVNFNRRSODC-OPRDCNLKSA-N 260.290 -0.199 5 20 CBBD Cn1cc(C[C@@H](CO)CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 846647230 YSUNFLBRPXMMKH-GMTAPVOTSA-N 282.300 -0.648 5 20 CBBD C[C@H]1CNC[C@@H](C)N1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923331021 AFBTUYONKRXRRV-UMNHJUIQSA-N 283.332 -0.166 5 20 CBBD CS(=O)(=O)NC[C@H]1CCCCN1CC[N+](=O)[O-] 929257728 VPBBPFNLLFSVRA-SECBINFHSA-N 265.335 -0.333 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CN(CCO)C[C@@H]2C1 1048812445 JTCHYBFITVSEPW-LMLFDSFASA-N 269.301 -0.966 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2C(=O)NCC[C@H]2C)c1[N+](=O)[O-] 1116910294 CIIRYSGSZRZEQJ-SVRRBLITSA-N 295.299 -0.109 5 20 CBBD Cc1nn(C)c(C(=O)NCCc2nc[nH]n2)c1[N+](=O)[O-] 1326769106 WXDLYAPRILIJRW-UHFFFAOYSA-N 279.260 -0.273 5 20 CBBD COCCN(CC(=O)O)c1nccc(C(N)=O)c1[N+](=O)[O-] 1606883877 VOYVFGOINMOVQA-UHFFFAOYSA-N 298.255 -0.374 5 20 CBBD C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)NC(N)=O 6121903 KORXRLSEMJZMOZ-RXMQYKEDSA-N 296.239 -0.083 5 20 CBBD C[C@H](O)CN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 91236141 YTKMJKAGQCVHKR-QMMMGPOBSA-N 271.277 -0.187 5 20 CBBD C[C@@H](CN)N(C)C(=O)CCn1cc([N+](=O)[O-])cn1 237421270 QZQTWQAIGPTXAN-QMMMGPOBSA-N 255.278 -0.013 5 20 CBBD Cc1ccc(C(=O)N[C@H](CO)C(N)=O)cc1[N+](=O)[O-] 353006242 UFZABJJFYMLMQN-MRVPVSSYSA-N 267.241 -0.521 5 20 CBBD CC(C)(C(=O)N1CCO[C@@H](CN)C1)n1cc([N+](=O)[O-])cn1 358499744 RDIXQWFHRIEZKY-JTQLQIEISA-N 297.315 -0.288 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])nn1C 360743029 BZKHDLKTFCKDSO-MRVPVSSYSA-N 298.255 -0.658 5 20 CBBD CNc1nccc(C(=O)NCCn2ncnn2)c1[N+](=O)[O-] 514871593 QYCSQGNJFYEKFA-UHFFFAOYSA-N 292.259 -0.552 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 548928310 VSSCDNYCBCYOKY-RXMQYKEDSA-N 255.234 -0.428 5 20 CBBD N[C@@H]1C[C@@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 575331430 WHJWSATYOSJZES-NXEZZACHSA-N 277.284 -0.262 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)C1(CO)CC1 588857308 SDCMCYOIKPCGAO-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD NS(=O)(=O)c1ccc(N2CC[C@@H](O)C2)cc1[N+](=O)[O-] 589111766 OZNLDJGGIGTAAN-MRVPVSSYSA-N 287.297 -0.187 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@H]3COC[C@H]3C2)c1 601973329 KMSUOHVKUNXNAZ-UMNHJUIQSA-N 282.300 -0.270 5 20 CBBD O=C(C1CC1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 817675800 WOOPZSUUBFISJM-RKDXNWHRSA-N 253.258 -0.310 5 20 CBBD CN1CCC(N2CC[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 839679466 JBKFULFDPMWCHH-RAIGVLPGSA-N 296.371 -0.064 5 20 CBBD CCOC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC12COC2 839780837 XFXVABLFOMKOTN-KXUCPTDWSA-N 298.295 -0.310 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC[C@]1(O)CCCOC1 1261526711 SJMCEQPFFIIABS-GFCCVEGCSA-N 298.299 -0.010 5 20 CBBD CNC(=O)CNC(=O)[C@](C)(N)c1cccc([N+](=O)[O-])c1 1578554885 SKSUSSYHKNWZBQ-GFCCVEGCSA-N 280.284 -0.369 5 20 CBBD Cc1[nH]nc(C(=O)NC2(C(=O)O)CC2)c1[N+](=O)[O-] 1607499969 GUYLJZBCQNUXLO-UHFFFAOYSA-N 254.202 -0.027 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1CCCN1 178779174 GAXHOPKYASRBJD-VIFPVBQESA-N 280.284 -0.375 5 20 CBBD O=C(N[C@@H]1C=C[C@H](CO)C1)c1cc([N+](=O)[O-])[nH]n1 286785900 PFLIMNYCHZOURO-NKWVEPMBSA-N 252.230 -0.015 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H](C(=O)O)C1CC1 347404826 BCKFXRZPLFVMRP-ZETCQYMHSA-N 269.217 -0.834 5 20 CBBD CN1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 358043062 SBMXYLSDEAWSMF-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD NC(=O)[C@H](CO)NCCC(=O)Nc1ccccc1[N+](=O)[O-] 519155863 UFJWKHDZEMZKKX-VIFPVBQESA-N 296.283 -0.641 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])cn1)CC(=O)O 519681783 SDEFGUIXBDRENM-UHFFFAOYSA-N 272.261 -0.176 5 20 CBBD Nc1ccnc(CNC(=O)c2cc([N+](=O)[O-])cnc2N)n1 546829398 RVCJHXCVNKCBMG-UHFFFAOYSA-N 289.255 -0.126 5 20 CBBD O=C(O)[C@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 578379453 AGFSXIVTIPIEIA-SCSAIBSYSA-N 296.282 -0.620 5 20 CBBD CC[C@@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)NC 582190761 CULKSDGAPQVDPC-SSDOTTSWSA-N 281.272 -0.174 5 20 CBBD CO[C@](C)(C(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 595990477 VOYPHFGTPURZOH-JTQLQIEISA-N 286.244 -0.603 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 600216730 CRABWJZVSJZAGC-YUMQZZPRSA-N 282.256 -0.791 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCC(=O)N1CCC1 746970807 FKGJXATWTUJOBG-UHFFFAOYSA-N 295.251 -0.468 5 20 CBBD COc1cccc(C(=O)NOCC(N)=O)c1[N+](=O)[O-] 768178622 CFGGIYHRHUDFGO-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CO)[C@H](O)C1 798998931 JTMPCABVJQLKFA-QPUJVOFHSA-N 295.295 -0.008 5 20 CBBD C[C@H](COC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O)[N+](=O)[O-] 813114048 YAPVNDNNFAOJGB-KRTXAFLBSA-N 299.283 -0.085 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC(O)C1 823613485 JHHUNLCIAWKCPL-UHFFFAOYSA-N 263.217 -0.649 5 20 CBBD O=C(NC1CN(C(=O)/C=C\C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280360 QDOSRUVFYMHZAF-ANDSXOESSA-N 279.296 -0.055 5 20 CBBD CN(CC(C)(C)N)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118572114 OMLPVNGDRFIRSM-UHFFFAOYSA-N 282.300 -0.048 5 20 CBBD CCc1[nH]nc(C(=O)NCc2ncn(C)n2)c1[N+](=O)[O-] 1255909990 UNDIBLORCKYTQZ-UHFFFAOYSA-N 279.260 -0.061 5 20 CBBD O=C(NC[C@@H](CO)[C@@H]1CCOC1)c1c[nH]nc1[N+](=O)[O-] 1256721299 WFAARAFVLAMFLZ-SFYZADRCSA-N 284.272 -0.307 5 20 CBBD N[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1326611186 DCEDBWRJLFTIMA-ZETCQYMHSA-N 254.250 -0.960 5 20 CBBD CN1CCN(CCCn2cnc([N+](=O)[O-])n2)CC1 1337467898 QCSJYVNLGYXOAA-UHFFFAOYSA-N 254.294 -0.176 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CNC[C@H]1C 1579877275 GWTSFKBBZUNPIM-VXNVDRBHSA-N 267.289 -0.176 5 20 CBBD O=C(N[C@H]1C[C@H](C(=O)O)C1)c1n[nH]cc1[N+](=O)[O-] 1594798983 UZICINYZWQIUPK-URHBZAFASA-N 254.202 -0.089 5 20 CBBD C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1604190147 DCICSMDONAIAQP-ZCFIWIBFSA-N 289.269 -0.011 5 20 CBBD CNc1c(C(=O)NCC(N)=O)cccc1[N+](=O)[O-] 130784743 KMDVWEICJVEJLG-UHFFFAOYSA-N 252.230 -0.148 5 20 CBBD CNC(=O)C1CN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 186117991 NYVOLGJXKXJJTA-UHFFFAOYSA-N 278.268 -0.005 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCc2cccnn2)c1 236552518 XSCZNMVWEWJDMJ-LLVKDONJSA-N 278.272 -0.268 5 20 CBBD O=C(NC[C@H](O)CO)Nc1ccncc1[N+](=O)[O-] 272739432 QRSHJCFULKHQQJ-LURJTMIESA-N 256.218 -0.536 5 20 CBBD COC[C@@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274993706 SHLJCNWTSMWJAW-ZETCQYMHSA-N 271.229 -0.568 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(=O)N(C2CC2)C1 279703688 WQLGWBKOOSHVND-UHFFFAOYSA-N 279.256 -0.418 5 20 CBBD CC(C)(C(=O)NC[C@@]1(O)CCOC1)n1cc([N+](=O)[O-])cn1 330464848 WAJYMGRADFMBGM-LBPRGKRZSA-N 298.299 -0.206 5 20 CBBD CCN(CC(C)(C)O)C(=O)Cn1cnc([N+](=O)[O-])n1 331025175 ANQGWXBAHNVCOV-UHFFFAOYSA-N 271.277 -0.194 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCO[C@@H]1C1CC1 340659319 AABGOFIMRFLXSR-WCBMZHEXSA-N 281.272 -0.130 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@H]1O 342382041 QAXZXPMZXOCSAX-VHSXEESVSA-N 284.272 -0.601 5 20 CBBD C[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1nc[nH]n1 353804422 ZHKKNGBZAGMPNG-SSDOTTSWSA-N 294.275 -0.030 5 20 CBBD CCOC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354360964 ZXKRDOITWITXSE-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD CNC(=O)CCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357189973 MLRAGTMGERUAKG-UHFFFAOYSA-N 281.272 0.027 5 20 CBBD CCOC(=O)CN1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 359957033 NAHCOWCCAPSJOZ-GHMZBOCLSA-N 299.327 -0.251 5 20 CBBD Cn1cnc(=O)n1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 414161109 ZOCJUABBKREUSB-SNVBAGLBSA-N 294.267 -0.070 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cn[nH]c1 427595111 SWIXWVBXMZOWDV-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCC(=O)NC(N)=O 531564667 JBBNUYMNXRUURA-UHFFFAOYSA-N 283.244 -0.752 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](O)COC)c1[N+](=O)[O-] 574413803 KHOGIHSFYYKDDS-SSDOTTSWSA-N 284.272 -0.231 5 20 CBBD C[C@@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 576148296 XQOHJZGVECULID-LLVKDONJSA-N 267.289 -0.093 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2cccc([N+](=O)[O-])c2N)n1 590550387 BOSRTGNAAQGYBH-UHFFFAOYSA-N 291.271 -0.150 5 20 CBBD C[C@H]1NCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 592224679 OFGSFAVQKKEIRM-SCZZXKLOSA-N 267.289 -0.095 5 20 CBBD Cn1nnc2c1CC[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C2 594401270 NEMJMMBCTPAKKK-ZCFIWIBFSA-N 291.271 -0.266 5 20 CBBD Cn1nnc2c1CC[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C2 594598305 HTCRVAWWUOVIHR-LURJTMIESA-N 290.287 0.065 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 763709212 NOPNTALVZPKVGN-VIFPVBQESA-N 283.240 -0.863 5 20 CBBD NC(=O)NC(=O)COC(=O)c1c(N)cccc1[N+](=O)[O-] 778142111 WZJKPUCKPBUNNA-UHFFFAOYSA-N 282.212 -0.471 5 20 CBBD CCc1[nH]nc(C(=O)OCC(=O)NC)c1[N+](=O)[O-] 790074997 YMZJRKAXJKHSOV-UHFFFAOYSA-N 256.218 -0.217 5 20 CBBD CN(CC(=O)OCCn1ccc([N+](=O)[O-])n1)C(=O)O 828120094 ATQHDRFMOZUDIL-UHFFFAOYSA-N 272.217 -0.056 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(CC(N)=O)C2)c1[N+](=O)[O-] 1321099281 ALKZYNOGKPXWRA-UHFFFAOYSA-N 281.272 -0.416 5 20 CBBD Cc1noc(CN[C@]2(C(N)=O)CCOC2)c1[N+](=O)[O-] 1347128293 BRIOFEVTFWMTGR-SNVBAGLBSA-N 270.245 -0.375 5 20 CBBD O=C(NC[C@@]1(C(=O)O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1601473782 MPZIPNNIXQYFTM-JTQLQIEISA-N 284.228 -0.461 5 20 CBBD C[C@](CO)(NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1604193364 LYJCIMIFCGQMNO-SNVBAGLBSA-N 269.213 -0.445 5 20 CBBD O=C(O)CN1CCC(NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1606240821 UVODPOAADGSNIW-UHFFFAOYSA-N 297.271 -0.403 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[C@H]2C(=O)O)n1 1608122770 RQUHCUWSCKMUEX-RITPCOANSA-N 268.229 -0.079 5 20 CBBD O=C(CN(CCO)CCO)Nc1ccccc1[N+](=O)[O-] 49753325 AGZHMIYDUCBLCQ-UHFFFAOYSA-N 283.284 -0.180 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CNC[C@H](O)CO)cc1 95082615 DOASXPUDFCLNMD-WDEREUQCSA-N 256.258 -0.429 5 20 CBBD Cn1cnn(CC(=O)Nc2cc([N+](=O)[O-])ccc2O)c1=O 182698093 WLUVPCIFFSMPLN-UHFFFAOYSA-N 293.239 -0.166 5 20 CBBD CN(CC(C)(CO)CO)C(=O)Cn1ccc([N+](=O)[O-])n1 270942506 NPFJQQADKJAXTP-UHFFFAOYSA-N 286.288 -0.759 5 20 CBBD CCOC(=O)CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])c[nH]1 355535485 HQKVOGCBVJUPGS-UHFFFAOYSA-N 298.255 -0.587 5 20 CBBD Nc1cc(NC(CO)CO)cc(CO)c1[N+](=O)[O-] 587985929 LRDHCQCDCZLWHJ-UHFFFAOYSA-N 257.246 -0.566 5 20 CBBD O=C(N[C@@H](CO)CN1CCCC1)c1n[nH]cc1[N+](=O)[O-] 590371620 PANIQSLVQVPHBE-MRVPVSSYSA-N 283.288 -0.496 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCCN 591679729 VQVKTNCNFYDXJG-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD NC[C@]12CCC[C@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 593912245 CSTFJZXUHNRCFR-CABZTGNLSA-N 294.315 -0.226 5 20 CBBD COC(=O)C[C@H](O)CNc1ncc([N+](=O)[O-])cn1 599163668 XISNAPCYSWENFH-ZETCQYMHSA-N 256.218 -0.279 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cccc([N+](=O)[O-])c1O 600241672 NLFLLDHPBUQTST-MUWHJKNJSA-N 295.251 -0.639 5 20 CBBD CN1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 615929186 SGHJQGALGCFKGX-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nnn(C)n1 799480312 TZYJJOXQLLTPRJ-UHFFFAOYSA-N 281.232 -0.633 5 20 CBBD COC(COCCNC(=O)c1cc([N+](=O)[O-])n[nH]1)OC 807322911 HRDQZPWGYGWONF-UHFFFAOYSA-N 288.260 -0.317 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]2CCCC[C@@H]2N1 839700701 GXEZWMHLJOAXAS-XFWSIPNHSA-N 267.285 -0.079 5 20 CBBD NC(=O)C(=O)NCCNc1ccc([N+](=O)[O-])cn1 1094079435 HGSFNNKLGFBWFI-UHFFFAOYSA-N 253.218 -0.997 5 20 CBBD CC(C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ncc[nH]1 1118253700 MPUDSNVSUWKTES-UHFFFAOYSA-N 279.260 -0.039 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCNC[C@H]1CO 1122125184 YRQBMBUFIQIWFP-LBPRGKRZSA-N 279.296 -0.070 5 20 CBBD CCn1ncnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126931832 AZIDSWRUQHZAKN-RKDXNWHRSA-N 282.304 -0.831 5 20 CBBD Cn1nccc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932263 OSSIOBVWZXWWTI-NXEZZACHSA-N 267.289 -0.709 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319737812 QYLBSOMPVWPRBI-UHFFFAOYSA-N 285.260 -0.848 5 20 CBBD CN1CCC(O)(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1328677393 MPWHAHKPDKAOMN-UHFFFAOYSA-N 283.288 -0.496 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN2C(=O)CC[C@H]2C1 1339456552 PDVUNDQRXJIHMW-VIFPVBQESA-N 294.315 -0.114 5 20 CBBD CN1CC[C@@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1604854060 JXPULLLDMFYCTN-LURJTMIESA-N 292.259 -0.550 5 20 CBBD COCC[C@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)O 1606859491 PGTUVIPCJFHZGS-LURJTMIESA-N 286.244 -0.154 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](O)C(N)=O 228492888 LQBXAKLSVOHMRG-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)CO 268835913 LXAVIUFUIXLFIT-ZETCQYMHSA-N 256.262 -0.156 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1CO 276877508 UTNAEPXAOJDIOJ-ZJUUUORDSA-N 295.295 -0.157 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(=O)N(C2CC2)C1 279441089 DEHFDGAOMYSACS-UHFFFAOYSA-N 279.256 -0.418 5 20 CBBD CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 284923295 AAZYIQMOPCGTIT-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CNC(=O)NC(=O)COc1ccc([N+](=O)[O-])c(CO)c1 428070600 ONBVKNCINVEROC-UHFFFAOYSA-N 283.240 -0.079 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 445157336 IDIKKIMTLUDTEE-NSHDSACASA-N 299.239 -0.651 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 593815773 QPBHBUPTBCANDU-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD Cn1nnc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1 819271525 SVYYCJNOCOFAAQ-SNVBAGLBSA-N 278.272 -0.059 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839653113 VFCBDXWSMHPJDU-PRJMDXOYSA-N 258.230 -0.948 5 20 CBBD CN(C(=O)c1cn[nH]c1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953791080 SCFSZKZAWCOORN-NXEZZACHSA-N 293.283 -0.642 5 20 CBBD CC(C)(F)C(=O)N1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 976475698 XXHNVPBVKIWJFX-SPFKKGSWSA-N 299.302 -0.027 5 20 CBBD CC(C)(C)C(=O)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991279161 JJOPVCSLQPJESH-RKDXNWHRSA-N 297.311 -0.406 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)C(N)=O)CC2)n1 1055999499 RRKHODCDGZKBCG-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD Cn1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)nn1 1122727090 KEZOTMZIAZOCBX-UHFFFAOYSA-N 267.205 -0.828 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1319652183 RVJMUSYYKYNWQG-QMMMGPOBSA-N 298.255 -0.658 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@]1(CCO)CCOC1 1320847845 HXMBDYUXXBLWPN-NSHDSACASA-N 284.272 -0.400 5 20 CBBD CCOCC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1321991310 MKKJUAMNJXCXPN-SECBINFHSA-N 299.283 -0.357 5 20 CBBD O=C(NCCn1cncn1)c1n[nH]cc1[N+](=O)[O-] 1324629168 FFUNMRHOCHPSPT-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@H](CO)CC1 1327914567 YBNCIRPRDKFRMI-VIFPVBQESA-N 283.288 -0.193 5 20 CBBD CNC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 1328141638 XULQFZXLUNGAFB-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD CNC(=O)CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 1336702780 FBENNSGBPPSCPW-SNVBAGLBSA-N 283.284 -0.330 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O 270647711 QHXZULBIEBVQLX-GXSJLCMTSA-N 295.295 -0.014 5 20 CBBD Nc1ccc(C(=O)N2C[C@@H](O)C[C@H]2CO)cc1[N+](=O)[O-] 274793792 IEPDLZCHCXMWKV-IUCAKERBSA-N 281.268 -0.255 5 20 CBBD CC(C)(CNC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(N)=O 275001185 OGMAPTZIDJIRSM-UHFFFAOYSA-N 282.256 -0.063 5 20 CBBD COc1ccc(NC(=O)C(=O)N(C)CCO)cc1[N+](=O)[O-] 275433970 OVLLDCVPBYQSSL-UHFFFAOYSA-N 297.267 -0.007 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H]1CCNC1=O 283120594 YGPHUWKGGRHZRA-SECBINFHSA-N 295.299 -0.163 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H]2CNC[C@H]2C1 290174818 PDAGJSKNLJJDAW-UWVGGRQHSA-N 279.300 -0.141 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)N(C)C 350009904 KYQQZIXDWWNLLX-ZCFIWIBFSA-N 281.272 -0.222 5 20 CBBD C[C@H]1CC(=O)NCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 375844324 VGJXQIKPKVDCND-GXSJLCMTSA-N 297.315 -0.637 5 20 CBBD O=C(NCCn1ncnn1)c1cnc(O)c([N+](=O)[O-])c1 444957578 GWGRYCILIZNWNX-UHFFFAOYSA-N 279.216 -0.888 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(C)CC(=O)O)n1 564968346 XRZTXCYCVZASFD-UHFFFAOYSA-N 256.218 -0.032 5 20 CBBD NCCN(Cc1cccc([N+](=O)[O-])c1)C[C@@H](O)CO 595903674 ZQFKSTICZFQPKJ-GFCCVEGCSA-N 269.301 -0.291 5 20 CBBD O=C1NC[C@@H]2CN(c3ccsc3[N+](=O)[O-])CCN2C1=O 610864611 NFPQKKFGEULCHF-SSDOTTSWSA-N 296.308 -0.197 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@H](CO)C1 699458820 SWWKBEMOLAULKO-JTQLQIEISA-N 282.300 -0.318 5 20 CBBD CNC[C@@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 843081719 UQTALSYGTDQZQI-NEPJUHHUSA-N 269.301 -0.202 5 20 CBBD COC[C@@H](CCO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1319248163 LTFZJKWVBRYQPK-SSDOTTSWSA-N 272.261 -0.246 5 20 CBBD Cc1noc(CNC(=O)c2c([N+](=O)[O-])cnn2C)n1 1319888917 ITCIJDGLPZOAND-UHFFFAOYSA-N 266.217 -0.050 5 20 CBBD COC[C@@H](CO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1321092940 JJIZQUJBTLAPHI-SSDOTTSWSA-N 272.261 -0.626 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCN1 1329118294 MZNJRDQXNOAPLF-ZETCQYMHSA-N 254.250 -0.946 5 20 CBBD CC(C)(CNC(=O)c1n[nH]cc1[N+](=O)[O-])S(C)(=O)=O 1341387529 DDVBLPSPANMALB-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD Nc1ccn(CC(=O)CCC(=O)O)c(=O)c1[N+](=O)[O-] 1601217886 CPBLBYUNNUTYAA-UHFFFAOYSA-N 269.213 -0.227 5 20 CBBD O=[N+]([O-])c1cnc(N2CCN(CCO)CC2)nc1 40455012 PFWGWTNUPKGRGD-UHFFFAOYSA-N 253.262 -0.501 5 20 CBBD C[C@H](C[S@](C)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 182786337 KKTFPPCVGQUEPK-MDTSDYNXSA-N 274.302 -0.326 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1CO 190906725 JUQJNGNJBWVYKM-JFGNBEQYSA-N 284.316 -0.288 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 227871585 RVGLEKTUDCEYAA-MRVPVSSYSA-N 253.214 -0.829 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 271242916 FMMGNWKRBKYEDB-SNVBAGLBSA-N 295.251 -0.373 5 20 CBBD CC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 271266224 IMXWFAQFGFGOHN-QMMMGPOBSA-N 269.257 -0.356 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 272606539 MMMZZEAABQITDX-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD CC(C)(C(=O)N1CC[C@H](C(N)=O)C1)n1cc([N+](=O)[O-])cn1 338670446 HOMGBGJFHFJDGW-QMMMGPOBSA-N 295.299 -0.140 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 352752118 ITDBSQYXUZRHBI-ZCFIWIBFSA-N 269.261 -0.167 5 20 CBBD O=[N+]([O-])c1cnc(=NCCN=c2cncc[nH]2)[nH]c1 354511691 SVHHNYWYJBNUHZ-UHFFFAOYSA-N 261.245 -0.457 5 20 CBBD Cn1nnc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])n1 428520919 UOVBWNKWEAZREF-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD COc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1[N+](=O)[O-] 444349775 CZEHJMAHXZCCLB-MRVPVSSYSA-N 294.267 -0.322 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(=O)N(C2CC2)C1 548074915 MYVKAENXGGCRGH-UHFFFAOYSA-N 279.256 -0.267 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CCOC1 566464799 KDVLREVLXSTEOZ-NSHDSACASA-N 296.239 -0.930 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCc2cn[nH]c2)c1 591771756 HPSRATDASSWUHG-NSHDSACASA-N 280.288 -0.292 5 20 CBBD Nc1ncc2c(n1)CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2 616176109 FMKIOADCYQKOIN-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H]1CCOC1=O 744661732 IKGQHVPAIMXQPO-ZETCQYMHSA-N 269.213 -0.042 5 20 CBBD CNC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748917932 SJNQTMZREMXAQQ-UHFFFAOYSA-N 269.213 -0.954 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC(N2CC[C@@H](O)C2)C1 894348411 APUFIABISQFXIQ-SECBINFHSA-N 267.289 -0.417 5 20 CBBD CCCC(=O)N(CCO)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1056799545 NUJLGXRNFPWMLG-NXEZZACHSA-N 287.316 -0.611 5 20 CBBD COCCN(CCNC(C)=O)c1ncc([N+](=O)[O-])c(N)n1 1126161827 MGGZSEALHYQCRL-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1c([N+](=O)[O-])cnn1C 1324732360 MFOHLCITCPTEPL-YUMQZZPRSA-N 284.272 -0.450 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@]2(CNCCO2)C1 1580008915 GPXRFEXIFRNQMQ-NSHDSACASA-N 267.289 -0.103 5 20 CBBD C[C@@H](O)[C@@H](O)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603694201 QGQGWWXFAAZHEF-LDWIPMOCSA-N 294.271 -0.072 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1607500101 KAMLAFRAVDQXOE-JTQLQIEISA-N 284.228 -0.712 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NCCS(N)(=O)=O 41031600 IREYBWRAOVEKOO-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 54052833 RYLDFGDIGBDVCO-ZCFIWIBFSA-N 256.218 -0.277 5 20 CBBD CN1C(=O)CC[C@@H](Nc2c([N+](=O)[O-])ncn2C)C1=O 90031358 AZZBTVQQSZBIDS-ZCFIWIBFSA-N 267.245 -0.112 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1CCn1ccc([N+](=O)[O-])n1 153386199 SKGPHBLIEQZDKZ-ZJUUUORDSA-N 270.289 -0.127 5 20 CBBD COCCN(C)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 171127643 VRGBUZJSLOGRHF-UHFFFAOYSA-N 299.331 -0.206 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](CN)C1 261700025 FKYGWUMCRBDXCE-BDAKNGLRSA-N 282.304 -0.228 5 20 CBBD COC(=O)C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 270872436 JYWZPPJGIJZRCN-SSDOTTSWSA-N 298.255 -0.278 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 313822443 BHASGJWIMSDBCO-LBPRGKRZSA-N 294.267 -0.761 5 20 CBBD N=C(O)N[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 330517125 IWJXTHBJGIPYGO-MRVPVSSYSA-N 268.277 -0.052 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)C(=O)O)c([N+](=O)[O-])n1 340448151 GJYHEFNDLCYIMA-YFKPBYRVSA-N 292.273 -0.437 5 20 CBBD CCC(CO)(CO)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 340996296 VTZSMSBPGACPDS-UHFFFAOYSA-N 284.272 -0.333 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCC[C@@H]1O 341837297 PUUHSDXLVRZEAB-YUMQZZPRSA-N 269.261 -0.442 5 20 CBBD NC[C@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 428626027 KJMCJTQQEBHIDI-SECBINFHSA-N 267.289 -0.011 5 20 CBBD CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O 436956112 OQKODGRWOOAHLH-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD Cn1cc([C@H](CO)NCCn2ccc([N+](=O)[O-])n2)cn1 494803998 ABKQHVXUTRAURO-JTQLQIEISA-N 280.288 -0.152 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](CO)CCF 593380976 AJQVYIKHRFXIBG-MRVPVSSYSA-N 289.267 -0.189 5 20 CBBD O=C(NOCCO)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 787292824 RNGPWCCZKMJDHP-UHFFFAOYSA-N 293.239 -0.171 5 20 CBBD Cn1cc([C@@H](CO)NC(=O)c2n[nH]cc2[N+](=O)[O-])cn1 1116502802 CYTDSPMOUKUHIQ-SSDOTTSWSA-N 280.244 -0.485 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1C=C[C@H](CO)C1 1319867029 OWRJNVHSZLGRBY-JGVFFNPUSA-N 266.257 -0.005 5 20 CBBD COCC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)OC 1324677825 SXLFDKAEUSDUIS-ZETCQYMHSA-N 286.244 -0.374 5 20 CBBD CN(C)CC1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1330852090 ZTEAWMLEEZRYQE-UHFFFAOYSA-N 294.311 -0.224 5 20 CBBD CC(C)(CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1590713470 HLISIICRVSVOMD-UHFFFAOYSA-N 297.267 -0.017 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@](O)(C(=O)O)C1 1609029338 YYCGONCKECMITH-GFCCVEGCSA-N 296.235 -0.038 5 20 CBBD NC(=O)NC(=O)COC(=O)Cc1ccccc1[N+](=O)[O-] 11467641 LNBXHOVBDUMONU-UHFFFAOYSA-N 281.224 -0.125 5 20 CBBD CC(=O)NCCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 48736056 SGYHCXLWUQYCRP-UHFFFAOYSA-N 294.267 -0.214 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)Cn2nnc(C3CC3)n2)c1 193416684 GQZCTVZLYCQCCX-SECBINFHSA-N 279.260 -0.284 5 20 CBBD COC[C@H](CO)NS(=O)(=O)c1cccc([N+](=O)[O-])c1 234816651 XOAYBKQPPZRAQL-QMMMGPOBSA-N 290.297 -0.120 5 20 CBBD CO[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1OC 277414739 AQCYCURITUBMMD-DTORHVGOSA-N 284.272 -0.337 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CCC1=O 595772878 OIUUTYOTPIQABI-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD O=C1CC[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CN1 748116029 JPLROELTPSCBJO-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD Cn1nnc(COC(=O)c2cc([N+](=O)[O-])cnc2N)n1 799503836 VHHCXJDUBJSMES-UHFFFAOYSA-N 279.216 -0.548 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 803155265 NQALBIBHKOFKSU-LURJTMIESA-N 267.245 -0.379 5 20 CBBD Cc1nn(CN2CCO[C@H](C(=O)O)C2)cc1[N+](=O)[O-] 821216903 SNRCHWQHPBJMHR-VIFPVBQESA-N 270.245 -0.157 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ncc[nH]1 991229380 SXCPEDUEHVWQFV-HTQZYQBOSA-N 279.256 -0.985 5 20 CBBD O=C(NCCC1CC1)C(=O)NCCn1cc([N+](=O)[O-])cn1 1324797828 FGYZYVNXCWALNS-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD NC(=O)c1cc(N2C[C@@H](O)C[C@H]2CO)ccc1[N+](=O)[O-] 1328557373 PWDKUFDPBLCIDO-IUCAKERBSA-N 281.268 -0.374 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 1608602137 QAGSTWVTQDXFDJ-VXNVDRBHSA-N 295.251 -0.103 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](O)[C@H]2C(=O)O)n1 1610607364 XCUSVXCSFDNDIK-CBAPKCEASA-N 298.255 -0.622 5 20 CBBD C[C@H](CC(=O)O)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 36981491 QNQRIVAMIVZIBT-RXMQYKEDSA-N 269.213 -0.124 5 20 CBBD O=C1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCN1 119317706 ULMBPJCLPAPIOK-UHFFFAOYSA-N 265.225 -0.128 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H](C)N1 154087095 JDYBFYGBYUACHU-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H](O)C[C@H]2CO)n1 186542236 LJWMXKDUIBZBJP-IUCAKERBSA-N 256.262 -0.781 5 20 CBBD O=C(CN1CCNCC1=O)Nc1cccc([N+](=O)[O-])c1 238116232 GMUJWJNXCFODLB-UHFFFAOYSA-N 278.268 -0.035 5 20 CBBD COCCN1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 264558006 QEXMIKQXHSRSIR-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD CCOC(=O)CC(=O)NCCn1cc([N+](=O)[O-])cn1 269114362 MBHJVBVJYYDTNP-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(=O)N(CC2CC2)C1 279611533 XQXQVCXHSXANJC-UHFFFAOYSA-N 293.283 -0.170 5 20 CBBD CC1(C)CNC(=O)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 282934755 YNVZKLQXWHNOEX-JTQLQIEISA-N 297.315 -0.637 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1 314528880 WEQLGKPKUAWLRH-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1COC[C@@H]1O 342394707 DEUNZKAURNTFID-RQJHMYQMSA-N 256.218 -0.850 5 20 CBBD NC(=O)N[C@@H](CO)C(=O)NCCc1ccccc1[N+](=O)[O-] 352098491 RDSBMOAKPZTJBN-VIFPVBQESA-N 296.283 -0.717 5 20 CBBD COC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 382560734 LOECBSLANSWRQP-LLVKDONJSA-N 285.256 -0.177 5 20 CBBD CNC[C@H](O)CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 519659923 ZGZJZTNIXDMBAO-NWDGAFQWSA-N 299.327 -0.496 5 20 CBBD CN(Cc1nnnn1C)c1ncc(C(=O)O)cc1[N+](=O)[O-] 571884237 NOVQPACUQNPUMT-UHFFFAOYSA-N 293.243 -0.152 5 20 CBBD CNc1nccc(C(=O)N[C@@H](CO)COC)c1[N+](=O)[O-] 579970467 FRGIALOAQQQVCG-ZETCQYMHSA-N 284.272 -0.231 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cccnc1O 604573646 HGFOFYWYZKYHNM-UHFFFAOYSA-N 264.201 -0.074 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN(C)[C@@H]1COC[C@H]1O 708609356 NULDDRSRNBHIQR-NXEZZACHSA-N 270.289 -0.209 5 20 CBBD NCC[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 723696728 XQCOJDRPINWTSV-SECBINFHSA-N 267.289 -0.011 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@@H]1COC(=O)O1 763930714 IXAWLBQXQVWLOQ-ZCFIWIBFSA-N 271.185 -0.130 5 20 CBBD COCCONC(=O)NCCn1cc([N+](=O)[O-])cn1 789119662 YICCYSYTPCFPMD-UHFFFAOYSA-N 273.249 -0.332 5 20 CBBD CS(=O)(=O)[C@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840361328 VUXDGUSAXGZVPM-PRJMDXOYSA-N 294.354 -0.402 5 20 CBBD COCCN1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042705265 AJADJIGFENOTEM-NXEZZACHSA-N 257.290 -0.559 5 20 CBBD COCCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1122388147 NJQMQLFFDKVWDD-UHFFFAOYSA-N 285.304 -0.429 5 20 CBBD O=C(NCCCNCc1ccon1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767711 RWIQILZIEQUOIQ-NXEZZACHSA-N 268.273 -0.064 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2ccnc(O)c2[N+](=O)[O-])C1 1328010647 ROIBMMQFXAASEX-LURJTMIESA-N 288.285 -0.437 5 20 CBBD C[C@H](c1nnc(N2CCN3C(=O)CC[C@@H]3C2)n1C)[N+](=O)[O-] 1338057271 OIRZCQZUZPPPKL-RKDXNWHRSA-N 294.315 -0.036 5 20 CBBD COC(=O)CN(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1341617274 CEDNFTAMQKEVDH-UHFFFAOYSA-N 299.287 -0.988 5 20 CBBD O=[N+]([O-])c1c(NC[C@@H](O)CO)cccc1-c1nn[nH]n1 1593469405 PANVSRPZOXBTJK-ZCFIWIBFSA-N 280.244 -0.460 5 20 CBBD Cc1nc([N+](=O)[O-])c(NC[C@@](C)(O)C(=O)O)n1C 1777526181 LIHFRRCTGKCTKM-SECBINFHSA-N 258.234 -0.116 5 20 CBBD CN(CCOCCO)C(=O)Cn1cc([N+](=O)[O-])cn1 282197287 QGKKNJNOSKJNAK-UHFFFAOYSA-N 272.261 -0.741 5 20 CBBD CCOC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 547730640 GZZQDQDVUNDWBA-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](CN)C1 574400361 IILYQZYNURQACP-YUMQZZPRSA-N 283.288 -0.104 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 580575760 FAOBMWPVLIKGPG-SNVBAGLBSA-N 267.245 -0.345 5 20 CBBD COC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C)O1 839734553 SKHHXFGGWYOEEC-AXTSPUMRSA-N 258.274 -0.086 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 863704299 IBVYDRHANCTEKU-MRVPVSSYSA-N 299.287 -0.294 5 20 CBBD CCOCC(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1099914423 SAWBGFMDMAJWGV-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1=NCCS1 1317953383 WCNAHFBZZVSBFY-UHFFFAOYSA-N 256.247 -0.595 5 20 CBBD CC(=O)NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 1329029336 BOFDHUJSQUNLFD-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)Cn1cc([N+](=O)[O-])cn1 1334565555 HUDJLWMPJXBVBC-UHFFFAOYSA-N 279.260 -0.422 5 20 CBBD C[C@@H](c1nnc(N2CC[C@@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1343361001 SMDKQYJYQKTLGN-NKWVEPMBSA-N 268.277 -0.536 5 20 CBBD Cn1c(C(=O)N2CCC[C@H](O)[C@H]2C(=O)O)ccc1[N+](=O)[O-] 1600899006 COTQLZXMOUMDGS-WPRPVWTQSA-N 297.267 -0.017 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC(O)(C(=O)O)CC1 1601028928 MXMZLXAVNPEYTB-UHFFFAOYSA-N 298.255 -0.620 5 20 CBBD CC[C@H]1C(=O)NCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173777970 CCDKOQRGAVWUJF-QWRGUYRKSA-N 297.315 -0.637 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 183520802 BIJGXBLPLVKWMS-QMMMGPOBSA-N 283.240 -0.225 5 20 CBBD Cn1ccc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 213173345 MQQVBMFVDPOWGC-LLVKDONJSA-N 280.288 -0.325 5 20 CBBD CCCNCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 236775216 KJBIVNANZOAJDU-UHFFFAOYSA-N 282.300 -0.128 5 20 CBBD CCN(CC(=O)O)C(=O)c1nn(C)cc1[N+](=O)[O-] 263285045 PHSTWMRRCCQTJC-UHFFFAOYSA-N 256.218 -0.125 5 20 CBBD COC(=O)CN(C)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 264277071 MZUJKRCKSVAGGL-UHFFFAOYSA-N 256.218 -0.129 5 20 CBBD CC1(C)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 279690726 GBSAQVXVZXYOPY-GHMZBOCLSA-N 284.316 -0.145 5 20 CBBD COCC[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 281556930 KQZXXNBKTANCIU-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD CCC[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 343489122 ZIQBRLJGRXUGFG-QMMMGPOBSA-N 281.272 -0.044 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1[C@@H]2CNC[C@@H]12 366526021 HHOCVTWDPQMLDF-RKDXNWHRSA-N 279.300 -0.176 5 20 CBBD CC(=O)NC[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590586506 XWXMLZXGKGJNGN-SECBINFHSA-N 295.299 -0.087 5 20 CBBD N[C@@H]1C[C@@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 594694785 SZNCBGQSPKCJBP-RNFRBKRXSA-N 283.313 -0.201 5 20 CBBD Cc1nn([C@@H]2CCN(CC(=O)O)C2=O)cc1[N+](=O)[O-] 596015037 ZFGNBUSOSCVDQM-SSDOTTSWSA-N 268.229 -0.042 5 20 CBBD CSCC[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(N)=O 600263674 WXWNAVCAKQEBJW-YFKPBYRVSA-N 287.301 -0.345 5 20 CBBD C=CC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])cn1 732102515 YVFPLVXWPVNTEC-UHFFFAOYSA-N 267.245 -0.790 5 20 CBBD CC(C)c1nnnn1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 788422875 YFBYHNRQUUIMHT-SECBINFHSA-N 281.276 -0.038 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1OC 816328949 ZUHFASDHJSIQGX-VIFPVBQESA-N 297.267 -0.560 5 20 CBBD COCC[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 840437345 QAMDEVIFQVSJGH-KKZNHRDASA-N 258.274 -0.037 5 20 CBBD CC(C)(C(=O)NCCn1cnnn1)n1cc([N+](=O)[O-])cn1 845801692 GWLAHTYBSLPLBB-UHFFFAOYSA-N 294.275 -0.671 5 20 CBBD CCONC(=O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 846493090 NAVYWEDGWNZZOS-UHFFFAOYSA-N 282.256 -0.026 5 20 CBBD Cn1cnnc1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 1117110559 NOWWXUSLIDXSBE-UHFFFAOYSA-N 265.233 -0.581 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318051223 SRPWGXXWGFASRF-ZETCQYMHSA-N 283.288 -0.109 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCNC(=O)C1 1329891084 JFTAIZYIDIXJQJ-UHFFFAOYSA-N 267.245 -0.710 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CCO)C(F)(F)F 1339749286 UMVNPEGVWZLSHZ-YFKPBYRVSA-N 297.193 -0.384 5 20 CBBD C[C@@H](O)[C@H](N)C(=O)NCCc1cccc([N+](=O)[O-])c1 1579419827 HXQYPPGZUJYHBK-KCJUWKMLSA-N 267.285 -0.038 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)O 1599845085 IJSCWTKATIVRBM-ANLVUFKYSA-N 284.224 -0.136 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC(=O)NC1=O 90020984 GFUCBKOHWPRCRT-SECBINFHSA-N 292.251 -0.288 5 20 CBBD NC(=O)c1ccc(N2C[C@@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 236173524 JVKZYNHBSVGGAO-NXEZZACHSA-N 267.241 -0.765 5 20 CBBD CC(C)[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 271244768 CLJIIRKCOXOVGI-SNVBAGLBSA-N 283.284 -0.110 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 341736803 LSDKHWVQOLFMEL-MRVPVSSYSA-N 271.204 -0.690 5 20 CBBD NC(=O)[C@@H](CO)Nc1nc2sccn2c1[N+](=O)[O-] 343268315 IOMKCTZHCXLSPM-SCSAIBSYSA-N 271.258 -0.438 5 20 CBBD CC1(C)NC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 438795312 UOXLKOTZPFVWDQ-QMMMGPOBSA-N 297.271 -0.517 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 549202009 RPMSERFAODEIBX-POYBYMJQSA-N 281.272 -0.038 5 20 CBBD CCN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 549321562 HPGYLDPBIGSTSU-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD CNC(=O)C[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 571225034 QZFHWIHDLFXEFS-ZCFIWIBFSA-N 281.272 -0.174 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H](O)C(F)(F)F 591786307 UELWNCPJDIEQPB-NJGYIYPDSA-N 297.193 -0.386 5 20 CBBD Nc1ccc(N2C[C@H](O)C[C@H]2CO)nc1[N+](=O)[O-] 596178832 LRSZSKVDNXIPNJ-NKWVEPMBSA-N 254.246 -0.496 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 599765341 CRZHEHTUBWHECN-SSDOTTSWSA-N 298.255 -0.543 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619836848 YKQUZWKVZOLFGA-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD C=CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cn1C 732102527 ZKYBNUQKHRHUPX-UHFFFAOYSA-N 266.257 -0.035 5 20 CBBD C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O 738963678 YMXHVAFOFUPMDS-SSDOTTSWSA-N 295.251 -0.086 5 20 CBBD Cn1nccc1C(=O)OCCn1cnc([N+](=O)[O-])n1 749081054 WTSKMGJABLFTFN-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD O=C1CCC[C@H](CC(=O)OCCn2cnc([N+](=O)[O-])n2)N1 808990085 BCABIZJLBOTNCJ-MRVPVSSYSA-N 297.271 -0.212 5 20 CBBD CC(C)N1C(=O)C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839698536 PQFVZCJCZARULR-GJMOJQLCSA-N 269.257 -0.696 5 20 CBBD COC[C@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842311120 RNTQQQMRNBLLIL-RRKCRQDMSA-N 266.275 -0.868 5 20 CBBD O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCOCCN1 854690908 PQDNWTBRRHDUAJ-LLVKDONJSA-N 281.268 -0.008 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 858694248 JURMPCVBXRBSLT-XCBNKYQSSA-N 296.239 -0.072 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccon1 990366510 PXJBVTLHCFEKAS-VXNVDRBHSA-N 280.240 -0.720 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C(C)(C)CC(=O)O 1118806681 ABOHXCVRFRZJMH-UHFFFAOYSA-N 285.260 -0.102 5 20 CBBD NC(=O)C(=O)NCCCNCc1ccc([N+](=O)[O-])cc1 1165613300 LTZJLOGVJJFIPL-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD CN1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CCC1=O 1327708979 NKLTYWJGHYXWMS-UHFFFAOYSA-N 293.283 -0.243 5 20 CBBD CNC(=O)[C@H](O)CNc1ccnc(O)c1[N+](=O)[O-] 1328556754 MOMVDGGTNZONPN-ZCFIWIBFSA-N 256.218 -0.786 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCO[C@@H]([C@H]2CCCO2)C1 1339667949 VEPBBBBGDJUWGM-NXEZZACHSA-N 297.315 -0.024 5 20 CBBD C[C@H](O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1590000747 DXQHADRANDHJAX-YFKPBYRVSA-N 265.233 -0.037 5 20 CBBD Cn1cc(CN2CCOC[C@H]2C(=O)O)c([N+](=O)[O-])n1 1594543330 ZLGMMUCIGNBDRH-QMMMGPOBSA-N 270.245 -0.386 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1C[C@H]1C(=O)O 1601028632 CMBOVQZQCUWAAA-PHDIDXHHSA-N 268.229 -0.221 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)NCC(=O)O 1609796402 BRZBLADLOJDCBE-LURJTMIESA-N 299.239 -0.321 5 20 CBBD CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 70262509 WQCFJWSXYDMRNE-UHFFFAOYSA-N 253.262 -0.435 5 20 CBBD NC[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 178271462 GBRCWCYWRMORIG-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@H](O)C[C@H]2CO)n1 248392960 LJWMXKDUIBZBJP-DTWKUNHWSA-N 256.262 -0.781 5 20 CBBD CC(C)[C@H](N)CNC(=O)Cn1ccc([N+](=O)[O-])n1 269294429 VPBAYGCUKJHEPY-MRVPVSSYSA-N 255.278 -0.109 5 20 CBBD CN(C)c1n[nH]c(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1 286132609 WXFYVGCWZFIXIG-UHFFFAOYSA-N 280.248 -0.386 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)CC[C@@H]2C1 331902897 QLRHHKOASSINHS-SSDOTTSWSA-N 279.256 -0.235 5 20 CBBD C[C@H](C(=O)N[C@@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1F 341732399 PWBOTANCGWDLNE-WKEGUHRASA-N 299.258 -0.200 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 355936824 BJCBEBAGBNGBGK-SSDOTTSWSA-N 269.261 -0.568 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 358339432 YEVKABLAAJFTDX-LLVKDONJSA-N 281.272 -0.485 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCOC1 563408393 XXKCRSKTNGTMPC-JTQLQIEISA-N 268.229 -0.703 5 20 CBBD O=C(NC[C@]1(O)CN2CCC1CC2)c1c[nH]nc1[N+](=O)[O-] 574530772 GNUBCPKARJLDTQ-LBPRGKRZSA-N 295.299 -0.496 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@H]1CO 698230033 TYHYYXVSIGGSHS-DTWKUNHWSA-N 281.268 -0.255 5 20 CBBD O=C(O)[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 738550320 BJABGICWCDCLCP-ZETCQYMHSA-N 256.218 -0.466 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC(C(N)=O)=NO1 793898710 VLEPTYYWFWZPKD-ZETCQYMHSA-N 295.255 -0.707 5 20 CBBD CCOC(=O)[C@H](COC)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842339678 VZSFZKSPEURONW-PRJMDXOYSA-N 261.230 -0.227 5 20 CBBD NC(=O)c1csc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 855873008 MXWNZLSCNARITG-INEUFUBQSA-N 270.270 -0.477 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCC(NCCO)CC1 893023116 OWXXWFNOMNFVDY-UHFFFAOYSA-N 269.305 -0.121 5 20 CBBD Cc1c[nH]c(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 991984450 HHQSOJJLVJZDDX-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD Cc1ccnc(N(C)CCCNC(=O)C(N)=O)c1[N+](=O)[O-] 1095719166 SARSLYUKYPMCRD-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H]3C[C@H]2C(=O)O3)c1[N+](=O)[O-] 1118934686 YLSVNBQOKIFAOX-RQJHMYQMSA-N 280.240 -0.223 5 20 CBBD O=C1C[C@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)CCN1 1122712354 OLOBQBSRSSBUIJ-SSDOTTSWSA-N 283.244 -0.744 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@H]2NCC[C@@H]2C1 1326305259 DQLSDHWGYPXOSU-BDAKNGLRSA-N 280.288 -0.603 5 20 CBBD Cc1noc(CN2C[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1327535719 SBBCKWJCGPJVEJ-YUMQZZPRSA-N 257.246 -0.324 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(n2cncn2)C1 1327993511 MGGCZCBFEJGTHQ-UHFFFAOYSA-N 291.271 -0.225 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@](O)(C(=O)O)C1 1607985229 RMTBEQZRYGOTRY-LLVKDONJSA-N 298.255 -0.852 5 20 CBBD CCN(CCNCc1cnnn1C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1754045469 QKVXKPHZTMVILK-GHMZBOCLSA-N 296.331 -0.582 5 20 CBBD C[C@@H](C(N)=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 26484527 XKJRMSJSCNVTSV-VIFPVBQESA-N 279.300 -0.014 5 20 CBBD C[C@H]1CO[C@H](CO)CN1CCn1cc([N+](=O)[O-])ccc1=O 90552531 JEQRKJGWIKTBNR-JQWIXIFHSA-N 297.311 -0.162 5 20 CBBD CC(C)[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(N)=O 135493044 AGCAREBULBWOGO-VIFPVBQESA-N 298.303 -0.400 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](O)C(N)=O 228492883 LQBXAKLSVOHMRG-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCOC1 229685167 YZXWEFIDAXATKZ-LLVKDONJSA-N 269.257 -0.186 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2cccnn2)c1 236517823 XSCZNMVWEWJDMJ-NSHDSACASA-N 278.272 -0.268 5 20 CBBD C[C@@H](O)C(=O)N1CCN(c2c([N+](=O)[O-])ncn2C)CC1 270817003 QXYVFOIMABDHPA-MRVPVSSYSA-N 283.288 -0.642 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCO 272789473 BURPZRJWGZNGFT-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 273331672 UHPIEUWIYSMHLQ-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CC(C)[C@@](C)(NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 288019642 SPTVELFUHZDKQF-SNVBAGLBSA-N 269.261 -0.052 5 20 CBBD CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 343489117 ZIQBRLJGRXUGFG-MRVPVSSYSA-N 281.272 -0.044 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 345904906 CLOUGNRYSTTXEC-UWVGGRQHSA-N 295.299 -0.178 5 20 CBBD Cn1c(C(=O)N[C@]2(CO)CCOC2)ccc1[N+](=O)[O-] 348228558 RVDGUUVAXLMOAD-NSHDSACASA-N 269.257 -0.186 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[S@@](=O)C1 350867740 NHGJZYJFUZOOHE-INMOSUBGSA-N 284.297 -0.177 5 20 CBBD C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 356355948 HQRSTABEXRNORQ-RXMQYKEDSA-N 253.214 -0.096 5 20 CBBD Nc1noc(CCNC(=O)c2ccc([N+](=O)[O-])o2)n1 359769610 XUVITXXBJMRLIO-UHFFFAOYSA-N 267.201 0.126 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@@H]2CCOC2)CC1 366052572 LSOIRLLVSICKNZ-GMTAPVOTSA-N 269.301 -0.415 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(O)(C(F)F)C1 425024080 PHDBJBNHJGSNCQ-UHFFFAOYSA-N 276.199 -0.220 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)CO)c1[N+](=O)[O-] 552967503 UQWAIAWPLWFBTI-LURJTMIESA-N 254.246 0.142 5 20 CBBD Nc1nccc(C(=O)N2CCC[C@@H](O)C2)c1[N+](=O)[O-] 594371480 CFSSIBIVVGYQGB-SSDOTTSWSA-N 266.257 0.169 5 20 CBBD CN(C)CC1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 596246874 JAWUYESAUVMIFU-UHFFFAOYSA-N 252.278 -0.035 5 20 CBBD O=[N+]([O-])c1cnn(CN2CCCS(=O)(=O)CC2)c1 740757823 BVHVGULLMYECRF-UHFFFAOYSA-N 274.302 -0.131 5 20 CBBD COC[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 760057827 BFKYEIIDHQLCOA-MRVPVSSYSA-N 299.287 -0.857 5 20 CBBD NC(=O)[C@@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CCN1 804338128 UJTBXKZUQGUPAA-ZETCQYMHSA-N 295.255 -0.234 5 20 CBBD CNC[C@@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843081722 UQTALSYGTDQZQI-VXGBXAGGSA-N 269.301 -0.202 5 20 CBBD Cn1cncc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292583 PMJDNTCOPIAJKM-GHMZBOCLSA-N 279.300 -0.614 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)NC[C@@H]2C1 1116432303 SGCUNQQKKVEVCY-SSDOTTSWSA-N 294.271 -0.822 5 20 CBBD CCN1C[C@@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1326893858 QCOPUHSTWKISGJ-MRVPVSSYSA-N 295.299 -0.074 5 20 CBBD CNc1nccc(C(=O)NC[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 1332915459 PBLOPTBRMJEYQQ-SSDOTTSWSA-N 293.283 -0.103 5 20 CBBD CN(C)C[C@]1(O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1348964916 HQTJCTQGZKKNDD-FXPVBKGRSA-N 257.290 -0.823 5 20 CBBD COCCN(CC(=O)O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 1604592486 FAYNASOPRYOSOD-UHFFFAOYSA-N 299.239 -0.131 5 20 CBBD O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1CNC(CO)CO 1607083728 MSMWYJJQFAPZSY-UHFFFAOYSA-N 294.271 -0.782 5 20 CBBD C[C@@H]1CN(Cn2nccc2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1607438657 GAMOPAWYEJOLLV-SFYZADRCSA-N 270.245 -0.077 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OC1CC(C(=O)O)C1 1608380623 RMKFIURAXUJDLQ-UHFFFAOYSA-N 270.201 -0.407 5 20 CBBD COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)CC(N)=O 47629401 CVVDTJJABQFTJB-UHFFFAOYSA-N 296.283 -0.041 5 20 CBBD C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)N1CCOCC1 52610232 BZDFTBCTLIPFDD-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@H](C(N)=O)O1 122784857 QFOLPNGJMSKBPL-RKDXNWHRSA-N 283.288 -0.634 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccccc1[N+](=O)[O-] 188920525 TZBATTLYUVJWHN-UHFFFAOYSA-N 287.297 -0.126 5 20 CBBD CC1(C)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 279690731 GBSAQVXVZXYOPY-WDEREUQCSA-N 284.316 -0.145 5 20 CBBD CN(CCOCCO)CCn1ccc([N+](=O)[O-])n1 282250314 BZLPQSNEJNSPLH-UHFFFAOYSA-N 258.278 -0.268 5 20 CBBD Nc1ccc(N2CCN3C(=O)NC[C@@H]3C2)nc1[N+](=O)[O-] 312486199 JHZMTZFVXTXJNM-SSDOTTSWSA-N 278.272 -0.214 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCCS(=O)(=O)CC2)c1 331459428 MRSGAZXVFYUVGE-UHFFFAOYSA-N 288.329 -0.088 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1N 429158521 OYTMTCAYPFEMLS-WPRPVWTQSA-N 267.289 -0.013 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2CC[C@H](C1)N2 602592820 UTXLBBWMTLJZKX-DTORHVGOSA-N 265.273 -0.246 5 20 CBBD O=C(O)Cc1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 739910777 OYTRBNAAWHIPAR-UHFFFAOYSA-N 280.200 -0.080 5 20 CBBD O=C(NCCn1ccnn1)c1ccc([N+](=O)[O-])[nH]1 782735969 JSNVEICPNVNESC-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD CC[C@@]1(C)NC(=O)N(NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 801600848 JLVDRMMZCKIMIS-SNVBAGLBSA-N 296.243 -0.317 5 20 CBBD Nc1ccc(C(=O)Nn2c(O)nnc2O)cc1[N+](=O)[O-] 816732639 PSUMGDWUOLNLKG-UHFFFAOYSA-N 280.200 -0.436 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)[C@H]1CCCO1 862656471 DNYYZXADZZJZBK-VHSXEESVSA-N 296.283 -0.158 5 20 CBBD COC(=O)[C@H](OC(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 919520269 CZGRWMWNAMBIEK-MRVPVSSYSA-N 286.244 -0.073 5 20 CBBD CN1CC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1 928567521 QBBKNRPBJOXJFC-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC(O)(C2CC2)C1 1116778045 QQVKWXLZKBYWFJ-UHFFFAOYSA-N 267.245 -0.830 5 20 CBBD O=C(NCCNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 1157775821 YUXXYYIEZLAYNA-GHMZBOCLSA-N 298.343 -0.726 5 20 CBBD O=C(N[C@@H](CF)C(=O)O)c1cnc(O)c([N+](=O)[O-])c1 1601418250 PVBBDSHXOXFFBR-YFKPBYRVSA-N 273.176 -0.152 5 20 CBBD CC[C@@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1604912424 GTOBLCPBYVDEOV-MWLCHTKSSA-N 286.288 -0.005 5 20 CBBD COC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1606808793 COVFULUBKDGOBN-MRVPVSSYSA-N 286.244 -0.603 5 20 CBBD CCNC(=O)Cn1cc([N+](=O)[O-])cc(C(=O)OC)c1=O 43928853 YTRCIXRHEVPLFL-UHFFFAOYSA-N 283.240 -0.321 5 20 CBBD CCOC(=O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75677958 KBZOXGMSSRENSW-JTQLQIEISA-N 286.288 -0.353 5 20 CBBD CN1CC[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1=O 152610175 RVUHCAGSPLQJEQ-VIFPVBQESA-N 295.299 -0.127 5 20 CBBD COC(=O)CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 267717601 XZNFZCINVXJOTO-NSHDSACASA-N 298.299 -0.210 5 20 CBBD CNC(=O)c1ccc(NCC(=O)NCCO)c([N+](=O)[O-])c1 268335741 QVOLRXHBCBMEOT-UHFFFAOYSA-N 296.283 -0.525 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H](C)O 275999282 OJVZZFNWVKSXSK-SVGQVSJJSA-N 299.239 -0.652 5 20 CBBD O=C1NC[C@H]2[C@H]1CCCN2C(=O)c1n[nH]cc1[N+](=O)[O-] 337149270 QSBSHKGILCCSTP-RQJHMYQMSA-N 279.256 -0.332 5 20 CBBD C[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 343171494 CBWVZPFVGWKRRP-SSDOTTSWSA-N 255.230 -0.747 5 20 CBBD Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 354375143 AXDMPWDFODYPOW-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD CN1CCC(O)(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 354736265 NZSCOSFIMNXRSH-UHFFFAOYSA-N 297.315 -0.636 5 20 CBBD C[S@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 355857655 UZGZXMMTCXAXSN-SFHVURJKSA-N 272.286 -0.041 5 20 CBBD Nc1nccc(C(=O)NCC(=O)N2CCCO2)c1[N+](=O)[O-] 600056637 GFXDBNIAXAJNGJ-UHFFFAOYSA-N 295.255 -0.534 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCC1(CO)COC1 611598908 DTHBWLYIVXHBMC-UHFFFAOYSA-N 282.256 -0.458 5 20 CBBD O=C(Nn1cnnc1O)c1cccc([N+](=O)[O-])c1O 777768469 NUIFSMZQJHDEIB-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD COC[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C(N)=O 823950049 BAWGVMLCSSWZEB-MRVPVSSYSA-N 297.271 -0.201 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCOCCO 1116328932 RDXISOZDPZZFLY-UHFFFAOYSA-N 272.261 -0.775 5 20 CBBD C[C@@H](NS(=O)(=O)c1ncccc1[N+](=O)[O-])C(=O)O 1599842073 DQTXVCROHHSFPP-RXMQYKEDSA-N 275.242 -0.259 5 20 CBBD O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H](CO)C(=O)O 1601283264 UPTQFORVBKQSBM-MRVPVSSYSA-N 298.251 -0.075 5 20 CBBD O=C(O)c1cnc(N2CC(NC3COC3)C2)c([N+](=O)[O-])c1 1602524811 SSTGYKHOEBDVQC-UHFFFAOYSA-N 294.267 -0.135 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H](O)CN1 37668501 POHDPCZDTWUIJU-MNOVXSKESA-N 265.269 -0.066 5 20 CBBD CN1CCN(C)[C@H](CNc2c([N+](=O)[O-])ncn2C)C1 68806634 JRXWJACOQKTNJE-SECBINFHSA-N 268.321 -0.014 5 20 CBBD CN(C)C(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 126371801 XRFGJKJXWBUQDM-UHFFFAOYSA-N 296.283 -0.697 5 20 CBBD CN(C)CC(=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273667012 XADDSJQMZREAJL-UHFFFAOYSA-N 294.315 -0.405 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H](C)O 277929586 ATLATQXXYNNESQ-XNCJUZBTSA-N 299.239 -0.652 5 20 CBBD COC(=O)C(C)(C)C(=O)Cn1cnc([N+](=O)[O-])n1 285299668 VSHWZJRQNHEVTA-UHFFFAOYSA-N 256.218 -0.045 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286007952 HZTORYGFRUMSMN-YUMQZZPRSA-N 284.272 -0.070 5 20 CBBD CCOC(=O)CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])o1 299351437 XDRYWDVXOXQJAU-UHFFFAOYSA-N 299.239 -0.322 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCO[C@@H](CO)C1 330472513 AJWOGSAAKKARAB-SNVBAGLBSA-N 298.299 -0.290 5 20 CBBD C[C@@H]1NC(=O)N(CCn2cc([N+](=O)[O-])ccc2=O)C1=O 342204241 GMOYTGHEPDANPP-ZETCQYMHSA-N 280.240 -0.303 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NC[C@H](O)[C@H]3CCOC3)nn12 347861304 MNASWGARGWMDOF-IUCAKERBSA-N 293.283 0.447 5 20 CBBD COC[C@H](NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)OC 351791716 ZMIWUCYHSWHILG-LURJTMIESA-N 286.244 -0.456 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](C)[C@@H](O)C1 351871535 UEDKOSSOFNCSRO-CBAPKCEASA-N 268.273 -0.061 5 20 CBBD NS(=O)(=O)c1cccc(NC[C@@H](O)CO)c1[N+](=O)[O-] 353268902 SDMSTSPPGLWLLL-ZCFIWIBFSA-N 291.285 -0.993 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN2C(=O)OC[C@H]2C1 371992105 NSHUTKWPZINBOU-BWZBUEFSSA-N 255.230 -0.685 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(O)(C(F)F)C1 425008001 HAQVGJFFYBXUST-UHFFFAOYSA-N 276.199 -0.370 5 20 CBBD Cc1nc(O)nc(O)c1NC(=O)Cn1cc([N+](=O)[O-])cn1 427135134 AJGRHYKTEQHYDR-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 493606298 PQCOZKRBICVKLJ-ZETCQYMHSA-N 294.267 -0.087 5 20 CBBD O=C(NC[C@]1(O)CCSC1)c1c[nH]nc1[N+](=O)[O-] 558757533 HTOODHAWWNOURY-SECBINFHSA-N 272.286 -0.084 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1cc([N+](=O)[O-])n[nH]1 600807350 BBSARXISUJYFPT-ZETCQYMHSA-N 269.261 -0.886 5 20 CBBD Cc1nonc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 735820083 DAKIAUQKZRBADH-UHFFFAOYSA-N 266.217 -0.201 5 20 CBBD CCc1[nH]nc(C(=O)OCC(=O)NC(=O)NC)c1[N+](=O)[O-] 790080320 WMUUQTVTKWRTMN-UHFFFAOYSA-N 299.243 -0.507 5 20 CBBD O=[N+]([O-])c1c(N2C[C@@H](O)[C@@H](CO)C2)ccnc1F 882443308 ZPSPUNMIOPQACI-HTRCEHHLSA-N 257.221 -0.082 5 20 CBBD CC(=O)NC1CCN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1055575285 QBRDLPNKPMFSRQ-VXGBXAGGSA-N 298.343 -0.632 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N(C)CCCNC(=O)C(N)=O)n1 1095718951 JJLUVJFMAYQEFZ-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1cocn1 1124777944 ICZCILMXDFUFDG-UHFFFAOYSA-N 294.271 -0.164 5 20 CBBD CC(C)OCCNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126942473 AJPAOLOXNSDSPV-NXEZZACHSA-N 259.306 -0.218 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCO[C@H](CN)C1 1326451059 KWIAOWFNDYVMRE-MRVPVSSYSA-N 283.288 -0.482 5 20 CBBD CCN(CC(=O)NC)c1nccc(C(N)=O)c1[N+](=O)[O-] 1343588235 PBYIIMKEEXVUOV-UHFFFAOYSA-N 281.272 -0.339 5 20 CBBD C[C@@]1(C(=O)O)CN(CCn2ccc([N+](=O)[O-])n2)CCO1 1776507254 CVWAEZKQJBAPCX-NSHDSACASA-N 284.272 -0.033 5 20 CBBD Cc1nn(C)c(NCCS(N)(=O)=O)c1[N+](=O)[O-] 36749407 RHIFMCUTDRCKIV-UHFFFAOYSA-N 263.279 -0.663 5 20 CBBD CN1CC[C@@H](CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 37894351 VVGGSNMPQYJIFO-JQWIXIFHSA-N 283.332 -0.307 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H](O)CN1 40676266 SEJDAUWGLFXQHQ-NWDGAFQWSA-N 279.296 -0.024 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC(=O)N1CCCC1 61545474 PLVHTLHRHNXBQA-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD Cc1cc(C(=O)NC(CO)CO)c(N)c([N+](=O)[O-])c1 119618800 BRRLMXFPAUHMDP-UHFFFAOYSA-N 269.257 -0.432 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN(CCO)CC(F)F)c1 193406935 PJJYZCFKXZIFQJ-SECBINFHSA-N 294.258 -0.288 5 20 CBBD C[C@]1(CN)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 262137116 WYPJTVRZZLUKJT-LLVKDONJSA-N 267.289 -0.011 5 20 CBBD CN1CC[C@@H](N(C)c2ncc([N+](=O)[O-])c(N)n2)C1=O 265611560 VGPFGMKOUDSBIX-ZCFIWIBFSA-N 266.261 -0.366 5 20 CBBD CC(C)N1C(=O)C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 267114167 OBYWILAEUJJHJA-ZCFIWIBFSA-N 294.271 -0.085 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H]1COC[C@H]1O 287256130 KMDVCEAAFPFAID-RKDXNWHRSA-N 283.240 -0.473 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1[C@H](CO)CC[C@H]1CO 347354846 ZMLMSMLIBZNTOX-RYUDHWBXSA-N 297.311 -0.426 5 20 CBBD CN(c1ncc([N+](=O)[O-])c(N)n1)C1CCN(CCO)CC1 357614239 PBHHJNLKESTXOH-UHFFFAOYSA-N 296.331 -0.140 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])nn1C 359512414 MSEWAXZZDCVJIB-UHFFFAOYSA-N 283.288 -0.088 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 436671553 AMEOXHMOTYIBJD-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 567890215 BNEHRRPWNZSEQS-QMMMGPOBSA-N 294.267 -0.190 5 20 CBBD O=C(NC1[C@@H]2CNC[C@@H]12)c1cc([N+](=O)[O-])cnc1O 592338481 WEUQRGPIDULIGG-HTQZYQBOSA-N 264.241 -0.357 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCS(=O)(=O)C1 612623412 XYZWBJYMYKGUIJ-SSDOTTSWSA-N 287.297 -0.150 5 20 CBBD CN1CCN(C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)CC1 827435647 QSNTWZOABZPIRF-CHWSQXEVSA-N 296.371 -0.110 5 20 CBBD CNC(=O)[C@@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 843112168 WUDZHCMTUYLVLN-QWRGUYRKSA-N 283.284 -0.675 5 20 CBBD Cc1nc(N2CCN(C(=O)C(N)=O)CC2)ccc1[N+](=O)[O-] 1055999347 JUPLSFZESJEXOZ-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCN(CCO)C2)C1 1072725413 MDICNLRDLXWOOE-NXEZZACHSA-N 269.301 -0.822 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCNC1=O 1321915123 NOFLFOWHPKQZJN-ZCFIWIBFSA-N 253.218 -0.722 5 20 CBBD COC[C@](C)(NC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 1322598335 AZUOOKYTLFRVOI-JTQLQIEISA-N 286.244 -0.452 5 20 CBBD CONC(=O)CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1605143903 JAUGXKUMYCOUKO-UHFFFAOYSA-N 294.231 -0.741 5 20 CBBD O=C(O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 37434180 OOSMSUXBWNGJKZ-UHFFFAOYSA-N 256.218 -0.228 5 20 CBBD COCCN(C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 171128453 RLQZBDNTRBFHML-UHFFFAOYSA-N 285.304 -0.514 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)Cn1cc([N+](=O)[O-])cn1 188516999 YMVWQZSXCIXVEN-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 194332375 QPEFAIVBWKYYSM-KWQFWETISA-N 295.299 -0.178 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 282142476 JLCZQRJKISCUCL-MUWHJKNJSA-N 294.267 -0.050 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c3nonc23)CCO1 299472681 SFFGJYLYBNYUSS-QMMMGPOBSA-N 293.239 -0.179 5 20 CBBD COC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 338648646 JABLBOHOFAPFFQ-ZETCQYMHSA-N 270.245 -0.691 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCNC(=O)c1cnccn1 338723555 YXPQSJOMJYDZPD-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD NC(=O)CCn1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 344429112 PWQGIGRHBNXVOH-UHFFFAOYSA-N 292.255 0.247 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](CO)[C@@H]1CCCO1 344862696 QDISWLZGYCAZRQ-ZJUUUORDSA-N 296.283 -0.158 5 20 CBBD COC[C@@]1(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CCCN1 423634102 MKJCYFHQQAXYCF-NSHDSACASA-N 283.288 -0.184 5 20 CBBD C[C@H]1CCNC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427573568 KKGNABTYKQRKSS-JGVFFNPUSA-N 268.277 -0.700 5 20 CBBD C[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(N)=O 444835247 MIUKMTJBQYONIB-SCSAIBSYSA-N 254.202 -0.701 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@@H]1O 565494093 ZAKRDFMFILIGAU-IUCAKERBSA-N 295.299 -0.681 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(c2c([N+](=O)[O-])ncn2C)C1 592003595 ITKYBBXTMRJIBY-SFYZADRCSA-N 284.272 -0.312 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCO[C@H]1CCCCO1 597677582 OWCLKBWZZKVXIE-JTQLQIEISA-N 299.287 -0.154 5 20 CBBD O=C(NCCNc1ncccn1)c1c[nH]nc1[N+](=O)[O-] 619786067 OBLJIPGKKHEWQV-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD C[C@@H](CN1CCOCC1)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840673634 WMDYBGVTMYQINJ-IVZWLZJFSA-N 258.274 -0.085 5 20 CBBD Cc1cnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1126932281 QEIYREVJUAEJTB-RKDXNWHRSA-N 268.273 -0.146 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@@H]2CCNC2)c1=O 1326052420 QYSGSOCCOLVSSC-QMMMGPOBSA-N 280.284 -0.145 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCO[C@H]([C@@H]2CCCO2)C1 1339667950 VEPBBBBGDJUWGM-UWVGGRQHSA-N 297.315 -0.024 5 20 CBBD Cn1c(C(=O)N2CCCNC[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 1600897873 CBHYKPSCTZNDQM-SECBINFHSA-N 296.283 -0.178 5 20 CBBD O=C(N[C@]1(C(=O)O)CCSC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1608406565 XEAIPGGHICQMJG-HCVRKRLWSA-N 260.271 -0.272 5 20 CBBD C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CC(N)=O)C1=O 4307354 BECIMWRQFOGMBT-LBPRGKRZSA-N 292.251 -0.153 5 20 CBBD Cc1c(NC(=O)CNC(=O)CN)cccc1[N+](=O)[O-] 37629041 SUORBHJUSDYVMZ-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C(=O)N(C)C 66045958 GXWYKSPFFHZHGX-ZETCQYMHSA-N 283.288 -0.307 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCc1ncc[nH]1 135487957 IOOYIHJAERLZEK-UHFFFAOYSA-N 264.245 -0.127 5 20 CBBD O=C(CNC(=O)Cn1cc([N+](=O)[O-])cn1)NCC1CC1 180907396 CVDUNDQAGHFPAN-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD O=C1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1 182173061 GMBXPBUPMXYORU-JTQLQIEISA-N 295.295 -0.234 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1cccc([N+](=O)[O-])c1 193093826 OQNQPLULFFIANB-UHFFFAOYSA-N 273.270 -0.299 5 20 CBBD C[C@H](O)CCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 227714607 KPFXGQNETSELRW-ONGXEEELSA-N 272.305 -0.097 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(CC(N)=O)C(C)C 264057556 ZOAIGLRTJBDEHP-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD CC(=O)C[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 274840320 PQZCKDGRRCBYRH-SNVBAGLBSA-N 296.283 -0.002 5 20 CBBD CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O 279418082 SVLKAYCQAQSICU-SNVBAGLBSA-N 295.295 -0.014 5 20 CBBD CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1CC(=O)NC1=O 299490857 CQBPJAAJNFMRQP-SSDOTTSWSA-N 280.240 -0.200 5 20 CBBD C[C@@](O)(CNc1ncc([N+](=O)[O-])cn1)CN1CCOCC1 302155840 MQWGUULQSYPCBX-GFCCVEGCSA-N 297.315 -0.120 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1O 331181234 RLRPJHDEIVLINE-KOLCDFICSA-N 295.295 -0.014 5 20 CBBD CS(=O)(=O)NCCn1cc([N+](=O)[O-])ccc1=O 340896528 GUMBJLBIQRKUMY-UHFFFAOYSA-N 261.259 -0.694 5 20 CBBD C[C@H](CCN)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 349938231 PNFSXAVGUFMYBR-MRVPVSSYSA-N 268.273 -0.390 5 20 CBBD COC1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 353012181 OEBNRJDRWZFXTN-VIFPVBQESA-N 256.262 -0.517 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])NCCn1ncnn1 353116827 BDHVDOTTYAFNLK-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD O=C(NCCNc1cnccn1)c1c[nH]nc1[N+](=O)[O-] 548953665 FFFRHMYOWXZYKZ-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD CN1CC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 553222918 OCZDFPGWMUSXAT-ZETCQYMHSA-N 279.256 -0.468 5 20 CBBD CN1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 734888896 APVQDUDBKCOBEG-MRVPVSSYSA-N 268.229 -0.435 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1C 763700070 VAEVYCOQMNGHPH-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD NC(=O)CONC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 772932549 IRPMOGVSZLEOMZ-UHFFFAOYSA-N 279.212 -0.382 5 20 CBBD CN1CC[C@@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 847789519 DWHYGIYIQTYJQC-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD C[C@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 928892609 INYJYHXBDATSAJ-IONNQARKSA-N 254.246 -0.058 5 20 CBBD Cc1conc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991294171 TXEYEAMHNNEXFQ-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1124014551 IZPNDIVHOGUSLP-OPRDCNLKSA-N 269.301 -0.022 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCn2ncnc2C1 1344729372 LMIREUYUTQZBTK-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD O=C(N[C@H]1CNCC12CC2)c1n[nH]cc1[N+](=O)[O-] 1580621998 FORZSEUUDCUIHF-ZETCQYMHSA-N 251.246 -0.200 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])cn2)C[C@H](C(=O)O)C1 1606247845 UTLANHUUCIVLKV-MRVPVSSYSA-N 281.272 -0.163 5 20 CBBD CC(C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 40910158 VCLKDADEKRRVPW-UHFFFAOYSA-N 256.218 -0.229 5 20 CBBD COC(=O)CCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 47368878 FSPXACBHMYLKNN-UHFFFAOYSA-N 283.240 -0.191 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1 70247365 LQAHVBISRBXXSK-UHFFFAOYSA-N 266.257 -0.329 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NCCn1cc([N+](=O)[O-])ccc1=O 193661105 FISIAIIDJGUWSL-JOYOIKCWSA-N 294.311 -0.129 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CC(=O)N(C2CC2)C1 267864381 IIBCSCUGJKITGR-QMMMGPOBSA-N 293.283 -0.329 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 276017020 APWOZPRTAVYZFG-SECBINFHSA-N 283.240 -0.559 5 20 CBBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCC(=O)NCCO 302839961 ZPABHFKPWDWRKD-ZZXKWVIFSA-N 293.279 -0.167 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)N1CCOCC1 331198645 MLEJPBLZZDLGJN-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@H](CO)O1 349577253 RUJWDSSWQHASSL-HTQZYQBOSA-N 284.272 -0.402 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@]1(CO)CCOC1 354324890 CIOJBHBFNFFASY-NSHDSACASA-N 282.256 -0.547 5 20 CBBD CCN(C)C(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 360979395 LNXMPDPLEBSGHY-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD C[C@@](O)(CO)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 362218802 YLEMLLPIBCYHKP-LBPRGKRZSA-N 297.267 -0.607 5 20 CBBD CO[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H]1O 456364956 GTBCJTWBTLIMAG-NXEZZACHSA-N 298.299 -0.256 5 20 CBBD COC(=O)NCCC(=O)NCCn1cc([N+](=O)[O-])cn1 493708584 FKRGVCSYLPMZBV-UHFFFAOYSA-N 285.260 -0.346 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 518379219 HNJFRHBEOUMOHJ-IYSWYEEDSA-N 256.218 -0.539 5 20 CBBD CN1C(=O)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1=O 550160369 OHQCDLQZHGRLFG-UHFFFAOYSA-N 291.263 -0.036 5 20 CBBD CC[C@]1(C)NC(=O)N(NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 806309280 PZRQBLYSXDATQF-JTQLQIEISA-N 296.243 -0.317 5 20 CBBD O=C(O[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 842329044 RZATUXHNHDQDFG-IWSPIJDZSA-N 254.242 -0.042 5 20 CBBD Cc1[nH]nc(C(=O)NOCCN2CCCC2=O)c1[N+](=O)[O-] 856039128 PUGMRYCEOYOGCH-UHFFFAOYSA-N 297.271 -0.090 5 20 CBBD CN1C(=O)CN(CC(=O)OCCC[N+](=O)[O-])C1=O 860923123 OOXXCFZXVLMCPV-UHFFFAOYSA-N 259.218 -0.910 5 20 CBBD O=C(CNC(=O)c1c[nH]nc1[N+](=O)[O-])NCC(F)(F)F 1116852659 PWPHZWAYFKEXEA-UHFFFAOYSA-N 295.177 -0.274 5 20 CBBD CN(C[C@H](O)C1CC1)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319591334 JEQFOFODJUVRNH-LBPRGKRZSA-N 295.295 -0.014 5 20 CBBD COCCOCC(=O)Nc1c([N+](=O)[O-])cnn1C 1320655662 CQVURHRWSOXSRX-UHFFFAOYSA-N 258.234 -0.070 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1325431963 OIFQGWGXYKJZNO-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])S(C)(=O)=O 1336532539 UOTLSIRPZLKYJC-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CCNC1 1349152279 IGRUJLUATREIHG-SSDOTTSWSA-N 253.262 -0.238 5 20 CBBD COc1ccnc(N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)n1 1349766998 NEBQDWYDENUSOR-UHFFFAOYSA-N 293.243 -0.352 5 20 CBBD COC[C@H]1CNCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 1578992620 YIVNKZHGKSKLKW-SECBINFHSA-N 268.273 -0.017 5 20 CBBD Cn1c(C(=O)N2CCO[C@H](CO)C2)ccc1[N+](=O)[O-] 168355599 PYSASPJHBBBSCR-QMMMGPOBSA-N 269.257 -0.233 5 20 CBBD O=C(CN1CCNCC1=O)NCc1cccc([N+](=O)[O-])c1 238109039 DNBBIGSXFFEQPH-UHFFFAOYSA-N 292.295 -0.357 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)[C@H]2CCOC2)c1 269153398 TWXDSHWMFHIPAB-VIFPVBQESA-N 290.301 -0.500 5 20 CBBD CN1CCC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 331104319 PXZKTZUEDLJZTM-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 341749475 URFXZYHMZXPYAX-SNVBAGLBSA-N 292.251 -0.348 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])n[nH]1)NC1CC1 348630023 LWKYYZWKWCRMRY-UHFFFAOYSA-N 253.218 -0.674 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@H](CO)O1 349662449 BIFDMROFICCPTE-DTWKUNHWSA-N 296.283 -0.158 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cccc([N+](=O)[O-])c1O 392163959 HDBJLWDXFVTZIX-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD O=C(NCCCCO)NCCn1cc([N+](=O)[O-])cn1 425919206 ITFIYINFZVMATN-UHFFFAOYSA-N 271.277 -0.137 5 20 CBBD O=C(O)[C@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 516075852 HAXBRLYOTWAURG-SECBINFHSA-N 270.245 -0.423 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)CCC1=O 595773531 OUTSQSOHRQGNNM-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD CS(=O)(=O)CCCOC(=O)Cn1ccc([N+](=O)[O-])n1 728621835 GOARXFLZRPGDGK-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD NC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O 773035999 ROIAKQKHTSZSOV-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD CC(=O)N1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 976483317 LPJSISUDUFDYIT-SPFKKGSWSA-N 253.258 -0.756 5 20 CBBD O=C(NC1CN(C(=O)CC2(O)CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991299227 SRWPZBYJBSNFPD-NXEZZACHSA-N 297.311 -0.716 5 20 CBBD O=C(Cc1ccc[nH]1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 992618218 SXIVLLFRSALHID-GHMZBOCLSA-N 292.295 -0.451 5 20 CBBD CC1(C(=O)O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1609812066 KRHLIGJKVUSPRI-UHFFFAOYSA-N 269.217 -0.881 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1 8169513 LRASRPKMAHHYTP-UHFFFAOYSA-N 287.297 -0.126 5 20 CBBD CN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 23441875 ZYBPEELJWSYHFT-UHFFFAOYSA-N 268.229 -0.899 5 20 CBBD NC(=O)Cn1c(-c2ccc([N+](=O)[O-])cc2)noc1=O 132367344 ALGCHFWZRBEBRX-UHFFFAOYSA-N 264.197 -0.103 5 20 CBBD C[C@@H](CO)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 153461316 NADLZIWUZVHORQ-QMMMGPOBSA-N 271.277 -0.187 5 20 CBBD O=C(NCCCN1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 158999107 RAVWZZNWSWBIBW-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD C[C@@H]1C(=O)NCCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 189297755 RBPBYAPPYNFTEC-KOLCDFICSA-N 297.315 -0.637 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@@H](O)[C@H](O)C2)cc1 212422543 ALCIZAAAINKCRK-NXEZZACHSA-N 288.281 -0.679 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)NCCF 337029503 CRJHMHBRADDSMF-ZCFIWIBFSA-N 287.251 -0.468 5 20 CBBD CNC(=O)CN(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1 596063733 WWCDWEFKHGNFTP-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD CN1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1=O 613999213 RKCKWPBKBOKNTB-SECBINFHSA-N 281.272 -0.614 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820036814 YPCLMUGCMOYOSR-LLVKDONJSA-N 297.267 -0.018 5 20 CBBD CN(C)C(=O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1148546598 WLGQLUNOSQJCKT-UHFFFAOYSA-N 281.272 -0.387 5 20 CBBD CN(CCNS(C)(=O)=O)CCn1ccc([N+](=O)[O-])n1 1252578206 JECPZLPSKQRQQC-UHFFFAOYSA-N 291.333 -0.728 5 20 CBBD COC(=O)NC1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 1343836516 SBSAEDCPPHNRSS-UHFFFAOYSA-N 296.239 -0.124 5 20 CBBD C[C@@H](O)[C@@H](O)CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1589997628 TUVQSHXUVHUBES-LDWIPMOCSA-N 294.271 -0.072 5 20 CBBD CC[C@H](C)[C@@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1594908509 HATQTFWWOOQIHN-IMTBSYHQSA-N 285.260 -0.198 5 20 CBBD COC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 65842823 HMCNQIJELZKJOL-UHFFFAOYSA-N 270.245 -0.269 5 20 CBBD CC(=O)N[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 79295443 BAYVMBNKFZPSQY-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD CN[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 134202488 UZFSHWNICVLDPK-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD Cc1c(NC(=O)C(=O)NC[C@H](O)CO)cccc1[N+](=O)[O-] 275723810 OTAZRSFNUCGIGM-QMMMGPOBSA-N 297.267 -0.689 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCS(=O)CC1 330709070 RQNWSKYRKNEJRH-UHFFFAOYSA-N 286.313 -0.228 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@H]2CS(=O)(=O)CCO2)s1 336976958 PNISWSGJUZPAJO-LURJTMIESA-N 293.326 0.277 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@@H]3C(=O)NC[C@H]32)c1[N+](=O)[O-] 337155577 UVJSDUTUASXKFH-JGVFFNPUSA-N 293.283 -0.023 5 20 CBBD NC1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1 342607620 NZCHMGKTIBJLFP-UHFFFAOYSA-N 253.262 -0.211 5 20 CBBD O=C(CO)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 346374072 WYXAUOYYLDSUOC-UHFFFAOYSA-N 267.245 -0.974 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@]2(O)CCO[C@H]2C)c1[N+](=O)[O-] 447741439 KYVMXOGLZMJCTR-WRWORJQWSA-N 284.272 -0.104 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 447742194 OZMRYBPAHNJSNX-KRTXAFLBSA-N 296.283 -0.158 5 20 CBBD C[C@H](NS(=O)(=O)c1cccnc1[N+](=O)[O-])C(N)=O 540942088 LNWZSTNSCCFRHS-YFKPBYRVSA-N 274.258 -0.858 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])cn2)[C@@H](CO)C1 601980236 SRTZGJQGENSGEG-SECBINFHSA-N 253.262 -0.503 5 20 CBBD Cc1nc(CN2CCN(CC[N+](=O)[O-])CC2)no1 791053266 CMNJYSZLXLDEQG-UHFFFAOYSA-N 255.278 -0.228 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ccccc1[N+](=O)[O-] 1100294791 OTBILFVIIFSLGN-UHFFFAOYSA-N 266.257 -0.368 5 20 CBBD O=C1C[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CCN1 1319267403 WBLPESULFJIGJW-QMMMGPOBSA-N 281.272 -0.566 5 20 CBBD CCN(CC)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1348608306 NUAGEOXUNXZRRQ-RNFRBKRXSA-N 265.291 -0.646 5 20 CBBD COC(=O)CN(CC(=O)O)Cn1cc([N+](=O)[O-])c(C)n1 1606468407 ASLVQYYATFFXPV-UHFFFAOYSA-N 286.244 -0.383 5 20 CBBD CONC(=O)CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1606996504 UXNOAEGGANHTHL-UHFFFAOYSA-N 297.223 -0.300 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)c(F)cc1NC[C@H](O)CO 1607076861 CSRTZECLJWPZPP-YFKPBYRVSA-N 298.234 -0.321 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H](CCF)C(=O)O)n1 1608122814 WCVDXTGYHCWCEC-YFKPBYRVSA-N 274.208 -0.129 5 20 CBBD C[C@@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(N)=O 45798965 FYYHVGGPSKAEJM-SSDOTTSWSA-N 287.297 -0.112 5 20 CBBD C[C@H]1C[C@@H](CN)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 261691225 INVLLAOXZOCQJC-IUCAKERBSA-N 267.289 -0.013 5 20 CBBD COC(=O)CSCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 270681629 CPCJDGJBORILPL-UHFFFAOYSA-N 288.285 -0.046 5 20 CBBD CNC(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 285332770 UOUZAGBNDJWRCV-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 330580290 TYUNMUKZCFRUEF-MRVPVSSYSA-N 298.255 -0.658 5 20 CBBD CCCN(CCO)C(=O)Cn1cnc([N+](=O)[O-])n1 343002519 KKOPCRJVNRHLTH-UHFFFAOYSA-N 257.250 -0.583 5 20 CBBD CO[C@@H]1CN(c2nccc(C(=O)O)c2[N+](=O)[O-])C[C@H]1O 395293716 GMCPGHAOWDKCAU-HTQZYQBOSA-N 283.240 -0.116 5 20 CBBD CCN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCNC1=O 555317568 QHBXNOVATUOPTC-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 594374495 SYWGRTJTZPYOCN-HTQZYQBOSA-N 282.256 -0.284 5 20 CBBD O=C(N[C@H]1CCO[C@H]1C(=O)O)c1ccc([N+](=O)[O-])cn1 595245730 ZKEGIMCEMOKMIH-IONNQARKSA-N 281.224 -0.038 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CN(C)CCO1 619789090 FMBPRKUXCCVOBW-VXNVDRBHSA-N 283.288 -0.233 5 20 CBBD C[C@H](CC(N)=O)Nc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820235698 UIGAFRXYFURSKU-RXMQYKEDSA-N 292.259 -0.154 5 20 CBBD Nc1c(C(=O)Nn2c(O)nnc2O)cc(F)cc1[N+](=O)[O-] 820292070 ONNSEBXASKCFKF-UHFFFAOYSA-N 298.190 -0.297 5 20 CBBD O=C(O)CNC(=O)COC(=O)c1ccccc1[N+](=O)[O-] 821532370 KUZNZGSUDSRRMO-UHFFFAOYSA-N 282.208 -0.048 5 20 CBBD COC(=O)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCOCC1 855446906 JZLHJDCVSVMXDE-NXEZZACHSA-N 286.284 -0.168 5 20 CBBD NC(=O)C(=O)NC1CN(Cc2csc([N+](=O)[O-])c2)C1 1030882311 UICVDCRUHOXMIJ-UHFFFAOYSA-N 284.297 -0.558 5 20 CBBD C[C@@]1(COC(=O)Cn2cnc([N+](=O)[O-])n2)CCNC1=O 1123099353 SWXQYRSJPQJNHP-JTQLQIEISA-N 283.244 -0.744 5 20 CBBD Cn1nnc2c1CC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C2 1326780552 JGYIFQYQWWCMBP-ZCFIWIBFSA-N 291.271 -0.266 5 20 CBBD O=C(N1Cc2ccc([N+](=O)[O-])cc2C1)C1(O)CNC1 1327602273 XJUYKWPKILPRRH-UHFFFAOYSA-N 263.253 -0.229 5 20 CBBD CCCNC(=O)[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1337496016 NMWSHUFJNGIYAB-LURJTMIESA-N 269.261 -0.038 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC1(N)CC1 1579877335 JPIDLUHLCOQHDQ-UHFFFAOYSA-N 253.262 -0.293 5 20 CBBD O=C(O)[C@H]1CC(=O)N(C2CCN(CC[N+](=O)[O-])CC2)C1 1605976576 DEHCOXVAFKRCGC-VIFPVBQESA-N 285.300 -0.339 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 36816394 AXGGKLOHKUQVIN-LURJTMIESA-N 257.202 -0.813 5 20 CBBD CN(C)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 37883235 VPWLVFZEJOSEJZ-JTQLQIEISA-N 257.294 -0.697 5 20 CBBD C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 49098037 XFIBXYMKNIVVIT-WPRPVWTQSA-N 285.304 -0.782 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 88373842 LDBROEUHTXAHRY-SSDOTTSWSA-N 269.213 -0.152 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@H](O)C1 90526207 MFSIIPOHSDZWMB-JTQLQIEISA-N 253.258 -0.177 5 20 CBBD O=C(N[C@]1(CCO)CCOC1)c1cc([N+](=O)[O-])[nH]n1 287274077 YKKQAPXCPYTCEO-SNVBAGLBSA-N 270.245 -0.411 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1O 330505501 KCMUTRGROXJNSI-SFYZADRCSA-N 269.261 -0.584 5 20 CBBD CN(CCNC(=O)N(C)C)CCn1ccc([N+](=O)[O-])n1 348917685 JHTIHBAOAOKHJP-UHFFFAOYSA-N 284.320 -0.006 5 20 CBBD Cc1nc([N+](=O)[O-])c(-c2noc(Cn3cnnn3)n2)n1C 350929684 TYWDSQRXIOZIQO-UHFFFAOYSA-N 291.231 -0.278 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H]2CNC[C@@H]2C1 353763165 SRSGTWUQIXNVMF-HTQZYQBOSA-N 265.273 -0.001 5 20 CBBD COC(=O)c1cnc(NCc2nnn(C)n2)c([N+](=O)[O-])c1 362855168 LFQAORALJDKXLR-UHFFFAOYSA-N 293.243 -0.088 5 20 CBBD NCC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCC1 429363244 OORCSNZCAOXFTK-UHFFFAOYSA-N 268.277 -0.426 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])o2)CCOC1 515355316 FYASBXYCSPDLBR-JTQLQIEISA-N 269.213 -0.438 5 20 CBBD Nc1ncc2c(n1)CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)CC2 598949473 CHQOFYYEXWOGPU-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD CS(=O)(=O)NC[C@H]1CCCN(CC[N+](=O)[O-])C1 787731910 UHACBSPQXJGTJK-SECBINFHSA-N 265.335 -0.476 5 20 CBBD O=c1c(F)cn([C@@H]2CCCO2)c(=O)n1CC[N+](=O)[O-] 899880422 LQMVDORNNWYEMG-QMMMGPOBSA-N 273.220 -0.265 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@@H]3C[C@H]2CN3)c1 1332334550 LTYGFSQZSHEWLQ-QXEWZRGKSA-N 267.289 -0.802 5 20 CBBD C[C@](O)(CO)CNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 1589993329 SXPNEDSNXZDUSE-LLVKDONJSA-N 294.271 -0.070 5 20 CBBD CC1(C)NC(=O)N(CCCn2cnc([N+](=O)[O-])n2)C1=O 48603276 BLGWQLVGPFABGS-UHFFFAOYSA-N 282.260 -0.093 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H](O)[C@@H](O)C2)c1 236601934 HNMSJWOGLJXCLW-UWVGGRQHSA-N 288.281 -0.679 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 267812311 RMUWZMUEMJEQCA-SSDOTTSWSA-N 298.255 -0.360 5 20 CBBD CO[C@@H]1C[C@H](CO)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 314565491 MGDZUEMCSYYMLU-RKDXNWHRSA-N 296.283 -0.206 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 345915624 NLAOSNRLIMDKKS-IUCAKERBSA-N 295.299 -0.178 5 20 CBBD COc1ccc(CNC(=O)CNC(=O)CN)cc1[N+](=O)[O-] 347645436 DEDSKBNGDKCNES-UHFFFAOYSA-N 296.283 -0.706 5 20 CBBD C[C@@H]1OCC[C@@H]1N(CCO)c1ncc([N+](=O)[O-])c(N)n1 360256609 HBIOOIDXMIOULD-YUMQZZPRSA-N 283.288 -0.057 5 20 CBBD CC(C)[C@@](C)(CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 429262549 JHAQUTAFRZQIRS-SNVBAGLBSA-N 270.293 -0.324 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1[C@H]2CNC[C@H]12 495120309 NCSOXFNXGZYWAR-IUCAKERBSA-N 278.268 -0.910 5 20 CBBD Nc1nccc(C(=O)NC[C@H](O)C(F)F)c1[N+](=O)[O-] 515354740 HHYYEENAJQAUTP-YFKPBYRVSA-N 276.199 -0.072 5 20 CBBD Cn1ccc(NCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 515487334 UPSJWYCKMFXDIJ-UHFFFAOYSA-N 279.260 -0.107 5 20 CBBD Cn1c(C(=O)N2CC[C@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-] 545283565 RGLZVUHYNDUGGL-SCZZXKLOSA-N 283.284 -0.251 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)C(=O)OC)c1[N+](=O)[O-] 561286345 LCLMKZHLALHPMF-ZCFIWIBFSA-N 282.256 0.323 5 20 CBBD O=C(NCCN1CCCC1=O)c1cc([N+](=O)[O-])n[nH]1 565136022 IHKKLIFVDKIRHP-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD C[C@H](C(=O)NCC(=O)NCCO)c1cccc([N+](=O)[O-])c1 583237867 IIRTXVVGNFMTSJ-VIFPVBQESA-N 295.295 -0.077 5 20 CBBD NCCN(Cc1cccc([N+](=O)[O-])c1)C[C@H](O)CO 595903675 ZQFKSTICZFQPKJ-LBPRGKRZSA-N 269.301 -0.291 5 20 CBBD O=C(NCc1nn[nH]n1)c1n[nH]c2ccc([N+](=O)[O-])cc12 609493534 KXQKFKXBWYSJGF-UHFFFAOYSA-N 288.227 -0.086 5 20 CBBD COCCONC(=O)c1cc([N+](=O)[O-])cnc1N 758325681 OGNNNFMQRXJSEQ-UHFFFAOYSA-N 256.218 -0.120 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CCC1 1111899963 QDOPGRAKNOXDSO-UHFFFAOYSA-N 293.283 -0.074 5 20 CBBD Cn1nccc1CCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1116932745 UUDBUWPZGQVPGQ-UHFFFAOYSA-N 291.267 -0.168 5 20 CBBD COC(=O)C1(O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1117114874 VWZWZLIFECNWJF-UHFFFAOYSA-N 298.255 -0.542 5 20 CBBD O=C(NCCCNCCn1cncn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157775385 QNLPRMUSEYVAEC-NXEZZACHSA-N 282.304 -0.961 5 20 CBBD CC[C@H](N)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261494966 LQDIBWAWIYFIJQ-QMMMGPOBSA-N 268.273 -0.390 5 20 CBBD Cc1nn[nH]c1C(=O)NCCn1cc([N+](=O)[O-])cn1 1321247447 LIUFSBOIJCWTIG-UHFFFAOYSA-N 265.233 -0.352 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)C(F)F)c1=O 1322629229 XRYHLDJOQJLOAE-UHFFFAOYSA-N 275.167 -0.310 5 20 CBBD COC[C@@H](O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1326062080 CQMHFDCOPZAVQZ-LURJTMIESA-N 258.234 -0.555 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])c(CO)c1)N1CCNCC1 1326806167 QBXNHMOAHVWECX-UHFFFAOYSA-N 295.295 -0.102 5 20 CBBD Cc1noc(CN2CCN(C)S2(=O)=O)c1[N+](=O)[O-] 1347254575 XAVVMYKYLHKWJT-UHFFFAOYSA-N 276.274 -0.117 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@H]2COC[C@@]2(C(=O)O)C1 1595279235 QCUGTSKQWFTLLF-KGFZYKRKSA-N 296.239 -0.509 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](CF)C(=O)O)c1[N+](=O)[O-] 1600768228 LJBULZALIJWZGF-RXMQYKEDSA-N 274.208 -0.211 5 20 CBBD Nc1nc(N)nc(COc2cccnc2[N+](=O)[O-])n1 18533134 ANSMAOCFLKFVCO-UHFFFAOYSA-N 263.217 -0.082 5 20 CBBD NCC(F)(F)CNC(=O)Cn1ccc([N+](=O)[O-])n1 190274566 WZVWUQNLKFXSJY-UHFFFAOYSA-N 263.204 -0.499 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 263804759 PBSOWCSVJJBDTH-LURJTMIESA-N 267.245 -0.413 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C[C@H](C)O)CC2)c1[N+](=O)[O-] 275132663 MIGABNPTUUTJFA-QMMMGPOBSA-N 297.315 -0.235 5 20 CBBD Cn1nnnc1CNC(=O)Cc1ccccc1[N+](=O)[O-] 275296188 XXANGGCIMYFOEG-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1cnc(O)c([N+](=O)[O-])c1 277953991 DASIHIHFQKGGKC-NSHDSACASA-N 283.240 -0.423 5 20 CBBD COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)OC 293979960 KVWASNMZGFXEHF-ZETCQYMHSA-N 271.229 -0.159 5 20 CBBD Cn1c(C(=O)N[C@@H]2CCCNC2=O)ccc1[N+](=O)[O-] 330582327 VDQUJUISFAGBHH-SSDOTTSWSA-N 266.257 -0.058 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCN2CCCC[C@H]12 331623638 HCOBVCJEAAOKIO-VHSXEESVSA-N 294.315 -0.071 5 20 CBBD Nc1nc(N2C[C@@H]3[C@H](CCS3(=O)=O)C2)ncc1[N+](=O)[O-] 343507883 OIMSUYWIFQLIAN-HTRCEHHLSA-N 299.312 -0.410 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 347884311 LQTIEHVUMSNBDX-SNVBAGLBSA-N 295.343 -0.091 5 20 CBBD CC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362578451 FDOPFZFUFFCMIV-YFKPBYRVSA-N 257.206 -0.834 5 20 CBBD CCN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 452952080 LVSSMLHTZLBTQU-LURJTMIESA-N 267.245 -0.332 5 20 CBBD COC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])cn2C)CCOC1 530795823 YJEHFTKWWHGYSH-LBPRGKRZSA-N 297.267 -0.005 5 20 CBBD COC(=O)C[C@@H](O)CSc1ncc([N+](=O)[O-])c(N)n1 594901186 ACBTVPGLFRDSCT-RXMQYKEDSA-N 288.285 -0.017 5 20 CBBD O=C1CN=C(NC(=O)COc2ccc([N+](=O)[O-])cc2)N1 604184831 LOKFWPFNXKNSTM-UHFFFAOYSA-N 278.224 -0.424 5 20 CBBD O=C1[C@H]2C[C@H]2C(=O)N1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 611165797 QHUZKJPNXXPYFM-HLTSFMKQSA-N 280.240 -0.843 5 20 CBBD CCCc1[nH]nc(C(=O)NOCCO)c1[N+](=O)[O-] 776582361 SPUKKUAXMFCULU-UHFFFAOYSA-N 258.234 -0.076 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O 779679144 UAGZISCPGVAXME-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD COCC(=O)N(C)CC(=O)OCC(C)(C)[N+](=O)[O-] 851127305 NCXLAORFHJEAGQ-UHFFFAOYSA-N 262.262 -0.310 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 860849252 MYPIRTDRXNYVSY-ZETCQYMHSA-N 297.271 -0.059 5 20 CBBD CNS(=O)(=O)C[C@@H]1CCCN1CC[N+](=O)[O-] 930017904 LKBCKGOLKUREHA-QMMMGPOBSA-N 251.308 -0.723 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCCNC1 1118082270 WPMHQEMJZUVOSV-BDAKNGLRSA-N 282.304 -0.309 5 20 CBBD Cc1nocc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936672 QBEORHAAMRQKQW-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H](CO)[C@H](CO)C2)n1 1174898137 GUFVYKNMMBNXLA-UWVGGRQHSA-N 270.289 -0.676 5 20 CBBD O=C(N[C@H](CO)C1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1321549751 FLOTXKNDPUMETP-MRVPVSSYSA-N 284.272 -0.165 5 20 CBBD C[C@H]1C[C@@H](N)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1326702508 MCGZHRHPFDFFFQ-YUMQZZPRSA-N 268.277 -0.476 5 20 CBBD CCn1nncc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1330100155 RZMDZVQSHMMWDX-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD C[C@@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])cn1 174842980 MHYYPYPJZSRPSD-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1CO 190906703 JUQJNGNJBWVYKM-SCVCMEIPSA-N 284.316 -0.288 5 20 CBBD NC(=O)CN1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1 192800018 XMIONIOFIFFQPK-UHFFFAOYSA-N 279.300 -0.216 5 20 CBBD CC(C)N(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 264040660 RHRKEBJZNLCELP-UHFFFAOYSA-N 296.283 -0.521 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(CCO)C1CC1 268873747 TYQPXQINRMLCAS-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)N(C)[C@H](C)C1 282348544 LQCACPFUVBXVKQ-MRVPVSSYSA-N 295.299 -0.211 5 20 CBBD Cc1nc(CCNC(=O)c2cc([N+](=O)[O-])[nH]n2)n[nH]1 285317608 IQVGHTBOALCFOT-UHFFFAOYSA-N 265.233 -0.283 5 20 CBBD CC(C)(CNC(=O)c1cc([N+](=O)[O-])[nH]n1)OCCO 292029371 GNMFXVYLDUXJQJ-UHFFFAOYSA-N 272.261 -0.165 5 20 CBBD NC(=O)[C@@H](O)CNc1c(Cl)cncc1[N+](=O)[O-] 302615528 YWPWVBJJBUFGBC-LURJTMIESA-N 260.637 -0.099 5 20 CBBD C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C(=O)N(C)C 338636884 LCCXPBRVHVTXDI-QMMMGPOBSA-N 296.283 -0.651 5 20 CBBD CC[C@H](C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339345263 FMVGCVHHZLNWDD-POYBYMJQSA-N 285.260 -0.198 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1COC[C@@H]1O 342315169 KXDCWBVZGSGUJL-BDAKNGLRSA-N 284.272 -0.682 5 20 CBBD O=C(NC[C@@H]1CN2CCN1CC2)c1cc([N+](=O)[O-])n[nH]1 354206896 KUVSWKUFLIFMFB-MRVPVSSYSA-N 280.288 -0.953 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1N 429180354 XRNFMRHYRZHQMX-MWLCHTKSSA-N 294.311 -0.048 5 20 CBBD CNc1nc(C(=O)N2CCNC(=O)[C@@H]2C)ccc1[N+](=O)[O-] 455364835 VOJZLRNRQMBMCD-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)OC[C@H]2C1 495656312 IVIBNIXXUSAOPQ-ZCFIWIBFSA-N 281.228 -0.406 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCc1cc[nH]n1 548502834 OOVCYDKSOATEKH-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCN(C(=O)C(=O)O)CC1 563218100 WIIDCCPXSCERNL-UHFFFAOYSA-N 297.271 -0.943 5 20 CBBD Nc1nc(N2CCC(O)(C(=O)O)CC2)ncc1[N+](=O)[O-] 564216005 QRUCLRYSPQAYJN-UHFFFAOYSA-N 283.244 -0.617 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)C1(O)CCOCC1 748119090 DYNPSLAHWXGFPI-UHFFFAOYSA-N 285.256 -0.124 5 20 CBBD O=[N+]([O-])c1ccn(CCn2cnc([N+](=O)[O-])n2)n1 748615226 VVWZYQCTSFBKAL-UHFFFAOYSA-N 253.178 -0.009 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(C[C@@H]2CCCO2)CC1 840242651 ZWBBDQWKYVBBPM-QJPTWQEYSA-N 283.328 -0.025 5 20 CBBD CCOC(=O)c1cn(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 846643796 KFRDJCNZQXCVTI-PSASIEDQSA-N 296.283 -0.159 5 20 CBBD O=C(N[C@@]1(CO)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1116585135 RPPXDQRKWVQFIM-SECBINFHSA-N 256.218 -0.801 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC(O)(CO)CC1 1118731297 NAHNATOFNVTDCR-UHFFFAOYSA-N 298.299 -0.473 5 20 CBBD Cn1nncc1NC(=O)Cn1ccc([N+](=O)[O-])n1 1321826656 SJFKTPLDFJCOQA-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)NCCF 1326065067 UXRYJHHABPLSKT-YFKPBYRVSA-N 273.224 -0.478 5 20 CBBD NC(=O)NC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1339908223 ROBVXBUDZBSSPJ-UHFFFAOYSA-N 296.287 -0.549 5 20 CBBD C[C@@H]([C@H](C)C(=O)O)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1603190563 VXFJRWMJVXOERB-VWDOSNQTSA-N 294.285 -0.793 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1608632734 UVOGHGNXTICCPC-YFKPBYRVSA-N 254.202 -0.135 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])s1 29680528 VWLLRRUNXTYNPK-UHFFFAOYSA-N 293.326 -0.065 5 20 CBBD O=C(NCCN1CCNCC1)c1ccc([N+](=O)[O-])[nH]1 36278222 UIQSGHASVHTZKD-UHFFFAOYSA-N 267.289 -0.442 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCC(=O)NCC(=O)O)n1 162561603 BKSVKVAUODXRJB-UHFFFAOYSA-N 268.229 -0.089 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnc[nH]1 225069975 BYTQPFKHVYXAER-ZCFIWIBFSA-N 265.233 -0.213 5 20 CBBD NC(=O)CCNC(=O)CNc1ccccc1[N+](=O)[O-] 266677946 LAEWMMSRMIJREF-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD CC1(O)CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 277698877 HRIFXJUYBQYNBN-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD CCOC1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 296153758 MUDNBFKZKXCHRV-JTQLQIEISA-N 270.289 -0.127 5 20 CBBD CN(C)C(=O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 330425791 GMAVUJYHHFSNOM-UHFFFAOYSA-N 283.288 -0.269 5 20 CBBD NC(=O)COCCNC(=O)c1ccc(F)cc1[N+](=O)[O-] 336840442 QBTSNJORBRRMGJ-UHFFFAOYSA-N 285.231 -0.034 5 20 CBBD CNC(=O)C(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 340627211 GJROMTIUQDDODS-UHFFFAOYSA-N 277.240 -0.167 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 347884310 LQTIEHVUMSNBDX-JTQLQIEISA-N 295.343 -0.091 5 20 CBBD NC(=O)c1ccc(N2CCO[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 353088586 OXTCBEZYRTYUBQ-SNVBAGLBSA-N 294.267 -0.616 5 20 CBBD Cc1[nH]nc(C(=O)NCCCOCCO)c1[N+](=O)[O-] 357050614 BQCUEXICCINTDS-UHFFFAOYSA-N 272.261 -0.245 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@H](O)C[C@H]1CO 357643482 LPXCRIKXPNONPM-GXSJLCMTSA-N 282.252 -0.132 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360646999 LICZWPIMJHSDCF-LLVKDONJSA-N 285.304 -0.629 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN2C(=O)NC[C@H]2C1 408385453 LZULJJTWCWRCGC-QMMMGPOBSA-N 279.256 -0.228 5 20 CBBD C[C@@H]1CCNC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427573569 KKGNABTYKQRKSS-SFYZADRCSA-N 268.277 -0.700 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)OC 554014059 SCZWHTLWVJDNDH-VIFPVBQESA-N 285.256 -0.149 5 20 CBBD N[C@@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 571441599 MPOXTXZITHQGRA-SSDOTTSWSA-N 272.286 -0.289 5 20 CBBD CC(C)(C(=O)NC[C@H](O)C(N)=O)c1ccccc1[N+](=O)[O-] 597586362 LSACQLABGVDGRV-JTQLQIEISA-N 295.295 -0.165 5 20 CBBD Cn1nnnc1CNC(=O)CNc1ccccc1[N+](=O)[O-] 614712783 ZFKPZHVLLYAGRY-UHFFFAOYSA-N 291.271 -0.153 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC2(CCNC2)C1 724117611 DTIZIEDUTRNZTD-UHFFFAOYSA-N 277.284 -0.112 5 20 CBBD O=C(NN1CCCC1=O)c1cc([N+](=O)[O-])cnc1O 780697199 CAMQTGQOICVBQB-UHFFFAOYSA-N 266.213 -0.037 5 20 CBBD O=C(O)C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 833220071 QZGRLKZHBITHEE-SECBINFHSA-N 284.272 -0.033 5 20 CBBD O=C(CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)NCCO 843070591 DMLZSFYTOPZWER-NSHDSACASA-N 283.284 -0.674 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@@]1(O)CCOC1 846443047 VJAGPTTURVREEP-GFCCVEGCSA-N 296.283 -0.157 5 20 CBBD CON1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 854860790 MWECWWOGHXWHJT-UHFFFAOYSA-N 296.283 -0.538 5 20 CBBD O=C(NC1CN(C(=O)c2cnco2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991286534 BUYVWCRTFYQQGU-HTQZYQBOSA-N 280.240 -0.720 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCNC(=O)CC(N)=O)n1 1093538473 ISYWKYHDZOGJFF-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD COC[C@H](OC)C(=O)OCCn1cnc([N+](=O)[O-])n1 1263385171 MBUPJXQRLFEPHK-ZETCQYMHSA-N 274.233 -0.609 5 20 CBBD CCN(CCCO)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319511672 VEBWWSFFGYFBPS-UHFFFAOYSA-N 283.284 -0.013 5 20 CBBD C[S@](=O)C1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1321325381 OUHDOHXLSGFJPX-SFHVURJKSA-N 272.286 -0.041 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@]2(O)CCO[C@@H]2C)c1[N+](=O)[O-] 1321428860 CIBLZHQVGMAAOW-PRHODGIISA-N 298.299 -0.094 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1331848173 XLQWPDCMPHKBQV-LURJTMIESA-N 285.260 -0.534 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCc1csnn1 1343991588 SGDYAYPDWLDJRF-UHFFFAOYSA-N 270.230 -0.219 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC2(CCNC2)CC1 1346045492 BIPULZAQKVYYOX-UHFFFAOYSA-N 294.315 -0.212 5 20 CBBD CC(C)[C@H](C(N)=O)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589419162 FOEJWLRIRZVYRF-SSDOTTSWSA-N 280.248 -0.346 5 20 CBBD O=C(O)C12CC(C(=O)OCCn3cnc([N+](=O)[O-])n3)(C1)C2 1601729639 PSHJXPWTAFRBHH-UHFFFAOYSA-N 296.239 -0.016 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H]2CCCO2)c1 37882051 BYTAMAXDRVHIEN-QWRGUYRKSA-N 270.289 -0.079 5 20 CBBD CNS(=O)(=O)c1ccc(N2CC(O)C2)c([N+](=O)[O-])c1 57839061 RBUCNJYLUFBJPV-UHFFFAOYSA-N 287.297 -0.316 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1c1c([N+](=O)[O-])ncn1C 168542061 GJAHVOIIFZQIMQ-JGVFFNPUSA-N 256.262 -0.086 5 20 CBBD NC(=O)[C@@H]1CCCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 267298685 JNIWCJDNZRITMI-NXEZZACHSA-N 295.299 -0.048 5 20 CBBD COC(=O)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 267833541 RRVCMGNAWPMLNS-SNVBAGLBSA-N 282.256 -0.141 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(C(=O)NC)C2)c1[N+](=O)[O-] 274507213 UQEBCCAHPLMLOJ-UHFFFAOYSA-N 281.272 -0.302 5 20 CBBD Cc1cc(C(=O)N[C@@H](CO)C(N)=O)ccc1[N+](=O)[O-] 286233536 HSTUBJDBDJSBNI-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD Cc1nc(NCCS(=O)(=O)N(C)C)ncc1[N+](=O)[O-] 295688877 NRIGWHKMWLDISK-UHFFFAOYSA-N 289.317 -0.003 5 20 CBBD CN(C[C@@H]1CCCO1)C(=O)Cn1cnc([N+](=O)[O-])n1 330646285 ZCRAWPFKHSFIPO-QMMMGPOBSA-N 269.261 -0.176 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CCO1 352939663 AWMUWVLAJSNQMD-VIFPVBQESA-N 295.255 -0.870 5 20 CBBD C[C@@H]1CNCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 432514607 MXDZAUNEORSXCK-BDAKNGLRSA-N 267.289 -0.095 5 20 CBBD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCCO 494823253 PXMIKGKYVIHPGA-QMMMGPOBSA-N 285.304 -0.064 5 20 CBBD Cc1cccc([N+](=O)[O-])c1NC(=O)Cn1nnnc1CN 580308498 HMKKPQNGGOICJY-UHFFFAOYSA-N 291.271 -0.013 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nccc(N)n1 597720234 PAVDCVCWXDHKMU-SSDOTTSWSA-N 291.271 0.041 5 20 CBBD O=[N+]([O-])c1ccn(-c2ccc(-c3nn[nH]n3)nn2)n1 826500988 UWGHEBHABQZFJJ-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD C[C@H]1CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839619927 CCYFCKWEUMZCRY-IVZWLZJFSA-N 257.290 -0.512 5 20 CBBD CCS(=O)(=O)N1CCN(CC[N+](=O)[O-])CC1 929421757 LETIEUVQHWLMPV-UHFFFAOYSA-N 251.308 -0.770 5 20 CBBD Cc1nn(C)c(C(=O)N2CCCO[C@H](CN)C2)c1[N+](=O)[O-] 1118227527 NNSUTSOAGKYDME-SECBINFHSA-N 297.315 -0.173 5 20 CBBD CNC(=O)Cc1noc(Cn2nccc2[N+](=O)[O-])n1 1323564928 QHLBUFJOCSIPHM-UHFFFAOYSA-N 266.217 -0.489 5 20 CBBD CS(=O)(=O)C1CN(c2ccnc(O)c2[N+](=O)[O-])C1 1330045056 HPWVBALTIDIFMF-UHFFFAOYSA-N 273.270 -0.071 5 20 CBBD Nc1ncc(C(=O)N[C@H](CF)C(=O)O)cc1[N+](=O)[O-] 1601221091 ITXQZZCQBXAVEJ-RXMQYKEDSA-N 272.192 -0.276 5 20 CBBD Nc1c([N+](=O)[O-])ccc(N2CC[C@H](O)C2)c1-c1nn[nH]n1 1606451010 CLBLGYFBVJSPPU-LURJTMIESA-N 291.271 -0.072 5 20 CBBD O=C(NCC1(O)CN(Cc2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1754767715 QEQGJVWAKLWHSB-NXEZZACHSA-N 296.283 -0.997 5 20 CBBD NC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 54546344 XFXZEACVMOJTGH-UHFFFAOYSA-N 282.256 -0.569 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)CC(C)(CO)CO 90552790 AWLRJMYPCHSPGI-UHFFFAOYSA-N 299.327 -0.321 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C[C@H](CO)O1 229997284 PVWLNXBPDSLTPV-IONNQARKSA-N 297.267 -0.083 5 20 CBBD CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230676756 WAAXCPAOOLMHHP-UHFFFAOYSA-N 267.245 -0.562 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 275436400 BFWVVZTXIMPVDB-APPZFPTMSA-N 298.255 -0.544 5 20 CBBD O=C(NCCCn1cc(CO)nn1)c1ccc([N+](=O)[O-])[nH]1 292163054 ZMQHSVSGCFDMMY-UHFFFAOYSA-N 294.271 -0.173 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343182980 JIILJAWXWAIFJY-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1C=C[C@H](CO)C1 360757205 XQMWUYOHKQREAK-YUMQZZPRSA-N 266.257 -0.005 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@](O)(C3CC3)C2)c1 365851941 XQDDKFZPPAVKDZ-STQMWFEESA-N 296.327 -0.001 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)CN 441609171 IXEPDDLIOPBFMD-ZETCQYMHSA-N 255.278 -0.189 5 20 CBBD CCC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 568859533 JLJUCXPLSZFIJF-UHFFFAOYSA-N 267.245 -0.030 5 20 CBBD CN(CCC(N)=O)C(=O)c1ccnc(N)c1[N+](=O)[O-] 575070670 DWIMQXCIYKEROI-UHFFFAOYSA-N 267.245 -0.481 5 20 CBBD Cn1cc(C[C@@H](CO)Nc2ncc([N+](=O)[O-])c(N)n2)cn1 596277396 KOQULINCCNZSBP-QMMMGPOBSA-N 293.287 -0.284 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 600217007 MHLZQDCWELWQKM-QWRGUYRKSA-N 281.268 -0.429 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@H]2COC[C@H]2C1 601973225 MLVGZWXMGBPPQB-DTORHVGOSA-N 266.257 -0.104 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)C1CCN(S(N)(=O)=O)CC1 814036848 MBNWFLBKPGGYIG-ZETCQYMHSA-N 295.317 -0.890 5 20 CBBD Cc1cc(C(=O)Nn2c(O)nnc2O)c(N)c([N+](=O)[O-])c1 816734329 JWZXSLFQGSQQGX-UHFFFAOYSA-N 294.227 -0.128 5 20 CBBD O=C(O)NCCC(=O)NCCn1cc([N+](=O)[O-])cn1 832599578 UMTWYQMQPQGRGW-UHFFFAOYSA-N 271.233 -0.435 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OC[C@@H]1CCC(=O)N1 845139906 KPEBUYLMWVARTQ-LURJTMIESA-N 268.229 -0.236 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCCN(CCO)CC1 892338267 UDOKXIRAKSWCFH-UHFFFAOYSA-N 269.305 -0.167 5 20 CBBD Cc1cc(NCCNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1094079415 FXXKCRNFFFVTPU-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CCC1 1323513053 AKRAYFUUFZJRBZ-UHFFFAOYSA-N 253.262 -0.236 5 20 CBBD Cc1nn(C)c(C(=O)NCCOCC(=O)O)c1[N+](=O)[O-] 1330255003 RQELZVVGHWMANF-UHFFFAOYSA-N 286.244 -0.532 5 20 CBBD NC(=O)[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCO1 50956129 ILZTXQBQLKIRAK-ZCFIWIBFSA-N 297.296 -0.006 5 20 CBBD C[C@@]1(O)CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 124082613 ICPORKCTRWXGMI-NWDGAFQWSA-N 284.316 -0.001 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 194174416 ZJUCPOSCHZXYHU-XVKPBYJWSA-N 281.272 -0.568 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236559958 RKWWPXBURYZTPJ-UWVGGRQHSA-N 282.252 -0.462 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])o1 298763762 BIHLUUGVCSCULJ-UHFFFAOYSA-N 271.229 -0.320 5 20 CBBD Cn1c(C(=O)N2CC[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-] 339672618 YVCUEVJNRNPRFA-SSDOTTSWSA-N 266.257 -0.119 5 20 CBBD CCn1cc(S(=O)(=O)NCCC(=O)O)c([N+](=O)[O-])n1 340455720 OIBVWCWDDPRVIF-UHFFFAOYSA-N 292.273 -0.436 5 20 CBBD COC(=O)Cn1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 352655693 VOGPKUCOOBNKHB-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD Cn1c(C(=O)N2CCCn3nnnc32)ccc1[N+](=O)[O-] 354451859 AOSMZIXLMZXGEC-UHFFFAOYSA-N 277.244 -0.030 5 20 CBBD Cn1cnc(C(=O)NCCn2cc([N+](=O)[O-])cn2)n1 355157357 GRWVXWFJXHXXKY-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 556858907 BPIMCFXUWMJQJK-VIFPVBQESA-N 258.234 -0.555 5 20 CBBD C[C@H](NS(=O)(=O)c1ncccc1[N+](=O)[O-])C(N)=O 594741777 GFBHQIYXPFJRGB-YFKPBYRVSA-N 274.258 -0.858 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCOC[C@H]2CO)c1 595715016 AXSSDKMZPOWFIA-SNVBAGLBSA-N 256.262 -0.516 5 20 CBBD C[C@@H](O)C(=O)N1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596179510 XBCMSYLSCCEXMM-MRVPVSSYSA-N 296.283 -0.275 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CN1C1CC1 610654049 FROMOJQYFFCYCV-DTWKUNHWSA-N 294.315 -0.072 5 20 CBBD Cn1ncc(CCCNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 817972866 DIHZZGVKJGSEDY-UHFFFAOYSA-N 293.287 -0.331 5 20 CBBD CCc1[nH]nc(C(=O)Nn2c(O)nnc2O)c1[N+](=O)[O-] 854610405 HHDYFYMDNXITFA-UHFFFAOYSA-N 283.204 -0.733 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnon1 973254398 LWPIRTQHDWARFU-JXOAFFINSA-N 295.255 -0.888 5 20 CBBD Cc1nc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 1031663424 ZGYYLTKHKBKCFO-NXEZZACHSA-N 294.315 -0.674 5 20 CBBD CC(=O)NCC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093455578 OTQBROVLBDGHSF-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)N(C)C 1116628285 JVOOXRPGNVUBHL-RXMQYKEDSA-N 255.234 -0.476 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC1CNC1 1118149098 XAGICHIKDIYYRA-UHFFFAOYSA-N 267.289 -0.175 5 20 CBBD Cn1ccnc1CNC(=O)c1c([N+](=O)[O-])cnn1C 1319650204 CQURRHNDXVZGGP-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD CN(CCC(N)=O)c1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1579105295 IGHFDYDOKJVRPU-UHFFFAOYSA-N 292.259 -0.519 5 20 CBBD Cc1nn(C)c(NC[C@H](O)CC(=O)O)c1[N+](=O)[O-] 1607999218 LQQXBDMPYLQOME-ZCFIWIBFSA-N 258.234 -0.116 5 20 CBBD O=C(O)CCCCOC(=O)Cn1cnc([N+](=O)[O-])n1 1608713222 GHAYSSCVQLSSFE-UHFFFAOYSA-N 272.217 -0.016 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@@H](CO)[C@@H](CO)C2)n1 1608915283 NHXFOIAQOSTGEY-OCAPTIKFSA-N 297.267 -0.275 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CCN(C3CC3)C2)c1 44721350 DQZBFELZIMSSQJ-MFKMUULPSA-N 295.343 -0.022 5 20 CBBD O=C(O)[C@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 50162201 LGMKACUUEACWRE-SSDOTTSWSA-N 268.229 -0.133 5 20 CBBD CC(C)(CNC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 192897913 MHPNPJVTENKTMG-UHFFFAOYSA-N 269.261 -0.581 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 230706273 LGTFKYMSGILVAZ-CBAPKCEASA-N 296.283 -0.206 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236561367 MFBGWYQAKFVOKY-QWRGUYRKSA-N 266.253 -0.299 5 20 CBBD C[C@H](O)[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 248602159 URSZEJVXCWYOGT-HOSYDEDBSA-N 284.316 -0.145 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)N(CC(N)=O)CC(N)=O 264880394 JXMGOXLESVNWRF-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@@H](OCCO)C1 269509774 OECUTLOAZUWMBB-LLVKDONJSA-N 298.299 -0.209 5 20 CBBD C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@H](O)C1 278556896 BFKUKUQKNZCIGM-KPXOXKRLSA-N 295.295 -0.041 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1CO 331261027 BOPFPFCHEUYQRI-JGVFFNPUSA-N 269.261 -0.584 5 20 CBBD Nc1noc(CCN=c2ncc([N+](=O)[O-])c[nH]2)n1 354602826 MEJPMHFDPFKKLZ-UHFFFAOYSA-N 251.206 -0.574 5 20 CBBD O=C(CCNC(CO)CO)Nc1ccccc1[N+](=O)[O-] 517030215 JUYWGIXKOABGDO-UHFFFAOYSA-N 283.284 -0.134 5 20 CBBD COC(=O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548057067 XFHQWQQYEDTXGQ-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD Nc1nc(=NCCN2CCCC2=O)[nH]cc1[N+](=O)[O-] 568022512 WRBHFNHWKQRSJH-UHFFFAOYSA-N 266.261 -0.577 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCOCCN1 597707585 NTZBDNZECVDGGS-UHFFFAOYSA-N 283.288 -0.147 5 20 CBBD Cn1cc(C(=O)C(=O)OCCn2ccc([N+](=O)[O-])n2)cn1 748119914 XRHNWSWDIFGXKS-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])NCCn1cnnn1 807920231 PATLGJDZXOLCPC-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NS(=O)(=O)CC(F)F 851360034 KMBDOYXLSYRHOH-UHFFFAOYSA-N 298.227 -0.498 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1C[C@@H](C(N)=O)C1 863358103 PUUUJFKPTMGTRJ-KNVOCYPGSA-N 293.283 -0.092 5 20 CBBD O=C(CC1CC1)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543548 NSHWXHZDKBCQEI-GHMZBOCLSA-N 299.327 -0.611 5 20 CBBD CCOCCONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1320701148 UGCHCBPTSNPIKT-UHFFFAOYSA-N 285.256 -0.159 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1CC(O)(C(=O)O)C1 1601342738 QHRPGXLRAHMAHI-UHFFFAOYSA-N 296.235 -0.369 5 20 CBBD COC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 19025754 IDJGOVVVHISZTO-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD C[C@@H](CO)NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 129212509 PYURSOFWJGKWGF-QMMMGPOBSA-N 281.268 -0.178 5 20 CBBD COC[C@@H](C)OC[C@@H](O)Cn1cnc([N+](=O)[O-])n1 234817899 NQSUJSYARXDDLP-SFYZADRCSA-N 260.250 -0.401 5 20 CBBD CO[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 263029526 BYPBWCDSLCXVKB-MRVPVSSYSA-N 286.244 -0.603 5 20 CBBD NC(=O)CNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 272730000 LFSNGDUREPTNFA-JTQLQIEISA-N 292.251 -0.311 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@H]2CN3CCN2CC3)nc1 274007914 ULPKZOBMPRRUOW-JTQLQIEISA-N 264.289 -0.204 5 20 CBBD Cc1[nH]nc(C(=O)N(C[C@H](C)O)[C@H](C)CO)c1[N+](=O)[O-] 275963800 HTCZLEXGIKBJGR-RQJHMYQMSA-N 286.288 -0.170 5 20 CBBD CCCNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 299150558 YAYYVACDHXBVLR-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD COC(=O)C[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 311551475 LWSJEEXJJJOOIY-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD C[C@H]1OCC[C@]1(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330865044 YTFFIMAEERPDAZ-XCBNKYQSSA-N 269.261 -0.130 5 20 CBBD CN(CC(N)=O)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338673437 XBTBSCYXHUUIGA-UHFFFAOYSA-N 269.261 -0.530 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 341737488 MLJOGUTWASAFKF-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD O=C(O)Cn1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1 345886075 KVFLYIQOAAKYBZ-UHFFFAOYSA-N 294.227 -0.289 5 20 CBBD O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1nn[nH]n1 347742902 DQLWJUIKIMLIBD-UHFFFAOYSA-N 256.609 -0.029 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 351864017 RFHKXSJYCVAQSR-CBAPKCEASA-N 254.246 -0.370 5 20 CBBD O=C(N[C@H]1C=C[C@@H](CO)C1)c1cc([N+](=O)[O-])n[nH]1 354065069 PFLIMNYCHZOURO-RQJHMYQMSA-N 252.230 -0.015 5 20 CBBD CCN1C(=O)[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCN2C1=O 370221127 SMDXNBYRLYRLRM-HLTSFMKQSA-N 296.283 -0.854 5 20 CBBD C[C@H](CC(N)=O)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 493606297 PQCOZKRBICVKLJ-SSDOTTSWSA-N 294.267 -0.087 5 20 CBBD C[C@@H](C(=O)NC[C@@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1F 597584355 FSBPWHKPUJNTNO-LHLIQPBNSA-N 299.258 -0.200 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 600316649 AUNCTXBELSMEBI-KBTIHESUSA-N 280.240 -0.311 5 20 CBBD CCNC(=O)CN(C)CCn1cc([N+](=O)[O-])ccc1=O 611185711 QFBZDEUCDNJSCR-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD CC[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 726996295 HUCFDQLMECHIID-SSDOTTSWSA-N 256.218 -0.402 5 20 CBBD COCCONC(=O)CCn1cc([N+](=O)[O-])cn1 748774384 QVCVFZLQHLOZTB-UHFFFAOYSA-N 258.234 -0.124 5 20 CBBD COC[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CCCO1 839747818 FJXZZAGDLDTYBG-KYXWUPHJSA-N 258.274 -0.038 5 20 CBBD CC(=O)NCC(=O)NCCNc1nccc(C)c1[N+](=O)[O-] 1093455873 ZFQBXVGACSQOQR-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@]1(O)CCOC1 1116378203 BRKWHJFGAWNTPZ-GFCCVEGCSA-N 298.299 -0.243 5 20 CBBD COC(=O)c1cn(CCn2ccc(=O)c([N+](=O)[O-])c2)nn1 1116697194 FKPDFPVEYZAVTP-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@H]1COCCO1 1255624154 IRXZRLKFFCFBET-SSDOTTSWSA-N 256.218 -0.318 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@@H]1O 1321006875 ZDFQBTIUVOLRFX-NSHDSACASA-N 295.295 -0.014 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(CCO)C1CC1 1324268092 VXYRLYYLMZEEKP-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](CO)C(N)=O 1324270942 GYLSKETZMBBIBZ-ZETCQYMHSA-N 267.241 -0.521 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N[C@@H]1C=CCC1 1328465613 BRXJTKFFETUDNF-SECBINFHSA-N 293.283 -0.258 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H](F)C(=O)O)c1[N+](=O)[O-] 1600768192 IVKANMOOAYTBGD-YFKPBYRVSA-N 274.208 -0.211 5 20 CBBD O=C(O)C1(O)CCN(CCn2ccc([N+](=O)[O-])n2)CC1 1610730137 RHGMGUDQAPFSDT-UHFFFAOYSA-N 284.272 -0.297 5 20 CBBD C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)NC(N)=O 36800735 NRJQWMJNUJRDCN-YFKPBYRVSA-N 254.202 -0.048 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C1=COCCO1 122751618 ILPILZUVAFIFBE-UHFFFAOYSA-N 268.229 -0.204 5 20 CBBD Cc1nn(CCC(=O)N2CCNC(=O)C2)c(C)c1[N+](=O)[O-] 170664635 CVLQLRVFZIRHQF-UHFFFAOYSA-N 295.299 -0.243 5 20 CBBD CC(=O)NC[C@H](C)OC(=O)Cn1cc([N+](=O)[O-])cn1 179260312 GZLYWRSHOHMUOL-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@H](O)[C@H](O)C2)c1 278799874 OOPSMFZSQKKHHL-SDDRHHMPSA-N 268.269 -0.334 5 20 CBBD CCOC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 312377256 MTXUCADGPXBJMU-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 330420628 RDFIBUFYHNZTKO-ZCFIWIBFSA-N 252.230 -0.117 5 20 CBBD Cc1cn(CC(=O)N[C@@H](C)C(=O)N(C)C)nc1[N+](=O)[O-] 337939343 RMTKEKHKZHFOKP-QMMMGPOBSA-N 283.288 -0.307 5 20 CBBD COC(=O)Cn1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 340514386 LOOPRNKKCYHNOD-UHFFFAOYSA-N 293.239 0.545 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 345563845 XSEWWOBWEPEJAD-LURJTMIESA-N 267.245 -0.345 5 20 CBBD COC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 346158646 BHDWGOQTMIYZPM-UHFFFAOYSA-N 295.251 -0.422 5 20 CBBD CN(C)[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 358286160 HUFJMMWUXRJXRK-SECBINFHSA-N 282.304 -0.357 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CN1 358890606 PPSKAEMQLFKDGS-SECBINFHSA-N 299.308 -0.097 5 20 CBBD C[C@]1(C(N)=O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361558173 VAXNRHASEZXPSG-JQWIXIFHSA-N 297.315 -0.651 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 548407787 CDIUAKUQKIPNBX-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD CN(C)C[C@@H](CO)Nc1nccc(C(N)=O)c1[N+](=O)[O-] 596242365 FVTRKAHVPPICSZ-ZETCQYMHSA-N 283.288 -0.577 5 20 CBBD CN1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1=O 613999217 RKCKWPBKBOKNTB-VIFPVBQESA-N 281.272 -0.614 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCSC[C@@H]1CO 708362075 FFDNDKIPPFNURY-QMMMGPOBSA-N 286.313 -0.272 5 20 CBBD Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)c(N)c([N+](=O)[O-])c1 777772241 STHZWWHKHUGECO-QMMMGPOBSA-N 293.283 -0.440 5 20 CBBD COC(=O)CN(C)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 821662520 GNBRHKPJAQUZDX-UHFFFAOYSA-N 293.243 -0.221 5 20 CBBD COC[C@H](NC(=O)Cc1ccc(F)cc1[N+](=O)[O-])C(N)=O 844449148 DUXWWZVITZHZEO-VIFPVBQESA-N 299.258 -0.107 5 20 CBBD Cn1ncc(Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])n1 863343685 IFKXFEMPKAUBJZ-UHFFFAOYSA-N 253.178 -0.124 5 20 CBBD CC(C)(Cn1cc(CCN2CCNCC2)nn1)[N+](=O)[O-] 864642394 NISYNNIVIURXKX-UHFFFAOYSA-N 282.348 -0.219 5 20 CBBD CS(C)(=O)=NC(=O)[C@@H]1CCCN1CC[N+](=O)[O-] 930707542 HDRQXWPZUYHRNY-QMMMGPOBSA-N 263.319 -0.018 5 20 CBBD NC(=O)C(=O)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 1055999598 ZCSYKYOLPLJWQQ-UHFFFAOYSA-N 296.258 -0.132 5 20 CBBD NC(=O)CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1 1107087501 FJKWMNIXDNAOTF-UPHRSURJSA-N 293.283 -0.051 5 20 CBBD Cn1cnnc1CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 1117736898 BLYPRFYIZAKVIA-UHFFFAOYSA-N 293.287 -0.331 5 20 CBBD CC(C)[C@H](O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589480672 SILRPCNEUAPRHB-SSDOTTSWSA-N 267.249 -0.012 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@H]2COCO2)c(-c2nn[nH]n2)c1 1593485045 OWJHTUIVEDILQV-ZETCQYMHSA-N 293.243 -0.045 5 20 CBBD Nc1ncc(C(=O)N2CCOC[C@H]2C(=O)O)cc1[N+](=O)[O-] 1605655531 RGNBXGQFBBWSIH-QMMMGPOBSA-N 296.239 -0.502 5 20 CBBD Cn1nc(C(=O)O)cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608143907 JWOSJSQFPLVUFC-INEUFUBQSA-N 254.202 -0.278 5 20 CBBD CO[C@@]1(C(=O)O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 1777155773 FYQBUYUQNTZCLR-JTQLQIEISA-N 283.244 -0.353 5 20 CBBD Cc1nn(Cc2cc(=O)n(C)c(=O)n2C)c(C)c1[N+](=O)[O-] 10539970 GOODJARDRDVXQY-UHFFFAOYSA-N 293.283 -0.146 5 20 CBBD O=C1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 31671835 DEUURODGRVEDKW-UHFFFAOYSA-N 265.225 -0.095 5 20 CBBD Cc1nnc(Sc2ncc([N+](=O)[O-])c(N)n2)n1N 76267598 HQWMFAFOAZLYSF-UHFFFAOYSA-N 268.262 -0.268 5 20 CBBD Cn1c(C(=O)NC[C@H](O)C(=O)O)ccc1[N+](=O)[O-] 90260790 JXEJLLYHIKYMMU-LURJTMIESA-N 257.202 -0.891 5 20 CBBD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC1CNC1 90289250 SYXWFELRZBGEIZ-UHFFFAOYSA-N 287.297 -0.147 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)CC(C)(CO)CO 269255567 CZRIAVZXZNUQPQ-UHFFFAOYSA-N 272.305 -0.286 5 20 CBBD NC(=O)Cn1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 339829509 RLPXIHWECPLBCY-UHFFFAOYSA-N 278.228 -0.143 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)CN 347706240 WROQFNJLLLPGHL-SSDOTTSWSA-N 255.278 -0.047 5 20 CBBD Cc1c(CC(=O)N[C@H](CO)C(N)=O)cccc1[N+](=O)[O-] 353001481 GIAPTFCHGBPLQB-SECBINFHSA-N 281.268 -0.592 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])cn2C)C1 547294433 ORPZCAQVPXIFJZ-LBPRGKRZSA-N 282.300 -0.270 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)O)c1 584132450 QMDBEGLGWKBLRW-UHFFFAOYSA-N 256.170 -0.372 5 20 CBBD C[C@@H](O)[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 595765589 JQRKEAHDYVJREI-ADEWGFFLSA-N 284.316 -0.003 5 20 CBBD O=C1CN(CCn2cc([N+](=O)[O-])cn2)CCCN1 746665763 FSHZJMUKLHYJHD-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD Cn1c(C(=O)OCC(=O)N2CCOCC2)ccc1[N+](=O)[O-] 761051056 VEHBYTIFIMKDBD-UHFFFAOYSA-N 297.267 -0.051 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 799949859 ZDNOKFKTYFBPNC-SECBINFHSA-N 274.302 -0.132 5 20 CBBD CC(C)[C@H](NC=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 860246604 XBQUCMNCMYRFTH-JTQLQIEISA-N 283.288 -0.322 5 20 CBBD NC(=O)CN1CCC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 918691073 FIEVFYYIJAUAJF-UHFFFAOYSA-N 295.299 -0.398 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@H]3CC[C@@H](C2)N3)c1 923293102 NHDWHUSITPDERI-NTZNESFSSA-N 295.343 -0.022 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N[C@H]1C[C@H](NC(=O)C(N)=O)C1 1059393746 HLBPHAHYASREII-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD CN(CCNC(=O)CC(N)=O)c1ncccc1[N+](=O)[O-] 1099971006 VQTYGKYVXZQVNJ-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)N(C)C 1116628286 JVOOXRPGNVUBHL-YFKPBYRVSA-N 255.234 -0.476 5 20 CBBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1nnnn1C 1120799820 SHXBWKTUNCGSGL-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD Cn1c(S)nnc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 1318334967 OGOXYCLYIXSIMJ-UHFFFAOYSA-N 297.300 -0.475 5 20 CBBD NC1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1574270304 CYKAIVMECGTIOL-UHFFFAOYSA-N 280.284 -0.294 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 44680507 DDZVDTCBGLCCGB-SSDOTTSWSA-N 269.261 -0.568 5 20 CBBD NCC(=O)NCC(=O)NCc1cccc([N+](=O)[O-])c1 52943228 GCJQPXXRAZSKER-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1 179069394 XOSMUAYPKKKCSA-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCNC1 179112615 SBMJKEZAXGJUPN-SECBINFHSA-N 280.284 -0.423 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](C)O[C@@H](CO)C1 187877225 PKFRAGCDVXSVIF-PSASIEDQSA-N 298.299 -0.292 5 20 CBBD COCCN(CCO)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 271830717 WWRQVRAGKYYIDB-UHFFFAOYSA-N 272.261 -0.293 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NCc1c([N+](=O)[O-])ncn1C 331274965 PXINDFVFSSVFCG-VXNVDRBHSA-N 267.289 -0.058 5 20 CBBD COCCN1CN(Cc2c([N+](=O)[O-])ncn2C)CC1=O 338347193 XEPKVJSCORKAKT-UHFFFAOYSA-N 283.288 -0.424 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN([C@H]2CCNC2)CC1 343690134 MPAFWABBOKDDGM-VIFPVBQESA-N 294.315 -0.562 5 20 CBBD COC(=O)[C@H]1C[C@@H](OC)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352959112 UOYLRMMTCFOWIN-HTRCEHHLSA-N 298.255 -0.280 5 20 CBBD CC(C)(C(=O)N[C@@H](CO)C(N)=O)c1ccccc1[N+](=O)[O-] 354205159 GOZJVPFQTOEEML-VIFPVBQESA-N 295.295 -0.165 5 20 CBBD CO[C@H](C)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 359771708 HPQFKNHXCCKDTG-ZCFIWIBFSA-N 255.230 -0.110 5 20 CBBD Nc1nc(=NC[C@@H]2CN3CCC[C@H]3CO2)[nH]cc1[N+](=O)[O-] 363571471 NXJCXCVIQKJLHY-DTWKUNHWSA-N 294.315 -0.336 5 20 CBBD Cc1nn(C)c(N2C[C@H](O)C[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 401777512 FIRLXTGQGOJMQX-HTQZYQBOSA-N 284.272 -0.091 5 20 CBBD CCO[C@@H]1C[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 515033902 AYHFWXBPTYZFRE-NKWVEPMBSA-N 255.234 -0.520 5 20 CBBD COC[C@H](O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 577744397 LSLAYBJYPZDCGN-SSDOTTSWSA-N 284.272 -0.301 5 20 CBBD CNC[C@@H](O)CNC[C@@H](O)COc1ccccc1[N+](=O)[O-] 584172813 GZBLCZJEXNWCDC-GHMZBOCLSA-N 299.327 -0.496 5 20 CBBD NC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593530791 MJFWMNHEIUPBRU-UHFFFAOYSA-N 274.258 -0.857 5 20 CBBD O=[N+]([O-])c1c(NCCn2ncnn2)ccnc1O 596159315 GKPOXQVUAPSPHE-UHFFFAOYSA-N 251.206 -0.206 5 20 CBBD C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839762579 SMSGCLMWHYFIJJ-IRCOFANPSA-N 283.328 -0.027 5 20 CBBD COC[C@H](OC)C(=O)OCCn1ccc([N+](=O)[O-])n1 850200925 LXUHJILMWOEDQK-QMMMGPOBSA-N 273.245 -0.004 5 20 CBBD COCCN1CCC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1072726039 YXABDRMLGRXJHY-GHMZBOCLSA-N 283.328 -0.168 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1599175750 WGHLDYZYAGUXFA-MRVPVSSYSA-N 269.213 -0.181 5 20 CBBD CC(C)(C(=O)OCC(N)=O)n1cc([N+](=O)[O-])cn1 102509445 ORVYEVHJWOOVKW-UHFFFAOYSA-N 256.218 -0.445 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)O1 268287386 CPSJPPHAKGIITE-FSPLSTOPSA-N 282.260 -0.588 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)C1CC1 271355412 WYGFFUMFIJLVLK-UHFFFAOYSA-N 252.230 -0.113 5 20 CBBD CN(CCO)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O 298208121 RAXWZSPTEIIIOH-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 343722552 MAKKSDZMFDVYNO-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD CNC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 352652261 MPMYPFKQBRCTGO-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD Cc1nc2n(n1)C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)CC2 352655392 QZZQIOBXPLFWJU-SSDOTTSWSA-N 291.271 -0.037 5 20 CBBD CN1CCC[C@@H]1CNC(=O)Cn1cnc([N+](=O)[O-])n1 353960101 MUQOHMCTLVAPCV-MRVPVSSYSA-N 268.277 -0.603 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H]2CCO)c1 426257373 VPZJLVZWIISJRA-ZYHUDNBSSA-N 284.316 -0.001 5 20 CBBD O=C1CCC[C@@H](CNc2ncc([N+](=O)[O-])cn2)N1 432941532 ZQOJXYZMHIXXSM-ZETCQYMHSA-N 251.246 0.465 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H]2CNC[C@@H]2C1 576871877 LVSHEJMYPSANAZ-KNVOCYPGSA-N 251.246 -0.391 5 20 CBBD O=C(NCC(=O)N1CC(O)C1)Nc1cccc([N+](=O)[O-])c1 598900329 KEXOFRBTHGMCHX-UHFFFAOYSA-N 294.267 -0.081 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839646043 HAFVGYFCKKVAHJ-IWSPIJDZSA-N 255.274 -0.365 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CN(C)CCN1C 896536098 VGPCPSHTCSGTNA-DBIOUOCHSA-N 270.333 -0.598 5 20 CBBD O=C(NCCNCc1ccccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932370 UWLJQNKCYZOSLN-GHMZBOCLSA-N 264.285 -0.047 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1n[nH]cc1[N+](=O)[O-] 1331883311 QGQSKEFDNXSILS-ZETCQYMHSA-N 269.261 -0.886 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN2C(=O)CC[C@@H]2C1 1338059854 LWTKLOVYTYHCDK-MRVPVSSYSA-N 280.288 -0.597 5 20 CBBD Cc1nn(CC(=O)N2CCC(C(N)=O)CC2)cc1[N+](=O)[O-] 1347794572 SNFSBTMJDYCSNC-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD Cc1cc(OCC(=O)N[C@H](CO)C(=O)O)ccc1[N+](=O)[O-] 1600287958 NYEWWGJKDHFQNH-SECBINFHSA-N 298.251 -0.156 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(=O)O 1606311824 SCRBGXSBWLZEEY-SECBINFHSA-N 283.240 -0.188 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](CF)C(=O)O 1608377049 KLNCQVVJJNHAJC-ZETCQYMHSA-N 287.203 -0.705 5 20 CBBD CN(CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccn(C)n1 1753853204 PCSOUNRGYBQZSG-VXGBXAGGSA-N 295.343 -0.025 5 20 CBBD Cn1nccc1CNC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1754514267 XEMXRAHVKOYDGA-GHMZBOCLSA-N 293.327 -0.176 5 20 CBBD O=C(CO)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 165999248 LYAVPSQVHNEHCL-UHFFFAOYSA-N 266.257 -0.369 5 20 CBBD Cc1nn(CCC(=O)NCC(=O)O)c(C)c1[N+](=O)[O-] 237780656 HVIMHYZCEHZKSJ-UHFFFAOYSA-N 270.245 -0.001 5 20 CBBD NCCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 237992027 OUAZVVXZZBLCAQ-UHFFFAOYSA-N 259.287 -0.027 5 20 CBBD C[C@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCO1 246650029 DBILEVYEHUGMJI-GXSJLCMTSA-N 270.289 -0.127 5 20 CBBD CN1CC[C@@H]2OCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])[C@@H]2C1 285642840 FLVBLHBFVKPUGN-ZJUUUORDSA-N 295.299 -0.137 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1 336850310 WUOHDBGSMQSRRV-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H](O)CC2)c1 339782175 WXKGXNOSZBQAGF-NEPJUHHUSA-N 284.316 -0.001 5 20 CBBD Cc1ccn(CC(=O)NC(N)=O)c(=O)c1[N+](=O)[O-] 349189625 HLHDSLBIBXQVOU-UHFFFAOYSA-N 254.202 -0.740 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 362413648 ZMISEHSXNUMKMB-LLVKDONJSA-N 298.255 -0.774 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@H](O)[C@@H](CO)C2)n1 396812939 QSYXDWXGYLHESU-XCBNKYQSSA-N 297.267 -0.133 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@H](CO)C1 494729090 PPOLZNQUCQBMTG-JTQLQIEISA-N 295.295 -0.013 5 20 CBBD CN1C(=O)CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1=O 551985628 FMYZJLUGFXGMAC-UHFFFAOYSA-N 294.223 -0.864 5 20 CBBD CCOC(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 553334512 QABZOFBNGMYQSF-UHFFFAOYSA-N 282.256 0.324 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1 562598195 YZBAYDJZPFERTN-ZCFIWIBFSA-N 281.272 -0.104 5 20 CBBD Nc1nccc(C(=O)N2CCC[C@@](O)(CO)C2)c1[N+](=O)[O-] 571059756 DPTBTSVLCGZETB-LBPRGKRZSA-N 296.283 -0.469 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC(=O)N1 574100749 YYVXSFLYRJIRQF-ZCFIWIBFSA-N 279.256 -0.468 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@@H]([C@@H](C)N)C1 592308957 PHBNDTVNNFTAOA-PSASIEDQSA-N 297.315 -0.326 5 20 CBBD O=C(NCC[C@]1(O)CCCOC1)c1cc([N+](=O)[O-])n[nH]1 593879324 FOEPQYZTFJNCRM-LLVKDONJSA-N 284.272 -0.021 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCCNC1=O 619867970 OVOSYOUGXZGNOP-QMMMGPOBSA-N 281.272 -0.566 5 20 CBBD O=C(Nn1c(O)nnc1O)c1cc(O)ccc1[N+](=O)[O-] 816731054 ZIKVFXQAQOKFRU-UHFFFAOYSA-N 281.184 -0.313 5 20 CBBD O=C(O)CNC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 821531118 GFDTYKRBPZZISY-UHFFFAOYSA-N 282.208 -0.048 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCOC(=O)C1CC1 846077187 JYZVUJWWICUEBZ-UHFFFAOYSA-N 283.244 -0.744 5 20 CBBD COC[C@H](CCO)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1326063899 JPYWUPYKYLEPMF-LURJTMIESA-N 258.234 -0.555 5 20 CBBD C[C@H]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C(=O)O1 1326800272 QBOGKYSGDLRLND-NJGYIYPDSA-N 254.202 -0.248 5 20 CBBD CN1CC[C@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C 1350999879 FQKHZQJXLNGVTI-ZETCQYMHSA-N 253.262 -0.238 5 20 CBBD COCC[C@@H]1CNCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1579010103 FJULKABAEGQSSU-SECBINFHSA-N 297.315 -0.221 5 20 CBBD O=C1CC2(CCNCC2)N(C(=O)c2ccc([N+](=O)[O-])[nH]2)N1 1580841094 VWCYHORXQHTYRU-UHFFFAOYSA-N 293.283 -0.078 5 20 CBBD O=C1N[C@H]2CN(CC[N+](=O)[O-])CC[C@@H]2N1C1CCNCC1 1580855352 SVURZNYOZNDMEY-RYUDHWBXSA-N 297.359 -0.517 5 20 CBBD C[C@H](O)[C@H](O)CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1589997626 SYHVZGFAJOUBFT-QUBYGPBYSA-N 294.271 -0.072 5 20 CBBD CN(CCNC(=O)c1cc([N+](=O)[O-])n[nH]1)CC(=O)O 1598493187 YKXDTJXWRWMNAG-UHFFFAOYSA-N 271.233 -0.936 5 20 CBBD O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC1CNC1 123833804 IZUSEIOERYOFFH-UHFFFAOYSA-N 275.261 -0.016 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])n1C 135513694 DLMJWPGJFZSJML-SECBINFHSA-N 297.267 -0.053 5 20 CBBD C[C@@H](C[S@@](C)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 182786354 KKTFPPCVGQUEPK-ULCDLSAGSA-N 274.302 -0.326 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@@H](O)C1 236561051 ZNPJPNXSHPOJHC-QWRGUYRKSA-N 266.253 -0.299 5 20 CBBD CS(=O)(=O)CCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 341799924 PROQHJCJYZDNGT-UHFFFAOYSA-N 275.290 -0.765 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@@H]2COC[C@H]2O)c1[N+](=O)[O-] 342448815 UDRVJXSEXFSNKC-HTQZYQBOSA-N 284.272 -0.532 5 20 CBBD CCNC(=O)CC(=O)NCCn1cc([N+](=O)[O-])cn1 357420235 CWGBFNKHVSSDQJ-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD C[C@H]1OCC[C@@H]1N(CCO)c1ncc([N+](=O)[O-])c(N)n1 360256608 HBIOOIDXMIOULD-SFYZADRCSA-N 283.288 -0.057 5 20 CBBD CC[C@@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(=O)NC 596260301 ILFVEBDSANDIPV-SSDOTTSWSA-N 253.262 0.509 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN(C)[C@@H]1CCNC1=O 602797360 VODZYXWRNJLIDI-SECBINFHSA-N 267.289 -0.080 5 20 CBBD CCOCC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 777054204 RPSFLMHFSDCSMM-UHFFFAOYSA-N 298.251 -0.095 5 20 CBBD CCn1nc(C)c(C(=O)OCCn2cnc([N+](=O)[O-])n2)n1 815972591 LQOXPLXKPOZYMF-UHFFFAOYSA-N 295.259 -0.037 5 20 CBBD NC(=O)[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840378245 CKYXTOAKPWOBBZ-FNCVBFRFSA-N 255.274 -0.188 5 20 CBBD O=C(N[C@H](CO)Cc1ccncc1)[C@@H]1C[C@H]1[N+](=O)[O-] 848374312 FSQYOVHYTZOELD-HBNTYKKESA-N 265.269 -0.234 5 20 CBBD O=C(CO)N1CCN(Cc2cccnc2[N+](=O)[O-])CC1 886087066 PHGJLKLEGOCYEB-UHFFFAOYSA-N 280.284 -0.374 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1csnn1 996592982 RVDCSSGGXXTCLK-HTRCEHHLSA-N 297.296 -0.856 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCN(CCO)CC2)C1 1050519930 MFXQLPNKKPOEFJ-GHMZBOCLSA-N 283.328 -0.432 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C(N)=O)C1 1115995334 PHBUIJXBFXARLR-ZETCQYMHSA-N 266.257 -0.119 5 20 CBBD O=[N+]([O-])c1ncn(Cc2nnnn2CC2CCOCC2)n1 1116797742 WRRBIWVBEMOOKZ-UHFFFAOYSA-N 294.275 -0.352 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](CN)C1 1118139017 ACMUBEKQDBSBMQ-SECBINFHSA-N 267.289 -0.093 5 20 CBBD O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 1258436956 LKGZXOGWAXDRMV-RXMQYKEDSA-N 274.258 -0.765 5 20 CBBD Cc1noc(CN2C[C@@H](CO)[C@H](CO)C2)c1[N+](=O)[O-] 1331628388 HPKXTJALJFRZJJ-IUCAKERBSA-N 271.273 -0.076 5 20 CBBD NC[C@]12CC[C@@H]1CCN2C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1580253441 MQUFHILZQSEPEJ-KGYLQXTDSA-N 295.343 -0.035 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2CC[C@](O)(C(=O)O)C2)n1 1608122443 BNLHIPDNXAPOFX-SECBINFHSA-N 256.218 -0.646 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](C)O 158930508 ULXGLZFSVCSDJK-SSDOTTSWSA-N 256.262 -0.013 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCOCC1 161691185 DCGZLPZPSSHERX-UHFFFAOYSA-N 267.241 -0.385 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H](O)CO)s1 272838354 MFWOUTYNWBMIOA-YFKPBYRVSA-N 296.326 -0.175 5 20 CBBD Cc1nnc(S)n1CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285725052 POVAJSGTUUWSKQ-UHFFFAOYSA-N 297.300 -0.063 5 20 CBBD CNC(=O)CN(C)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338639476 BZXGNDFKRMLSJP-UHFFFAOYSA-N 283.288 -0.269 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[S@@]1=O 352315451 VVGFTCHSUHPZLE-RLBGWGEZSA-N 286.313 -0.229 5 20 CBBD Nc1ncncc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354369358 AXNUJKLQHWGIPE-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD CN1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1 558350845 NONFCODNFWKCMR-VIFPVBQESA-N 264.241 -0.330 5 20 CBBD CO[C@@H](CN)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 568393332 SVOAPLAXLCRSLM-NSHDSACASA-N 280.284 -0.152 5 20 CBBD O=C1CC(C(=O)NCCNc2ccccc2[N+](=O)[O-])=NN1 731866246 UFUMIGOZGYBFNP-UHFFFAOYSA-N 291.267 -0.001 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCN1CCOCC1=O 785303844 ZWZXNYGEWFMPPW-UHFFFAOYSA-N 298.255 -0.807 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(N)=O 791252328 BEVIENVXSFBCMP-SNVBAGLBSA-N 296.283 -0.763 5 20 CBBD C[C@H](CO[C@@H]1CCOC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839701660 YONXEMAVWRAOQB-ZYUZMQFOSA-N 258.274 -0.038 5 20 CBBD Cn1cc(N2CC[C@@H](NCC[N+](=O)[O-])C2=O)cn1 905122829 DPTZNGYAPGBOHD-SECBINFHSA-N 253.262 -0.608 5 20 CBBD Cc1[nH]nc(C(=O)NCCn2cnnc2)c1[N+](=O)[O-] 1261744244 ZQGLYIITUABYKW-UHFFFAOYSA-N 265.233 -0.352 5 20 CBBD CN1CCN(c2nnc(CCC[N+](=O)[O-])n2C)CC1=O 1350549732 PFGJRANJBQKGKB-UHFFFAOYSA-N 282.304 -0.697 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])N1CCNC[C@H]1CO 1354593875 OXPMVBKHVGEVQH-NSHDSACASA-N 279.296 -0.070 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCNCC1 1580578861 PJOPKKKZAJSNJH-SECBINFHSA-N 282.304 -0.308 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC(NC3COC3)C2)n1 1602403489 HNDRMABRJROPMT-UHFFFAOYSA-N 294.267 -0.135 5 20 CBBD COCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 6119942 UPDXINQUGGSVQF-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD NC(=O)CN1CCC(Nc2ncc([N+](=O)[O-])cn2)CC1 40454784 UVADOOYIXCZYRE-UHFFFAOYSA-N 280.288 -0.254 5 20 CBBD CCN(CCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75714359 CZJCPWSKSWAYGE-SNVBAGLBSA-N 258.278 -0.534 5 20 CBBD Cn1c(C(=O)NC[C@@](C)(O)C(=O)O)ccc1[N+](=O)[O-] 90274769 SSUACEMUFRBCHW-SNVBAGLBSA-N 271.229 -0.501 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@H](O)C[C@@H]2CO)n1 185175823 LJWMXKDUIBZBJP-RKDXNWHRSA-N 256.262 -0.781 5 20 CBBD COCCN1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 264584181 UZEKMAHBWWVKOM-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD CCCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])[nH]n1 285135279 OVADGSRSPQZOLD-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD NC(=O)CCCNC(=O)CCn1cc([N+](=O)[O-])cn1 352892216 ITFDBIDGZWNWBL-UHFFFAOYSA-N 269.261 -0.437 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 358056212 ZWVNSVALGUWFPQ-LLVKDONJSA-N 268.273 -0.281 5 20 CBBD CCn1cc(S(=O)(=O)N2CCOCC2)c([N+](=O)[O-])n1 408407528 QTSAAXPLVNTSDU-UHFFFAOYSA-N 290.301 -0.168 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 547729696 CXZHXVSNAMDUSP-YFKPBYRVSA-N 268.229 -0.137 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCN1CCNCC1 572602467 RIXDBJWNZJCELO-UHFFFAOYSA-N 293.327 -0.188 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@H]2C[C@@H]21 590437250 WIJQZBLTUGQPKS-IUCAKERBSA-N 252.230 -0.209 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 592934650 ZJOSRKZUTXCLMO-BQBZGAKWSA-N 298.255 -0.686 5 20 CBBD O=C1NC[C@H]2CN(c3ccc([N+](=O)[O-])s3)CCN2C1=O 610864664 XDAHORDJYIMHPG-ZETCQYMHSA-N 296.308 -0.197 5 20 CBBD CCc1nc(COC(=O)Cn2cnc([N+](=O)[O-])n2)n[nH]1 754787222 CBPXTJVNKJDGAF-UHFFFAOYSA-N 281.232 -0.390 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)O1 808204761 PMHWODMBXCYJQR-BQBZGAKWSA-N 268.229 -0.389 5 20 CBBD CN(CCO)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 985435298 YMLJMKAFUXSEQQ-GHMZBOCLSA-N 271.317 -0.433 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H](c2nc[nH]n2)C1 1335582705 CJJIDNLSSJIWPN-MRVPVSSYSA-N 291.271 -0.075 5 20 CBBD O=C(N[C@@H]1CNC[C@H]1O)c1ccc([N+](=O)[O-])cn1 1580746921 WWJMGCUJZFXPOA-RKDXNWHRSA-N 252.230 -0.948 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN[C@]1(C(=O)O)CCOC1 1600749537 CKFMRLVRDHAPNK-LLVKDONJSA-N 284.272 -0.067 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCNCC2)c1 88061323 NTSZBLUWDVUDFK-JTQLQIEISA-N 255.278 -0.943 5 20 CBBD O=C(NCC(=O)N1CC(O)C1)c1cccc([N+](=O)[O-])c1 151968869 VTCNUTCNSKPXAU-UHFFFAOYSA-N 279.252 -0.472 5 20 CBBD C[C@@H](O)C(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 153023360 VQAICWAEPNWBHR-SNVBAGLBSA-N 297.315 -0.684 5 20 CBBD O=C1NC[C@H]2CN(CCn3ccc([N+](=O)[O-])n3)CCN12 175934960 KQGRXNXFZKRUKB-VIFPVBQESA-N 280.288 -0.499 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1OC 234569368 BSLOKDPWJDWZRL-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD C[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1CO 248910807 IXPSBSOCJWHIOH-USWWRNFRSA-N 284.316 -0.145 5 20 CBBD CCS(=O)(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 263769899 WIBNLUFAZJAWNY-UHFFFAOYSA-N 290.305 -0.682 5 20 CBBD O=[N+]([O-])c1ccn(CCN(CCO)CCCO)n1 267074723 LNLUKFMQJGFADO-UHFFFAOYSA-N 258.278 -0.532 5 20 CBBD O=C(CO)N1CCN(c2ncccc2[N+](=O)[O-])CC1 270348620 HBUIRSDXCQDUKN-UHFFFAOYSA-N 266.257 -0.369 5 20 CBBD COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)O1 282147578 BNTKJSKEBXOVNX-HTRCEHHLSA-N 297.271 -0.266 5 20 CBBD CC1(C)CNC(=O)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 282934756 YNVZKLQXWHNOEX-SNVBAGLBSA-N 297.315 -0.637 5 20 CBBD COCCOCCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 289888492 XCNRZCYIWZNKLJ-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD O=C(N[C@H](CO)C1CCOCC1)c1cc([N+](=O)[O-])n[nH]1 354617845 GPOFVGWTXYHEMN-SECBINFHSA-N 284.272 -0.165 5 20 CBBD C[C@H](CC(N)=O)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359034496 WVPOCGMPAZEDTD-ZCFIWIBFSA-N 267.245 -0.203 5 20 CBBD C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)S(N)(=O)=O 535071664 WJFHWLDLWLVYFB-ZCFIWIBFSA-N 288.285 -0.603 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1CCNCC1 581999720 DZEYHTWEBLEBNG-UHFFFAOYSA-N 252.230 -0.259 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@H]2C[C@H]21 590437247 WIJQZBLTUGQPKS-BDAKNGLRSA-N 252.230 -0.209 5 20 CBBD NC[C@H]1OCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 595956595 OFRRDKYSUXMRSQ-NXEZZACHSA-N 283.288 -0.729 5 20 CBBD CNS(=O)(=O)CCn1cccc([N+](=O)[O-])c1=O 598712020 WFWCUTZNPIXASF-UHFFFAOYSA-N 261.259 -0.694 5 20 CBBD COC[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])C(N)=O 760051382 ZWROOFHLPQOBQP-QMMMGPOBSA-N 285.231 -0.036 5 20 CBBD COC(=O)N(C)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 855942047 BOUCHKQGOZKQKT-UHFFFAOYSA-N 297.271 0.000 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2CCOC[C@H]2C1 893156329 CSEMDFIEKSHQGQ-SECBINFHSA-N 267.289 -0.151 5 20 CBBD NC(=O)CC(=O)NC/C=C\CNc1ncccc1[N+](=O)[O-] 1107087699 JIQOTNUCFQHZNN-UPHRSURJSA-N 293.283 -0.051 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCn3cnnc3C2)c1 1116326221 XSKRTSGQQMXQSY-UHFFFAOYSA-N 263.261 -0.101 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H](C)S(C)(=O)=O)c1[N+](=O)[O-] 1319685987 CMVWPTATXUIJEM-RXMQYKEDSA-N 290.301 -0.211 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1320414056 YYPDNUJMFNZGTG-IUCAKERBSA-N 298.299 -0.060 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(C)(C)C(N)=O 1320418105 OWNAUWFMMYFYOC-UHFFFAOYSA-N 269.261 -0.430 5 20 CBBD O=C(O)[C@@H]1[C@H]2CN(C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]21 1610803986 VZAXCJBXVLFWKL-ZNSHCXBVSA-N 296.283 -0.585 5 20 CBBD NC(=O)NC(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1 6121844 DWZJFQVVGSCDIB-UHFFFAOYSA-N 282.212 -0.471 5 20 CBBD NCC(=O)NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 124516037 OTWLELAHFGBXLI-UHFFFAOYSA-N 278.268 -0.441 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 131454845 ZVOOBKMAZYOCOE-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD Cc1cccc(C(=O)NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 227871233 GQLWOTJMJSANNA-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](O)C(N)=O)n1 228771801 PRUYVIFGFFTNGN-ZETCQYMHSA-N 284.228 -0.966 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1F 234568346 KXQCLZBXTYKQHV-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD CNC(=O)CCCNc1ncc([N+](=O)[O-])c(N)n1 263957049 MNVXMYRKGAGUDT-UHFFFAOYSA-N 254.250 -0.095 5 20 CBBD NC(=O)[C@H]1CCN(c2nccc(C(=O)O)c2[N+](=O)[O-])C1 312658391 LWWLYEGWEHTPLL-LURJTMIESA-N 280.240 0.000 5 20 CBBD Cn1nnnc1N1CCN(c2ncccc2[N+](=O)[O-])CC1 364101794 MHEPOKWEYZNMEA-UHFFFAOYSA-N 290.287 -0.160 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)CCN)c([N+](=O)[O-])n1 447255340 JIFFSMXITUFWJN-ZETCQYMHSA-N 291.333 -0.173 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1[C@@H]2CNC[C@@H]21 495120304 NCSOXFNXGZYWAR-GDGBQDQQSA-N 278.268 -0.910 5 20 CBBD O=C(NC[C@@]1(O)CN2CCC1CC2)c1cc([N+](=O)[O-])n[nH]1 563820644 XUEKIHUMDBTGBA-GFCCVEGCSA-N 295.299 -0.496 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 600460516 VFQCNFNDOZJPPI-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD O=C1NC(=O)N2CCN(c3ncc([N+](=O)[O-])s3)C[C@@H]12 619697305 LXEIBVPIHPQFEJ-YFKPBYRVSA-N 283.269 -0.208 5 20 CBBD CC[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 726998485 VRJKTDFFUAHWHF-LURJTMIESA-N 256.218 -0.402 5 20 CBBD O=C(Nn1cnnc1O)c1cc(O)cc([N+](=O)[O-])c1 782123859 HHVVPVDZXKMYDB-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD C=CC(=O)NCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 791358915 ISBZHPKVOVDNGO-UHFFFAOYSA-N 279.256 -0.396 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)O[C@H]1CNOC1 808092754 YAUVYYFNKKZGGV-QMMMGPOBSA-N 269.213 -0.797 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC[C@@H]1CCNC1=O 813921201 AORPZUHBBMQLIH-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@](F)(C(=O)O)C1 833122595 OYVMXXNXPNCUGL-SECBINFHSA-N 287.207 -0.789 5 20 CBBD COc1cc([N+](=O)[O-])cnc1N1CCNC(=O)C1 891473238 XTJJVOTZGRIJQP-UHFFFAOYSA-N 252.230 -0.065 5 20 CBBD CN(Cc1nc[nH]n1)S(=O)(=O)c1cccnc1[N+](=O)[O-] 1257242090 SLNYTHCDCDQDSO-UHFFFAOYSA-N 298.284 -0.071 5 20 CBBD Nc1nccc(C(=O)N2CCn3cnnc3C2)c1[N+](=O)[O-] 1326771124 KJKGXKZLTSODNV-UHFFFAOYSA-N 289.255 -0.181 5 20 CBBD CCc1nn(C)c(N2CCO[C@H](C(N)=O)C2)c1[N+](=O)[O-] 92829386 TVBWGRDVUJNPBA-QMMMGPOBSA-N 283.288 -0.419 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1OC 164897903 YPDWKGKUKFYJMD-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1 175452656 VTGBWMYUHVAJHO-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD Nc1nc(NCCCS(N)(=O)=O)ncc1[N+](=O)[O-] 263932532 BCNVNTCWSQCWNB-UHFFFAOYSA-N 276.278 -0.943 5 20 CBBD CN1CC[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)C1=O 266939009 PIDXJVXYDMQWLE-JTQLQIEISA-N 267.289 -0.046 5 20 CBBD Cc1nc(NC(=O)Cn2cc([N+](=O)[O-])cn2)nn1C 344539224 AZQGRTMZOZJTGU-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 360607693 OOHPZSCHYJYWJH-ZETCQYMHSA-N 271.229 -0.423 5 20 CBBD CCC1(O)CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 568532702 JSQYKMDDLAVYHO-UHFFFAOYSA-N 266.257 0.169 5 20 CBBD COCCN(CC(=O)N(C)C)C(=O)c1c[nH]nc1[N+](=O)[O-] 570346212 FFGCSMHLNXUROG-UHFFFAOYSA-N 299.287 -0.505 5 20 CBBD Nc1ccc(NCC2(CO)COC2)nc1[N+](=O)[O-] 596169986 NDVKTJJLBPEOBC-UHFFFAOYSA-N 254.246 -0.007 5 20 CBBD C[C@H](O)C1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 598383193 BRKGVCWOVLKBKJ-QMMMGPOBSA-N 281.268 -0.214 5 20 CBBD Cn1nc2c(c1N)CN(c1ncc([N+](=O)[O-])c(N)n1)C2 598630611 GDSSCBZFPCLWEZ-UHFFFAOYSA-N 276.260 -0.197 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)C[C@H]1CO 698230035 TYHYYXVSIGGSHS-IUCAKERBSA-N 281.268 -0.255 5 20 CBBD Nc1nccc(C(=O)OCCN2CCNC2=O)c1[N+](=O)[O-] 848791119 USVOOYCUDMJLTO-UHFFFAOYSA-N 295.255 -0.246 5 20 CBBD O=C(NC1CN(Cc2cnns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293562 OEGXNBHXWBXGSM-RKDXNWHRSA-N 283.313 -0.496 5 20 CBBD CCCC(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1041177750 OABQQCSUSBYECY-RKDXNWHRSA-N 285.300 -0.859 5 20 CBBD NC(=O)C(=O)N1CCCN(c2ccc([N+](=O)[O-])cn2)CC1 1057222286 KQAWNNTZZXLWSW-UHFFFAOYSA-N 293.283 -0.486 5 20 CBBD O=C(O)CC1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1117948508 VSBYIFHFSXIJEN-UHFFFAOYSA-N 297.271 -0.100 5 20 CBBD O=C(NCc1nnc2n1CCC2)c1n[nH]cc1[N+](=O)[O-] 1253811732 LYDWUZVGBWEZHQ-UHFFFAOYSA-N 277.244 -0.214 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](CO)[C@@H](O)C1 1320788534 OQOGTDNAPDCTDW-UWVGGRQHSA-N 298.299 -0.699 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](CC(=O)O)C2)n1 1321168696 ASWRESQTMDKKQB-ZETCQYMHSA-N 298.255 -0.356 5 20 CBBD CCNC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1331222922 QWJDRXCDHMGBFF-UHFFFAOYSA-N 255.234 -0.806 5 20 CBBD CNCCN(C)C(=O)Cn1c([N+](=O)[O-])cnc1C 1357443615 KBEFYGNIWGEXDL-UHFFFAOYSA-N 255.278 -0.222 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)N1CCCC1 1592938035 XTAZJIHBCXPMSZ-UHFFFAOYSA-N 292.259 -0.406 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@H]1CCS(=O)(=O)C1 35121755 PKQKLSVLXJDCKV-LURJTMIESA-N 260.275 -0.073 5 20 CBBD CCN(CC(=O)OC)C(=O)Cn1cc([N+](=O)[O-])cn1 42299651 JUPWEQKGIVBJAU-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NCc1nnn[nH]1 44927452 UMITZBDJMCEFJJ-UHFFFAOYSA-N 278.228 -0.197 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@@H]1C(N)=O 68422128 LNYRZNPKQFRPEH-SECBINFHSA-N 295.299 -0.034 5 20 CBBD COC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 71267824 AFFFFWCSMYCZET-SSDOTTSWSA-N 257.246 -0.330 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 122022207 ZHVBHTITDNHQDH-UHFFFAOYSA-N 269.261 -0.086 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](CN)C1 124292496 WUPMWRWTDSUVJH-SECBINFHSA-N 281.316 -0.352 5 20 CBBD CNC(=O)CCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 155337322 CJNOIQVWKTUQSC-LLVKDONJSA-N 299.331 -0.390 5 20 CBBD Cn1ncnc1NC(=O)c1cc([N+](=O)[O-])cnc1N 227887930 STHRPLVVKZFOAW-UHFFFAOYSA-N 263.217 -0.047 5 20 CBBD CC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 271266222 IMXWFAQFGFGOHN-MRVPVSSYSA-N 269.257 -0.356 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1CCNC(=O)C1 272756288 FJZXZRQBLSPLLV-UHFFFAOYSA-N 268.277 -0.828 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H](C)O 274520401 SDFACWXUOQKARI-QUBYGPBYSA-N 297.267 -0.171 5 20 CBBD COCCN(CCO)C(=O)c1cc([N+](=O)[O-])[nH]n1 285492328 ALKPWOWGLIMMHV-UHFFFAOYSA-N 258.234 -0.601 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)CO 292098708 GDUIZOIPEKVSIF-MWLCHTKSSA-N 272.305 -0.145 5 20 CBBD Cn1ncc(CCCNC(=O)c2cc([N+](=O)[O-])[nH]n2)n1 293831664 GKWUMVCVCGROSV-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@@H]1O 342382022 QAXZXPMZXOCSAX-UWVGGRQHSA-N 284.272 -0.601 5 20 CBBD O=C(O)[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 342557987 DZPVOXKSUVCBRM-ZCFIWIBFSA-N 269.217 -0.738 5 20 CBBD C[C@H]1CN(C)CCN1c1ncc([N+](=O)[O-])c(N)n1 344420237 GDPHXJUPQRMLNM-ZETCQYMHSA-N 252.278 0.107 5 20 CBBD CN1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C(=O)N1 349691958 IOIGHPDCLWLJEJ-SNVBAGLBSA-N 278.268 -0.401 5 20 CBBD O=C(NCCN1C(=O)CCC1=O)c1cc([N+](=O)[O-])c[nH]1 356407466 PZAZVDNNVYTBMT-UHFFFAOYSA-N 280.240 -0.198 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cn1C 394117804 KZXWTDAHCBARJP-SNVBAGLBSA-N 281.316 -0.433 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCN1CCCC1=O 405383639 IJMZNRCGOWDZGW-UHFFFAOYSA-N 293.283 -0.076 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 447741550 NFXJRXRZJRAWRP-RDDDGLTNSA-N 284.272 -0.402 5 20 CBBD CN(C)C1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 541309550 JYYLBTBBDAJVSA-UHFFFAOYSA-N 286.313 -0.076 5 20 CBBD CO[C@H]1CS(=O)(=O)C[C@@H]1N=c1cc[nH]cc1[N+](=O)[O-] 596434129 JCQOPZUXKCLMRF-WPRPVWTQSA-N 287.297 -0.364 5 20 CBBD C[C@@H]1[C@@H](N(C)C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 597696618 CYEZUDXRMKTGRO-BDAKNGLRSA-N 282.304 -0.263 5 20 CBBD CCC(=O)N[C@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 610874679 MRWUKBMGIZMTNR-MRVPVSSYSA-N 283.288 -0.178 5 20 CBBD CN1CCN(CCNc2c([N+](=O)[O-])cnn2C)CC1 891620104 OMVIESDTISOOHZ-UHFFFAOYSA-N 268.321 -0.012 5 20 CBBD Cc1ncc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1126936439 HXGYJVQNZWNJSA-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 1261494991 MUZGEULUIKTVGE-SFYZADRCSA-N 268.277 -0.557 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N(CCO)CC1CC1 1322271756 QKAJSGMRDQYSEK-UHFFFAOYSA-N 295.295 -0.013 5 20 CBBD C[S@](=O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 1330033874 CRYNQVQYSUMJOK-SFHVURJKSA-N 272.286 -0.121 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)[C@@H](CO)C1 1333037344 DVUPXRHSSSKBAG-LLVKDONJSA-N 269.305 -0.600 5 20 CBBD CCN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H](C)CO 1344018526 WWGVPLFAXMNZKM-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD O=C(O)C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 1601907788 XXCPNBAZNGSFRV-MNOVXSKESA-N 298.299 -0.005 5 20 CBBD NC(=O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 18188091 KKAQVSSRMTXGPE-UHFFFAOYSA-N 253.214 -0.425 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 103950220 FNVZANLUGUGQLW-NSHDSACASA-N 295.299 -0.226 5 20 CBBD CN(CC(N)=O)c1nc(C(=O)O)ccc1[N+](=O)[O-] 166674087 YPLOFOPHVXUOSN-UHFFFAOYSA-N 254.202 -0.391 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 281860096 QROZKXSZCFPTPL-YFKPBYRVSA-N 256.218 -0.049 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1NC(=O)NC(CO)(CO)CO 296712081 IUAMSIQXFOGDIZ-UHFFFAOYSA-N 299.283 -0.260 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)NC[C@H]2C1 332230880 MANOANLSIXJBHJ-QMMMGPOBSA-N 294.271 -0.973 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 344443075 AHDGRBDIRJLALB-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD COC(=O)[C@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357434678 CFZIBKPYAJJTHR-LLVKDONJSA-N 298.255 -0.575 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)C(N)=O 540947981 WUJSOGSFPSNVLC-LURJTMIESA-N 295.251 -0.030 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(C)C[C@H]2CN)c1[N+](=O)[O-] 564944268 KGIAHMSYNVMFOT-SECBINFHSA-N 296.331 -0.648 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H]1O 578082493 RROURFXOSUNANM-CBAPKCEASA-N 283.288 -0.925 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H](CCO)C(F)F)c1 578651923 PSGNGLYKWNIPGG-IUCAKERBSA-N 294.258 -0.242 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619788143 HVJMNKLOUOVJMV-LURJTMIESA-N 267.245 -0.332 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)C1CC1 771028079 FMJWBGVVBYRBGH-SECBINFHSA-N 254.246 -0.322 5 20 CBBD Cn1ncc2c(N3CCN(CC[N+](=O)[O-])CC3)ncnc21 791054357 UDVUPSPGTDBXMT-UHFFFAOYSA-N 291.315 -0.238 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC/C=C\C(=O)O)n1 863407070 DQPUKXRTMYVDKL-IHWYPQMZSA-N 290.257 -0.753 5 20 CBBD O=C1CC[C@@H](COC(=O)Cn2cnc([N+](=O)[O-])n2)N1 1261506711 BJZJAJANBMRUBJ-LURJTMIESA-N 269.217 -0.992 5 20 CBBD CNC[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1261645826 PNCWQHABSWRIAB-ZCFIWIBFSA-N 255.278 -0.026 5 20 CBBD Cc1noc(CN(C)CCNS(C)(=O)=O)c1[N+](=O)[O-] 1327511644 JMZWFMVPBBTGQF-UHFFFAOYSA-N 292.317 -0.128 5 20 CBBD CN1CC[C@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1 1591179333 JOSHKUBJBSCQAB-ZETCQYMHSA-N 278.276 -0.077 5 20 CBBD O=C(O)[C@@H]1CC[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)O1 1602178091 IXAZPWAEWGVKNZ-JGVFFNPUSA-N 299.239 -0.033 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](O)C[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 1610404466 UCDJFPGXARPCRH-RQJHMYQMSA-N 298.255 -0.466 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H]2CCOC2)c1 38094674 PVIODNXTGGEGMR-KOLCDFICSA-N 270.289 -0.222 5 20 CBBD COCCOCCCNC(=O)Cn1ccc([N+](=O)[O-])n1 49087706 SCDKLYZTUZCKAM-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD CC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 50469680 AGMSVNAWJNEHLT-LURJTMIESA-N 256.218 -0.229 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NC(CO)CO)c1 88147621 LBUYRDPAEBXAKM-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCNC(=O)C1 120495004 CXTVAYNBSMBDLW-UHFFFAOYSA-N 267.245 -0.942 5 20 CBBD NC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 165599059 HOVZBSGWFBRDBU-SSDOTTSWSA-N 255.230 -0.013 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])cn1)[C@@H](C)C(N)=O 174851694 RZSQDZPFDQGBGZ-VIFPVBQESA-N 285.304 -0.387 5 20 CBBD CNC(=O)c1ccc(NC[C@@H](O)C(N)=O)c([N+](=O)[O-])c1 227830668 PFBUIEGSMHWHQD-SECBINFHSA-N 282.256 -0.788 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCNC1CC1 238142763 NFMIDFYNTSZFOA-UHFFFAOYSA-N 280.284 -0.375 5 20 CBBD CN(C)C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 270872719 WLYMQOHJOGTGPR-UHFFFAOYSA-N 253.262 -0.436 5 20 CBBD C[C@H]1OCCN(CCn2cc([N+](=O)[O-])cn2)[C@@H]1C(N)=O 284603116 BTWUFMFEKPSLPX-SCZZXKLOSA-N 283.288 -0.634 5 20 CBBD CNC(=O)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 285202475 LLEHCOGKAPYKKB-UHFFFAOYSA-N 292.295 -0.011 5 20 CBBD N[C@@H]1CCC[C@@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@H]21 342763782 YVOSJJLIJYIDJQ-OPRDCNLKSA-N 294.315 -0.228 5 20 CBBD Cc1nn(Cc2nc(=N)[nH]c(=N)[nH]2)cc1[N+](=O)[O-] 354933216 ZHGKYVKXOSYNCV-UHFFFAOYSA-N 250.222 -0.842 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1ccc([N+](=O)[O-])n1C 357250177 AEEWGZYITPNOSR-UHFFFAOYSA-N 285.300 -0.004 5 20 CBBD O=C(NCCn1ncnn1)c1ccc([N+](=O)[O-])o1 433976972 QFZXDQATTPTKKF-UHFFFAOYSA-N 252.190 -0.396 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CCNC1=O 535497155 SZIMNVAWHFDAEC-QMMMGPOBSA-N 266.257 -0.106 5 20 CBBD CC(CO)(CO)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 578874695 CYSHAAPUPHNBST-UHFFFAOYSA-N 258.234 -0.961 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC(N2CC[C@@H](O)C2)C1 593856470 XWCGMSXJQQMVIA-SECBINFHSA-N 280.284 -0.186 5 20 CBBD CN(Cc1nnc(O)o1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 595547007 KZVCOMYKXPMOFB-MRVPVSSYSA-N 298.259 -0.627 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cnnn1 807920080 CKLKGDQSXGEIPS-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccns1 992894551 OFWLCZLHPKSTAL-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD Cn1cncc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1119106994 DMFMDFPMXVLRON-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NN1CCCNC1=O 1254500717 HRKGFSBJIGRIKU-UHFFFAOYSA-N 268.233 -0.612 5 20 CBBD CC1=NO[C@@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261744190 XZEZUGOHAXTBMJ-SSDOTTSWSA-N 268.233 -0.533 5 20 CBBD O=C(Nc1cc(-c2nn[nH]n2)ccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1582633356 APDFFXHSQHWCGB-RNFRBKRXSA-N 275.228 -0.135 5 20 CBBD COC[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 1599176214 ZDVRNMZMYDQSDV-RXMQYKEDSA-N 272.217 -0.842 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H](O)C1 48439775 UBIQYUAKYTYGGY-QMMMGPOBSA-N 254.246 -0.225 5 20 CBBD Nc1nc(NCCNC(=O)C2CC2)ncc1[N+](=O)[O-] 76267226 QSWNINSPFGXKPL-UHFFFAOYSA-N 266.261 -0.095 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1c[nH]cn1 88753543 CKLNOCUDYKHDJI-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD NC[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 178271452 GBRCWCYWRMORIG-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1c1ncc([N+](=O)[O-])c(N)n1 265837306 ROHHGCUJMQNKSM-LURJTMIESA-N 287.301 -0.410 5 20 CBBD CC(C)[C@@H](O)C(=O)NCCn1cc([N+](=O)[O-])cn1 285700149 HQHQQQOHLVDOCC-SECBINFHSA-N 256.262 -0.076 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](O)[C@@H](O)C1 331293922 LZCSATPJZCDXDI-RYUDHWBXSA-N 295.295 -0.121 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)N1CCCC1 337153450 SZCLXKLLZSWXMI-SECBINFHSA-N 295.299 -0.082 5 20 CBBD C[C@H](NC(N)=O)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 340347880 YHULNIAVNUQCDR-YFKPBYRVSA-N 292.255 0.466 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCCC1 356506201 JIPDZQUZZKTGFC-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD CNc1nccc(C(=O)N2CCNC(=O)[C@H]2C)c1[N+](=O)[O-] 584664084 VVDWASFADMVAOS-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@@H]1O 594334604 DEYSARYADLQBBS-SVRRBLITSA-N 266.257 0.025 5 20 CBBD CNC(=O)C1(C(=O)OCCn2cc([N+](=O)[O-])cn2)CC1 748125554 RUNFFLXEBFDHCL-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)NC(=O)NC)n1 755567577 FFUBJHRJPXRXHE-UHFFFAOYSA-N 299.243 -0.576 5 20 CBBD Cc1nn(C)c(C(=O)N2CCOC[C@H]2C(=O)O)c1[N+](=O)[O-] 833012925 KMXRYJMGQCEERB-ZETCQYMHSA-N 298.255 -0.438 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1COCO1 861967806 KFKCUMIFKXSKCO-VIFPVBQESA-N 270.245 -0.330 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(N2CCCC2=O)C1 888748600 BOPXOEKVSUFECO-RKDXNWHRSA-N 253.258 -0.515 5 20 CBBD CN1C[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 1122870185 DZNSSBTWKUBSIL-SECBINFHSA-N 282.256 -0.045 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCc2nn[nH]c2C1 1321436036 ASXWURKJPXNOBX-UHFFFAOYSA-N 277.244 -0.506 5 20 CBBD COC[C@H]1C[C@@H](O)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1326505889 MXXWOBVMZSYUHT-HTQZYQBOSA-N 296.283 -0.325 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC/C=C/CO 1330920817 FYJKCBMDACKPGK-OWOJBTEDSA-N 267.241 -0.579 5 20 CBBD Cn1cnc(CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)n1 1341553433 LZJOJFOUHJHESE-UHFFFAOYSA-N 293.287 -0.029 5 20 CBBD O=C1OCC[C@H]1n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1582789421 NOYSTFADJUAMPD-SCSAIBSYSA-N 265.189 -0.541 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CCF)C(=O)O 1608376596 BENLSJKWYOOQTQ-ZETCQYMHSA-N 274.208 -0.280 5 20 CBBD CNc1ccc(C(=O)N[C@H](CO)C(=O)OC)cc1[N+](=O)[O-] 8138354 DDHGHBCAYQRVAB-SECBINFHSA-N 297.267 -0.100 5 20 CBBD NC(=O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 70243601 UKHLQJAHGDFIDT-UHFFFAOYSA-N 259.243 -0.642 5 20 CBBD O=C(NCCOCCO)C(=O)Nc1cccc([N+](=O)[O-])c1 170358307 SEJUXBNCYWZHBI-UHFFFAOYSA-N 297.267 -0.342 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(C[C@H](C)O)c1=O 193085808 KVWABZSHPJEPIR-LURJTMIESA-N 256.214 -0.076 5 20 CBBD CC(C)CS(=O)(=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 194591340 KZZLEHDVIHMIJR-UHFFFAOYSA-N 290.301 -0.107 5 20 CBBD O=c1[nH]cnc2cc(N3C[C@H](O)[C@@H](O)C3)c([N+](=O)[O-])cc12 236555674 SDKCEAZUTHGKRK-QWRGUYRKSA-N 292.251 -0.627 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@](F)(C(=O)O)C1 262211334 SDCMEZGKMSHLPV-SNVBAGLBSA-N 286.219 -0.184 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CC1=O 263819196 TYEGILYICMJAOD-ZCFIWIBFSA-N 280.240 -0.344 5 20 CBBD COCC(=O)NC1CN(c2c([N+](=O)[O-])c(C)nn2C)C1 274732062 LXJPNFVDJLDQEC-UHFFFAOYSA-N 283.288 -0.412 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@]1(CCO)CCOC1 278111570 PMAFXIXTHOZHNH-GFCCVEGCSA-N 298.299 -0.161 5 20 CBBD CC(CO)(CO)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N 283274796 VWAVPOWDGZYGSI-UHFFFAOYSA-N 287.247 -0.211 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H](O)C2CCC2)c1 315851268 FVTVKSQFKCWZQZ-NWDGAFQWSA-N 284.316 -0.097 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@@H](O)C1 330460680 KPEDWXOEANRSLZ-SECBINFHSA-N 267.241 -0.650 5 20 CBBD C[C@@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CCN1CCO 331120248 AOPWUHCJRVHMNN-SNVBAGLBSA-N 283.332 -0.173 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(O)(C2CC2)C1 357062185 WKIGYCINFPPPBE-UHFFFAOYSA-N 266.257 -0.075 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 360607692 OOHPZSCHYJYWJH-SSDOTTSWSA-N 271.229 -0.423 5 20 CBBD O=C(COC[C@@H]1CCOC1)NCCn1cc([N+](=O)[O-])cn1 492960913 MRPAVLMPTWYNNZ-SNVBAGLBSA-N 298.299 -0.039 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](C)[C@@H](O)C2)c1[N+](=O)[O-] 594335936 YUMFRHCMFRPIRS-CBAPKCEASA-N 280.284 0.484 5 20 CBBD CNc1nccc(C(=O)N2CCO[C@@H](OC)C2)c1[N+](=O)[O-] 597541037 QEUQTLKREQXWTJ-SECBINFHSA-N 296.283 0.476 5 20 CBBD O=C1C[C@@H](C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)N1 597575332 OCPJENHHSLBDLS-VIFPVBQESA-N 293.283 -0.157 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](O)[C@@H](O)C1 600217398 XOFBJTXTLMOYOI-IUCAKERBSA-N 267.241 -0.645 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cn1)c1nc[nH]n1 1093793304 MUUHPEKKCUPGPF-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCCNC1 1118082271 WPMHQEMJZUVOSV-DTWKUNHWSA-N 282.304 -0.309 5 20 CBBD CCN1C[C@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1326893860 QCOPUHSTWKISGJ-QMMMGPOBSA-N 295.299 -0.074 5 20 CBBD NC[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 1328243615 PFPSSKQOFIGXQN-ZCFIWIBFSA-N 255.234 -0.882 5 20 CBBD CS(C)(=O)=NC(=O)Cn1cc([N+](=O)[O-])c(C(=O)O)n1 1599779043 DRPLPNGWVRJILN-UHFFFAOYSA-N 290.257 -0.256 5 20 CBBD Cc1nc(NC(=O)Cn2cnnn2)ccc1[N+](=O)[O-] 133759025 OZGUTFBOCOALHT-UHFFFAOYSA-N 263.217 -0.077 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)C(=O)C1 152858728 ITZKAPSGBNOJGA-UHFFFAOYSA-N 281.272 -0.600 5 20 CBBD CO[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 189181981 RJSSCRRWPVUAPM-MRVPVSSYSA-N 269.257 -0.092 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC[C@H]1CCNC1 262598097 WAGRWRYGPGAUQX-SECBINFHSA-N 267.289 -0.093 5 20 CBBD O=C(N[C@@H](CO)CN1CCCCC1)c1cc([N+](=O)[O-])[nH]n1 298619436 OZYSNRWXXVQCCL-SECBINFHSA-N 297.315 -0.106 5 20 CBBD Nc1nc(NCCNC(=O)c2ccn[nH]2)ncc1[N+](=O)[O-] 302012856 DESZFIJBNOGYKR-UHFFFAOYSA-N 292.259 -0.468 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1COC[C@@H]1O 342456610 NTFISLIVDXPFPQ-IUCAKERBSA-N 269.257 -0.235 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC2[C@@H]3CNC[C@@H]23)n1 592338427 SQDBQYGAKVMTAO-RNFRBKRXSA-N 265.273 -0.241 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 594330628 FWBYSKLSUYKGAT-JGVFFNPUSA-N 296.283 -0.401 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)C1(O)CNC1 595924529 FQEPZCSUNFYUGH-UHFFFAOYSA-N 251.242 -0.455 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H](C(=O)O)C1CCC1 596003607 SXSVFAIQBQIIMF-MRVPVSSYSA-N 297.271 -0.197 5 20 CBBD Nc1nc(N2C[C@@H]3CNC[C@@H]3C2)ncc1[N+](=O)[O-] 609075043 MWSUZMIZTRGYGX-KNVOCYPGSA-N 250.262 -0.377 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 844114812 LGQZKGNXFFNEKK-RBXMUDONSA-N 272.257 -0.966 5 20 CBBD Cn1cc(S(=O)(=O)NC(=O)c2ccc([N+](=O)[O-])[nH]2)cn1 916823410 CDJAAGVPTJKLJE-UHFFFAOYSA-N 299.268 -0.225 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@@H]1COC(=O)N1 1122970612 GHPWQNNABRPRKJ-SSDOTTSWSA-N 284.228 -0.167 5 20 CBBD Cc1[nH]nc(C(=O)NCCOCCO)c1[N+](=O)[O-] 1319335797 INRVUMFMZGALRQ-UHFFFAOYSA-N 258.234 -0.635 5 20 CBBD CN(C[C@H]1COCCO1)c1nnc(CCC[N+](=O)[O-])n1C 1338166327 IODKUDRVDAHNBY-JTQLQIEISA-N 299.331 -0.124 5 20 CBBD Cc1nn(CC(=O)N2CCNCC2)cc1[N+](=O)[O-] 1345780214 BNAAMRNNJIXUDW-UHFFFAOYSA-N 253.262 -0.468 5 20 CBBD O=C(O)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 37589108 SOUJVUSCFGWDRK-UHFFFAOYSA-N 268.229 -0.133 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCNC(=O)C1CC1 48168768 KKGOKSYIKXIQFL-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD COCCOC1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 80373063 ZLTWNBVIJRESMZ-UHFFFAOYSA-N 298.299 -0.026 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NCC1(CO)CC1 162124332 VOTPPQWGKJYOQP-UHFFFAOYSA-N 283.288 -0.137 5 20 CBBD CN(C)C(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])cn1 180647274 RMGBVHQJNQCXHZ-UHFFFAOYSA-N 284.276 -0.821 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCCNCC1 238142586 WDMWSSWPVVNHOD-UHFFFAOYSA-N 280.284 -0.422 5 20 CBBD O=C(NC[C@H]1CC[C@@H](CO)O1)c1cc([N+](=O)[O-])cnc1O 293673230 MOWUAGHIJPWWDY-BDAKNGLRSA-N 297.267 -0.035 5 20 CBBD CCN(CCOCCO)C(=O)c1cc([N+](=O)[O-])nn1C 337590092 MLVXQOAKICNIPW-UHFFFAOYSA-N 286.288 -0.201 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CN2CCN1CC2 347371096 IBOVYCWGYJSDEL-VIFPVBQESA-N 294.315 -0.942 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)OC 347876259 CGEDASGSYZYRBK-QMMMGPOBSA-N 271.229 -0.159 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCn1cccn1 356472501 BFXMVLJPZOJYAZ-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD O=C(NC[C@@H]1CC[C@@H](CO)O1)c1cc([N+](=O)[O-])cnc1O 356548892 MOWUAGHIJPWWDY-IUCAKERBSA-N 297.267 -0.035 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 358373560 CWNBXYXJJCCZGB-NSHDSACASA-N 285.256 -0.033 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 412429639 VKDIZTONJSVWQL-HTRCEHHLSA-N 270.241 -0.228 5 20 CBBD COCCN(CCN(C)C)C(=O)c1c[nH]nc1[N+](=O)[O-] 547763499 RDVJDDKYQBGMTB-UHFFFAOYSA-N 285.304 -0.032 5 20 CBBD CN1C(=O)CN(C(=O)c2cccc([N+](=O)[O-])c2O)CC1=O 550160752 XCHXKKWKQWPXOQ-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD CNC(=O)C1CN(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C1 563547634 MXECJPCODJTITK-UHFFFAOYSA-N 293.283 -0.151 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 567890214 BNEHRRPWNZSEQS-MRVPVSSYSA-N 294.267 -0.190 5 20 CBBD O=[N+]([O-])c1cccc(OCCNC(CO)CO)c1 580723103 PJHKGKMCCYSDBC-UHFFFAOYSA-N 256.258 -0.084 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H](CO)CC1CC1 598292818 JKZGFWLQURJMSR-VIFPVBQESA-N 283.288 -0.289 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[C@H]2O)n1 599324762 WXGPERFAYRLWJL-HTRCEHHLSA-N 290.301 -0.480 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCOCCO 740211762 BYOASZWFJXPMTF-UHFFFAOYSA-N 259.218 -0.657 5 20 CBBD O=[N+]([O-])CCN(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 791053742 FVMUVZXCMYPBTJ-MNOVXSKESA-N 292.357 -0.069 5 20 CBBD Cn1ncc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)n1 804849519 PDMCNWOFRHIQPW-UHFFFAOYSA-N 277.244 -0.171 5 20 CBBD CCONC(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 845714428 DNSKSILYNVODLH-UHFFFAOYSA-N 283.244 -0.432 5 20 CBBD COCCN1CCN(c2c([N+](=O)[O-])cnn2C)CC1=O 893077862 NQKZWEYULSAHPP-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD Cc1cc(N2CC[C@@H](NCC[N+](=O)[O-])C2=O)n(C)n1 905136884 TVFYIAFOICEESF-SECBINFHSA-N 267.289 -0.300 5 20 CBBD NC(=O)CN1CCCC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 981765078 PCPQKIFINAHKKO-NXEZZACHSA-N 296.327 -0.939 5 20 CBBD Cc1nc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 1022064144 YGYANWGICFLMTD-UTINFBMNSA-N 294.315 -0.485 5 20 CBBD Cn1ccc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030292579 PIIBOOAOYAKPLA-GHMZBOCLSA-N 279.300 -0.614 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2ccn(C)n2)C1 1042705271 OVIRXLMJQMQGBX-VXGBXAGGSA-N 293.327 -0.272 5 20 CBBD Cn1cnc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 1116441799 SQEABCGBIKDEDK-UHFFFAOYSA-N 265.233 -0.764 5 20 CBBD C[C@H](C[S@@](C)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116837470 HFDGLPKJYYKLLP-WXQGDBPDSA-N 260.275 -0.185 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@H]2CCOCO2)c1=O 1321839478 AQYHDVOBXHOQDE-MRVPVSSYSA-N 283.240 -0.382 5 20 CBBD C[C@H]1CCNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 186707052 ZFSLFOSAOWNECT-WCBMZHEXSA-N 267.289 -0.095 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@H](C)O)c1 193084755 VLVLNHZBLDCMHU-LURJTMIESA-N 256.214 -0.076 5 20 CBBD CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 261936863 FKUWJIOUYLMURH-NSHDSACASA-N 297.267 -0.018 5 20 CBBD CC1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)OCCO1 271039871 NMDCAAPXWSOYGF-UHFFFAOYSA-N 270.245 -0.330 5 20 CBBD Cn1c(Cn2cccc([N+](=O)[O-])c2=O)cc(=O)n(C)c1=O 338637404 NEBXBTXIIGVVAF-UHFFFAOYSA-N 292.251 -0.798 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H](CO)COC)c1[N+](=O)[O-] 357706166 HYBSLBNDMYRKMP-ZCFIWIBFSA-N 272.261 -0.383 5 20 CBBD CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 357849085 NUSKCVPSLQRPHH-SSDOTTSWSA-N 255.234 -0.829 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 424115006 UBOLOURLJBPVFR-ZETCQYMHSA-N 280.240 -0.200 5 20 CBBD COC(=O)c1cn(CCn2cccc([N+](=O)[O-])c2=O)nn1 428939353 YQPMNOLBNYAZRW-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1N 429158510 OYTMTCAYPFEMLS-PSASIEDQSA-N 267.289 -0.013 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN(CCO)C2CCC2)c1 439270724 HJLXUUOSSZNSAV-GFCCVEGCSA-N 284.316 -0.001 5 20 CBBD COC(=O)NCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 497133565 QSSIBFGKBVKIMX-UHFFFAOYSA-N 256.222 -0.843 5 20 CBBD C[C@H]1CN(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 523715196 VDXQYQUSTLTJRO-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD C[C@@H]1CN(CCNC(=O)c2c([N+](=O)[O-])cnn2C)CCO1 536583390 LCVHKWRNJIWGOJ-SECBINFHSA-N 297.315 -0.221 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 548941710 FUWOGMJZFVKVJW-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](CO)[C@H](O)C1 577014329 ZLMHBHWBBXAVLZ-JGVFFNPUSA-N 256.262 -0.492 5 20 CBBD Nc1nc(N2CC[C@@H]3CCN[C@@H]3C2)ncc1[N+](=O)[O-] 591439667 XNYVNPXLMBRSHL-JGVFFNPUSA-N 264.289 0.155 5 20 CBBD CO[C@@H]1CS(=O)(=O)C[C@H]1N=c1cc[nH]cc1[N+](=O)[O-] 596434126 JCQOPZUXKCLMRF-PSASIEDQSA-N 287.297 -0.364 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2cccc([N+](=O)[O-])c2)C1 600348449 TYUPKOKTPANZHZ-UHFFFAOYSA-N 299.308 -0.032 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1c([N+](=O)[O-])ncn1C 782390438 BUDITNOJKZSJGM-ZETCQYMHSA-N 253.262 -0.005 5 20 CBBD CCONC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1N 846494051 LAYPCZAIVXNUHH-UHFFFAOYSA-N 282.256 -0.026 5 20 CBBD CC(C)(CCC(=O)N1CC(NS(C)(=O)=O)C1)[N+](=O)[O-] 862840003 SKBZZQLGFJYJMS-UHFFFAOYSA-N 293.345 -0.418 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)NCCF 1116921601 KMZWYTYVQQRFHS-ZCFIWIBFSA-N 287.251 -0.468 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2COC(=O)C2)c1[N+](=O)[O-] 1261251804 LTAYVKFVEIHZDK-LURJTMIESA-N 268.229 -0.318 5 20 CBBD C[S@](=O)c1nncn1CCn1ccc([N+](=O)[O-])n1 1318987133 SNDFDCFLFPPSRE-SFHVURJKSA-N 270.274 -0.180 5 20 CBBD O=C(N[C@H](C(=O)O)C1CC1)c1cc([N+](=O)[O-])n[nH]1 1601393600 WEBGUQZEQOIKAS-ZETCQYMHSA-N 254.202 -0.089 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(C)(C(=O)O)C1 1608158716 DKNLOUKIENEVCK-UHFFFAOYSA-N 268.229 -0.125 5 20 CBBD Cc1nn(CC(=O)NCC(=O)O)c(C)c1[N+](=O)[O-] 37415529 OWQAFDVQIPSBKA-UHFFFAOYSA-N 256.218 -0.391 5 20 CBBD O=C(NC[C@H](O)C1CC1)c1cc([N+](=O)[O-])c[nH]c1=O 71302185 KOAARZXATXAWTP-VIFPVBQESA-N 267.241 -0.216 5 20 CBBD CC(C)[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])cn1 92404844 UDJTWYBKKTWQRM-SECBINFHSA-N 256.262 -0.076 5 20 CBBD CC(C)[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 107184399 VKBTYDZGRCBMNC-VIFPVBQESA-N 269.261 -0.583 5 20 CBBD Cc1ccn(CC(=O)N2CCNC(=O)C2)c(=O)c1[N+](=O)[O-] 129892036 ZVCZQUYMUQBXPQ-UHFFFAOYSA-N 294.267 -0.977 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)CC(=O)N(C)C 159730542 DZKVPEOQLLMTEY-UHFFFAOYSA-N 282.300 -0.224 5 20 CBBD CNC(=O)C1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 186188512 HJPUXFBQEDVFMF-UHFFFAOYSA-N 281.272 -0.614 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@@H](C)O 274512959 HLDFDWSBGLYHFM-SVGQVSJJSA-N 272.213 -0.160 5 20 CBBD CN1CCO[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 330525978 KNAFLFYMHVRARZ-ZETCQYMHSA-N 269.261 -0.622 5 20 CBBD Nc1nc(N2CCSC[C@@H]2CO)ncc1[N+](=O)[O-] 345191212 QEUICLQATWUANK-LURJTMIESA-N 271.302 -0.119 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 346343197 FLEAEYCWBSXPRW-RNFRBKRXSA-N 281.272 -0.038 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCOC1 359785995 BLAKIIXDUPFHID-NSHDSACASA-N 282.256 -0.547 5 20 CBBD Cn1cc(N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2=O)cn1 363601239 UZRIUPCQTYCNIY-NXEZZACHSA-N 293.283 -0.740 5 20 CBBD COC[C@@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 382580346 VLQMSGSHKHGYRY-JTQLQIEISA-N 272.261 -0.695 5 20 CBBD CN1C[C@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C(=O)N1 436977160 DSGTZFGBOQVBNC-ZETCQYMHSA-N 280.240 -0.625 5 20 CBBD CN(C)C(=O)C(C)(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 517455448 JGRHXHCMDFHJPV-UHFFFAOYSA-N 283.288 -0.226 5 20 CBBD NC(=O)[C@H](CO)NC(=O)CCOc1ccccc1[N+](=O)[O-] 563828686 BLGJXVNLGJBFDT-QMMMGPOBSA-N 297.267 -0.674 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@@]12CCNC2 574037258 JSAVBXOPMYYDJF-ZYHUDNBSSA-N 279.300 -0.093 5 20 CBBD CN1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 615928939 LSKUUECLKBIKKP-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCCN(C(=O)O)C1 739362430 VSBIJFYLMUMNRB-SSDOTTSWSA-N 298.259 -0.555 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 782596677 SNSRXRMZBFWODO-MWLCHTKSSA-N 297.315 -0.685 5 20 CBBD O=C(CN1CCN(CC[N+](=O)[O-])CC1)N1CCCCC1 791053718 NKHMGBXDNQVEMB-UHFFFAOYSA-N 284.360 -0.107 5 20 CBBD CON(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 834849145 QUJJUFOSSYVLDY-UHFFFAOYSA-N 270.245 -0.317 5 20 CBBD CCNC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C 839779164 UINIULCVFIDLFM-HLTSFMKQSA-N 257.290 -0.072 5 20 CBBD CCONC(=O)CNC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] 846495627 BEIUJISQEGPFJA-UHFFFAOYSA-N 285.260 -0.322 5 20 CBBD CON(C)C(=O)[C@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 858834377 WOCRWXNJDSVBKJ-YFKPBYRVSA-N 270.249 -0.213 5 20 CBBD Cc1nc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)co1 990990558 QKMHERYCSIDZRH-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1ccon1 1124187151 ZHXOVZDIDHUDNK-UHFFFAOYSA-N 294.271 -0.164 5 20 CBBD O=C(NCCn1ccnc1)c1n[nH]cc1[N+](=O)[O-] 1319596466 MEVBFXRPDJKJCU-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@@]12CCOC2 1322625336 HAVUELMDVKQOFW-LBPRGKRZSA-N 296.283 -0.040 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](C(N)=O)C1 1324657164 JXOYAWSXNQUFCA-LURJTMIESA-N 267.245 -0.724 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)Cn1cnc([N+](=O)[O-])n1 1328480037 ZDXZIBSLMHMMBE-QMMMGPOBSA-N 285.260 -0.940 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN(C(C)=O)CC1 1340111835 AURMBSGHBKNJMQ-UHFFFAOYSA-N 282.304 -0.257 5 20 CBBD C[C@H](c1nnc(N2CC[C@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1343361004 SMDKQYJYQKTLGN-RQJHMYQMSA-N 268.277 -0.536 5 20 CBBD Cc1ccc(N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)nn1 1346424224 QAMPDDPBBOJQKC-UHFFFAOYSA-N 277.244 -0.052 5 20 CBBD C[C@H](C(=O)O)C(=O)OCCn1cnc([N+](=O)[O-])n1 1588580755 VNTYGXJOHUTAAD-RXMQYKEDSA-N 258.190 -0.550 5 20 CBBD O=C1C[C@H](Nc2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])CN1 1593383594 AFBUULFQSWFMMP-LURJTMIESA-N 290.243 -0.530 5 20 CBBD O=[N+]([O-])c1cn(Cc2nncs2)nc1-c1nn[nH]n1 1593486454 UAQGDBAWRSXSFX-UHFFFAOYSA-N 279.245 -0.129 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@H](O)C1 35200691 OJEYQUVLYHRGAK-VIFPVBQESA-N 254.246 -0.225 5 20 CBBD CN(CC(C)(CO)CO)c1ncc([N+](=O)[O-])cc1C(N)=O 269260937 BEVPCYNHXFFIGU-UHFFFAOYSA-N 298.299 -0.484 5 20 CBBD CCN1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1=O 273449368 FTRPLHCEBRHZGR-UHFFFAOYSA-N 281.272 -0.069 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 281221101 OMJKRCWHDLWEAZ-QMMMGPOBSA-N 297.267 -0.224 5 20 CBBD CC(C)c1[nH]nc(C(=O)NC[C@](C)(O)CO)c1[N+](=O)[O-] 338632786 JMFWZMLENVQFKP-NSHDSACASA-N 286.288 -0.086 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1COC[C@@H]1O 342374494 KQDNFAAQRDEURT-SFYZADRCSA-N 255.230 -0.245 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 342556472 DGFTYXCZBQKACF-YFKPBYRVSA-N 257.206 -0.882 5 20 CBBD CC(C)N1C(=O)C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 343993945 AJRISNKZLNBLHC-ZCFIWIBFSA-N 295.255 -0.416 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCC[C@@H]1O 352661010 QEMYBLCNIUGYTB-SRVKXCTJSA-N 284.316 -0.003 5 20 CBBD NC(=O)CC1(CNc2ncc([N+](=O)[O-])c(N)n2)CC1 420612962 WYVMPWSZQWTQTO-UHFFFAOYSA-N 266.261 0.035 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)OC[C@H]2C1 494130611 CGGFFEHOVUPARL-ZCFIWIBFSA-N 281.228 -0.406 5 20 CBBD C[C@@H]1CN(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 522268566 HIAWLJZBPZIDSK-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@H](CO)[C@@H](O)C1 545282202 OZBAJGLZFCTLRJ-CBAPKCEASA-N 269.257 -0.262 5 20 CBBD Nc1nc(N2CC[C@H]3NC(=O)CC[C@H]3C2)ncc1[N+](=O)[O-] 596458333 HOZMAICKOZSEPK-JGVFFNPUSA-N 292.299 0.072 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCS1(=O)=O 741110962 TZUQDEYFOJARGB-UHFFFAOYSA-N 288.285 -0.257 5 20 CBBD NC(=O)CS(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])cc1 753949417 DOFBCGWCTLQFAF-UHFFFAOYSA-N 287.253 -0.860 5 20 CBBD NC(=O)CONC(=O)c1ccc(O)c([N+](=O)[O-])c1 755845690 DZQZUTMRQIQOFY-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD C[C@@H](OC(=O)c1c(N)cccc1[N+](=O)[O-])C(=O)NC(N)=O 778145085 NZTGEKGPSANERU-RXMQYKEDSA-N 296.239 -0.083 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@H]2C[C@]2(CO)C1 783816879 ZORPWDWROORMQV-NOZJJQNGSA-N 293.279 -0.403 5 20 CBBD NC(=O)C[C@@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 808229881 VCESTRZFPGLNAX-QMMMGPOBSA-N 253.262 -0.054 5 20 CBBD CCOC(=O)COCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783802 VRTCZCDIXAPEJH-HTQZYQBOSA-N 260.246 -0.653 5 20 CBBD CCNC(=O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 855525629 FUAJVBJRZNSELE-LLVKDONJSA-N 281.268 -0.120 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2ncc[nH]2)C1 954239725 FHAHWTCZJAPSLE-RKDXNWHRSA-N 293.283 -0.642 5 20 CBBD CC(=O)N[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 978796193 QLTXULDKNIOGLV-UTINFBMNSA-N 255.274 -0.318 5 20 CBBD O=C(NC[C@H](CO)[C@H]1CCOC1)c1c[nH]nc1[N+](=O)[O-] 1256721298 WFAARAFVLAMFLZ-JGVFFNPUSA-N 284.272 -0.307 5 20 CBBD C[S@](=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1318368206 ICVKWEWUHIBHGE-IBGZPJMESA-N 287.297 -0.749 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 1320967786 QYLJDEMVDOYSDI-SSDOTTSWSA-N 273.274 -0.748 5 20 CBBD Cn1ccnc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1=O 1331749854 NEMINUAXDCWBKQ-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCO[C@@H](COC)C1 1340993658 SLROPTLNIONQKQ-SECBINFHSA-N 285.304 -0.074 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CC(O)C1 161468435 RCQQLNUGGXTLJK-QMMMGPOBSA-N 293.279 -0.084 5 20 CBBD C[C@H]1CNCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 178496224 XRARRZUEQIKSFC-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CS(=O)(=O)NCCCNc1ncc([N+](=O)[O-])cn1 230388545 LLLQXDZPXAJRQZ-UHFFFAOYSA-N 275.290 -0.264 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)c1nn(C)cc1[N+](=O)[O-] 263341948 XVJYXOKJXQGCRQ-YFKPBYRVSA-N 256.218 -0.127 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1Nc1ncc([N+](=O)[O-])c(N)n1 281765175 ZCNRRAGEAJWSRS-VDTYLAMSSA-N 266.261 -0.097 5 20 CBBD CC(=O)NCC(=O)NCC(=O)Nc1cccc([N+](=O)[O-])c1 298994273 AFKWYELREQZIIE-UHFFFAOYSA-N 294.267 -0.214 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)CCO 343173431 LTVIMCPBQNWCOL-UHFFFAOYSA-N 256.262 -0.059 5 20 CBBD Cc1[nH]nc(C(=O)NCCC(=O)N(C)C)c1[N+](=O)[O-] 354593906 FCXDPVUDSQEFAU-UHFFFAOYSA-N 269.261 -0.166 5 20 CBBD CCC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 425035324 ITKWEDFRCWEJMV-UHFFFAOYSA-N 281.272 -0.020 5 20 CBBD COC1(CO)CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 444876260 NTWWLGPWESQGHU-UHFFFAOYSA-N 283.288 -0.055 5 20 CBBD C[C@@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)CC(=O)O 573687270 ADVHLDSGLZKQIH-RXMQYKEDSA-N 255.234 -0.088 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 592942058 YMSPZILFLVINJG-NKWVEPMBSA-N 298.255 -0.686 5 20 CBBD COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](C)O1 593502704 BNTKJSKEBXOVNX-XPUUQOCRSA-N 297.271 -0.266 5 20 CBBD CCC1(O)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 619876690 LVJWMJARRWJATK-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD NC[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 702049324 KWMSQKOFGMEIFZ-MRVPVSSYSA-N 253.262 -0.402 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 762715344 BGOUPAFWIOOIOZ-CYBMUJFWSA-N 294.311 -0.027 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCC1(CO)COC1 763670127 KZXNRTPUKFISNL-UHFFFAOYSA-N 285.256 -0.267 5 20 CBBD CN(C)c1noc(COC(=O)Cn2cc([N+](=O)[O-])cn2)n1 801221417 GZWHJYOVEJKFNJ-UHFFFAOYSA-N 296.243 -0.016 5 20 CBBD O=C(O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 821535130 IINYKJLKDDNVHF-UHFFFAOYSA-N 256.170 -0.616 5 20 CBBD Cn1ncc(CCCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 842375683 CIZABZNCDMIXKJ-RKDXNWHRSA-N 254.246 -0.044 5 20 CBBD C[C@H]1COC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 928892608 INYJYHXBDATSAJ-CBAPKCEASA-N 254.246 -0.058 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2nncs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022064149 YJPZFHIOIMFWMV-BZNPZCIMSA-N 297.340 -0.060 5 20 CBBD CC(=O)N(C)CC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093526455 FYKULTTUPJRERX-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD C[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@]2(CCOC2)O1 1121300212 UUVPDJPYHOVAMR-SKDRFNHKSA-N 297.315 -0.024 5 20 CBBD CCn1nncc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936256 CZPOGAJEBNDHEQ-NXEZZACHSA-N 282.304 -0.831 5 20 CBBD CN(Cc1ncon1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 1319877181 DSSWMEVBIIMIQK-UHFFFAOYSA-N 293.239 -0.202 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1319888543 STKGTKPGEPGECB-HTQZYQBOSA-N 295.299 -0.027 5 20 CBBD CC(C)[C@@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(N)=O 1320011536 BVEXOKIQNNAVCH-LLVKDONJSA-N 297.267 -0.190 5 20 CBBD O=C(NCCC1(O)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1323064044 SDNJDPKEBRGRIJ-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nncn1C 1323879329 BDVKPETVAUCEDT-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD CC1(C)C[C@@H]1NC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1325647788 VFWMEOIHZNOJEW-VIFPVBQESA-N 295.299 -0.178 5 20 CBBD NC(=O)CN1CCN(c2ncccc2[N+](=O)[O-])CC1 49320750 GNTPJYLSMPNTPK-UHFFFAOYSA-N 265.273 -0.403 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])NC(CO)CO 87751592 JSUMGAADVZBUJK-UHFFFAOYSA-N 254.242 -0.393 5 20 CBBD CN1C[C@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@H]2C1 192523095 CHGYDZOZHRFYTB-AOOOYVTPSA-N 279.300 -0.189 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286686250 FGNUCEOOUBJWTF-CBAPKCEASA-N 298.255 -0.544 5 20 CBBD CN(CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 299497809 JYRMMUJUHQJGJY-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)c1cc([N+](=O)[O-])nn1C 356467312 ZMGCRAFZWIQAMJ-SECBINFHSA-N 297.315 -0.221 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCO[C@H]1C(=O)O 595244567 KVWKOOVNZWDDIB-IMTBSYHQSA-N 284.228 -0.850 5 20 CBBD Cc1noc(CN2CCN3C(=O)NC(=O)[C@@H]3C2)c1[N+](=O)[O-] 595404208 OOGJFIPXHHXCIH-ZETCQYMHSA-N 295.255 -0.373 5 20 CBBD CCn1cc(CN=c2nc(N)c([N+](=O)[O-])c[nH]2)nn1 596455412 XOUFOECQINXIMH-UHFFFAOYSA-N 264.249 -0.388 5 20 CBBD Cn1cc(N2CCN(CC[N+](=O)[O-])CC2=O)cn1 791053653 VDWBNZOVZZIMDP-UHFFFAOYSA-N 253.262 -0.655 5 20 CBBD C[C@@H](O)[C@@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 843062549 PSICPGRAZMAHIK-FXAINCCUSA-N 270.285 -0.041 5 20 CBBD NCCN(CCO)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 857768529 SXXWAWCWGNPGMZ-UHFFFAOYSA-N 296.283 -0.687 5 20 CBBD CC(=O)N1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1 860936586 GLCKVUAVFVVLKB-SNVBAGLBSA-N 282.256 -0.045 5 20 CBBD O=C(NC1CN(C(=O)c2nccs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991292034 BOLCFKLQPGVFSO-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD Cc1noc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932429 XLGOFKHTUAYSIG-HTQZYQBOSA-N 269.261 -0.751 5 20 CBBD NCCC1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1332721989 AXILWMBSTYKFOL-UHFFFAOYSA-N 282.304 -0.226 5 20 CBBD CO[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@H]1OC 1338061354 ZAGKXVMQQPGFCB-OCAPTIKFSA-N 271.277 -0.558 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)CC(=O)O 1600748416 QDWAJOPQEOSPLS-MRVPVSSYSA-N 283.240 -0.136 5 20 CBBD C[C@](O)(CNC(=O)c1cccc([N+](=O)[O-])c1O)C(=O)O 1604373374 PDILHUXVXFAFRO-NSHDSACASA-N 284.224 -0.134 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)CC1=O 266027053 VKCHPGZXTAHSAX-UHFFFAOYSA-N 280.240 -0.390 5 20 CBBD C[C@@H]1[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCN1C 343565592 RUSZWJHHLGXTAD-BDAKNGLRSA-N 282.304 -0.215 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 356724158 BTQQPGCWJREYRA-SFYZADRCSA-N 295.299 -0.027 5 20 CBBD O=C(N[C@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])cnc1O 359445007 WCVMEEIHJAYYKA-PVDFSEMESA-N 285.281 -0.054 5 20 CBBD CCC[C@@H](O)[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 413501087 YMFNSVUSKSGDIM-HTRCEHHLSA-N 271.277 -0.099 5 20 CBBD CC[C@@H](N)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 517029517 RUPHGODXODZIOM-MRVPVSSYSA-N 255.278 -0.047 5 20 CBBD C[C@@H](CO)N(C[C@@H](C)O)C(=O)c1c[nH]nc1[N+](=O)[O-] 571742811 JLKZWECWWYKCJA-NKWVEPMBSA-N 272.261 -0.478 5 20 CBBD NC(=O)[C@H]1CN(c2sccc2[N+](=O)[O-])CCN1 611411413 UGZMEZOKCQCWKY-ZCFIWIBFSA-N 256.287 -0.080 5 20 CBBD CCCc1[nH]nc(C(=O)NN2CC(=O)NC2=O)c1[N+](=O)[O-] 743290053 JIKJRQHUDPKLIH-UHFFFAOYSA-N 296.243 -0.533 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCn1ccccc1=O 745573284 FCRXSTRTVSJOBG-UHFFFAOYSA-N 293.239 -0.409 5 20 CBBD CC(=O)OCCNC(=O)Cn1ccc([N+](=O)[O-])n1 798256197 LQRUKKLFIFUNMM-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)Nn1c(O)nnc1O 816731897 KBFOMUVTTDYZLY-UHFFFAOYSA-N 295.211 -0.253 5 20 CBBD Nc1nc(N2CC[C@H](C(=O)O)C2)ncc1[N+](=O)[O-] 819130533 BMUBZEAJTDLVHB-YFKPBYRVSA-N 253.218 -0.122 5 20 CBBD CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840308490 UNXKKINKPKGSID-PRJMDXOYSA-N 273.314 -0.359 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](C2OCCO2)C1 927995464 BCCVLHHLCUJJEZ-DJLDLDEBSA-N 256.258 -0.127 5 20 CBBD C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1118090533 LQRIYBBHAQYWCF-PSASIEDQSA-N 295.303 -0.369 5 20 CBBD O=C(NCCC1=CCN(CCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1160107163 KNEFZEHCKBWHQV-VXGBXAGGSA-N 283.328 -0.218 5 20 CBBD NC(=O)CCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1323393162 UOYXLFIIHGDCLD-UHFFFAOYSA-N 296.283 -0.472 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@H]2NCC[C@@H]2C1 1326305262 DQLSDHWGYPXOSU-RKDXNWHRSA-N 280.288 -0.603 5 20 CBBD CN1C[C@H](N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)CCC1=O 1326767037 HSDMHVJMHMWDFF-MRVPVSSYSA-N 296.287 -0.735 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CCNC2)c1=O 1328181062 GHKCINAYINWKOJ-SSDOTTSWSA-N 266.257 -0.535 5 20 CBBD CC(C)(CCC(=O)N1CCC(O)(C(N)=O)CC1)[N+](=O)[O-] 1328369091 KURJYFSUJVTQDZ-UHFFFAOYSA-N 287.316 -0.339 5 20 CBBD O=c1ccn(CCN2CCNCC2)cc1[N+](=O)[O-] 1349114503 URJXTCLOAGUAOY-UHFFFAOYSA-N 252.274 -0.338 5 20 CBBD C[C@@H](c1nncn1C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590054819 NEBIHBQXPCXFTA-YFKPBYRVSA-N 290.247 -0.291 5 20 CBBD CN1CCN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C[C@H]1CO 1598622688 BRYDKCUMBBRYHT-VIFPVBQESA-N 296.283 -0.199 5 20 CBBD O=C(O)CNC(=O)CNCCc1ccc([N+](=O)[O-])cc1 1608752619 GCLSPXLWVPMADC-UHFFFAOYSA-N 281.268 -0.072 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1609741247 FKSRTJKYYSWHBO-QMMMGPOBSA-N 297.267 -0.064 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCNC1=O 10452347 GARRVXIFBDIFMQ-UHFFFAOYSA-N 266.213 -0.692 5 20 CBBD O=C(O)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])s1 35097314 PIFHLPMAQHUKLD-UHFFFAOYSA-N 287.253 -0.413 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CN3CCC2CC3)c1 37883513 RWIPLSSDLAJEDQ-CHWSQXEVSA-N 295.343 -0.164 5 20 CBBD CC[C@@H](C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 53835765 PWBHSKBPZPBHCG-APPZFPTMSA-N 299.287 -0.110 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ncc[nH]1 70991665 LMSNDLYAZVPOAX-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD C[C@@](O)(CNC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)O 90275013 NJKXXIPNCIMSCO-GFCCVEGCSA-N 298.251 -0.075 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC(=O)NC1CC1 227884848 AWRZXMJDQFOZLW-UHFFFAOYSA-N 279.256 -0.420 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 230706256 LGTFKYMSGILVAZ-VXNVDRBHSA-N 296.283 -0.206 5 20 CBBD CN1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 264560500 OCULPWALRNYFJW-YFKPBYRVSA-N 252.234 -0.390 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 265661032 AZIDOAUHIFWGQQ-SSDOTTSWSA-N 281.272 -0.071 5 20 CBBD CC(C)[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 268697827 XOVVHPIRUVPPMH-JTQLQIEISA-N 283.284 -0.110 5 20 CBBD CNC(=O)[C@@H]1CN(c2ncccc2[N+](=O)[O-])CCO1 273168474 KATUNAXNDJOLGQ-VIFPVBQESA-N 266.257 -0.059 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1F 341747973 OJLUBRJMQKXILV-SECBINFHSA-N 285.231 -0.761 5 20 CBBD Cn1ccc(=NCCN=c2ncc([N+](=O)[O-])c[nH]2)[nH]1 439126676 CYYREDMFMYUNDU-UHFFFAOYSA-N 263.261 -0.514 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)CNC)c([N+](=O)[O-])n1 595119073 LGAGCLMPDGRAQG-ZETCQYMHSA-N 291.333 -0.303 5 20 CBBD Nc1ccc(NCCN2CC[C@H](O)C2)nc1[N+](=O)[O-] 599199658 ORPFGUQNKZXXHQ-QMMMGPOBSA-N 267.289 0.051 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(N)=O 760061436 YWQIJJIGWDNXBO-RXMQYKEDSA-N 257.202 -0.582 5 20 CBBD O=C(O)[C@H]1C[C@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 833181570 PZLMAMXJCPFQPM-NTSWFWBYSA-N 270.201 -0.550 5 20 CBBD NC(=O)c1ccc(CN2CCNC[C@H]2CO)c([N+](=O)[O-])c1 1580103196 UXRSVAVYPVNGQO-NSHDSACASA-N 294.311 -0.540 5 20 CBBD O=C(O)[C@]1(O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 1601722566 PFKYGDLDDDYTTC-JTQLQIEISA-N 270.245 -0.687 5 20 CBBD CCc1[nH]nc(C(=O)NCCN(C)CC(=O)O)c1[N+](=O)[O-] 1610057657 ZTKKQRYZAOOQGB-UHFFFAOYSA-N 299.287 -0.374 5 20 CBBD Cn1c(C(=O)N2CCN(CCO)CC2)ccc1[N+](=O)[O-] 35187745 NZRXTCCKSDRDTC-UHFFFAOYSA-N 282.300 -0.317 5 20 CBBD O=[N+]([O-])c1ccc(OCCNC(CO)CO)cc1 87753309 RIBKXOAGYSYAGO-UHFFFAOYSA-N 256.258 -0.084 5 20 CBBD CN(CC(=O)NC(C)(CO)CO)c1ccccc1[N+](=O)[O-] 120654472 JBNKJNMOVXBQSR-UHFFFAOYSA-N 297.311 -0.110 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N(CCO)C1CC1 161873957 QWFARJJRRFRRRN-UHFFFAOYSA-N 283.288 -0.042 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 227046897 YTTUGOIPGHLSQI-SSDOTTSWSA-N 271.229 -0.803 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 264985284 IPBCUIXYOVNHIG-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD COCCN1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 282396120 HGNVAWRNRMCOTP-UHFFFAOYSA-N 297.271 -0.934 5 20 CBBD CN1CCN(CCNC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285678935 ZVGPCGUTWPMTNV-UHFFFAOYSA-N 282.304 -0.705 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@H](O)CO)n1 286080643 BPECXLDNICYDPM-ZETCQYMHSA-N 285.256 -0.434 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1C=C[C@H](CO)C1 341732774 IOWDFSPMCLEFCT-IUCAKERBSA-N 266.257 -0.156 5 20 CBBD O=C(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)NCCO 348207892 ZTKFXYRGIKMBFS-UHFFFAOYSA-N 282.256 -0.175 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CCO1 350486835 ZDQJAERFQLMIIQ-YFKPBYRVSA-N 258.259 -0.258 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H]2CNC[C@H]2C1 353763168 SRSGTWUQIXNVMF-YUMQZZPRSA-N 265.273 -0.001 5 20 CBBD CN1C(=O)CC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 355017141 MJAZFBNXYPRHME-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD O=C(NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1cc[nH]n1 357459392 VPZBLWSBCLJKJJ-UHFFFAOYSA-N 292.255 -0.194 5 20 CBBD O=C(N[C@@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])cnc1O 359445008 WCVMEEIHJAYYKA-YIVBRQOJSA-N 285.281 -0.054 5 20 CBBD CN(CCCC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362432674 AVCCKTNBKDLFHY-UHFFFAOYSA-N 271.233 -0.491 5 20 CBBD Cc1nc(NC[C@](C)(O)C(=O)O)ncc1[N+](=O)[O-] 516070841 QZNVTKNCFALDOB-VIFPVBQESA-N 256.218 -0.059 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC1(C(N)=O)CC1 532864121 JNXIQSCEJMISCN-UHFFFAOYSA-N 252.230 -0.319 5 20 CBBD COC(=O)c1cnc(NCCNC(N)=O)c([N+](=O)[O-])c1 616371751 BEOXKNTXICJWQX-UHFFFAOYSA-N 283.244 -0.143 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NOCCO 776581075 COACBYILYKHFQL-UHFFFAOYSA-N 258.234 -0.470 5 20 CBBD O=C([C@@H]1CCCO1)N1CCN(CC[N+](=O)[O-])CC1 791054379 UKUBXLFYVPQMRE-JTQLQIEISA-N 257.290 -0.414 5 20 CBBD COCCO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839731559 SVZWVVMBFPKZAB-IVZWLZJFSA-N 258.274 -0.085 5 20 CBBD CC(=O)N1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1 881694050 VZHDYZOBWPSXAB-LMLFDSFASA-N 267.285 -0.412 5 20 CBBD CN(CCNC(=O)C(N)=O)c1cccc(F)c1[N+](=O)[O-] 1100294804 PJVHGOSLJHLFPS-UHFFFAOYSA-N 284.247 -0.228 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1116496935 ZCIPQVHRJJKMKJ-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD O=C(CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NC1CC1 1157767145 ICMPRVUUNMLUQA-NXEZZACHSA-N 284.316 -0.974 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@]1(O)CCOC1 1319485182 MAKITDPHGXTRTJ-LBPRGKRZSA-N 297.267 -0.976 5 20 CBBD CN(C)CCN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319591305 HUZYYIJUVZNNPE-UHFFFAOYSA-N 282.300 -0.224 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@H]2CC[C@@H](O)C[C@H]2C1 1328447820 JZBQICLNLGSLBH-KXUCPTDWSA-N 295.299 -0.194 5 20 CBBD O=C(NC[C@]1(C(=O)O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1601473783 MPZIPNNIXQYFTM-SNVBAGLBSA-N 284.228 -0.461 5 20 CBBD Cn1cc(CCNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 149015956 YEYAMWXHHXRTML-GFCCVEGCSA-N 294.315 -0.282 5 20 CBBD NC(=O)c1ccc(N2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 236174416 JVKZYNHBSVGGAO-AOOOYVTPSA-N 267.241 -0.765 5 20 CBBD CC(C)[C@H](N)CNC(=O)Cn1cc([N+](=O)[O-])cn1 269292441 UYCYRGIBYAFOJZ-SECBINFHSA-N 255.278 -0.109 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)N1CCCCC1 298775346 QRJYPDWOXMAKJF-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD O=C1C[C@@H](Nc2nccc(C(=O)O)c2[N+](=O)[O-])CN1 311827520 JLABEWVBRYMMEE-RXMQYKEDSA-N 266.213 -0.012 5 20 CBBD C[C@](O)(CO)CNc1cccc(C(N)=O)c1[N+](=O)[O-] 343047082 VOIHGAVHPMXVIQ-LLVKDONJSA-N 269.257 -0.151 5 20 CBBD N=c1nc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)[nH]c(=N)[nH]1 344195619 DIVPMBLBRBAGQD-UHFFFAOYSA-N 276.260 -0.273 5 20 CBBD COCCN(Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)C(N)=O 355925819 BYEOTKNKQZXHDI-QMMMGPOBSA-N 285.304 -0.350 5 20 CBBD COC(=O)[C@@H]1C[C@@H](OC)CN1c1ncc([N+](=O)[O-])c(N)n1 372787265 WDLYHXNGTGQNEO-RQJHMYQMSA-N 297.271 -0.266 5 20 CBBD CC(=O)N[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 491038617 RLWBUTXVCGVJSP-ZETCQYMHSA-N 269.261 -0.568 5 20 CBBD Cc1cccc(C(=O)N[C@@H]2CN(C)NC2=O)c1[N+](=O)[O-] 539781944 UACYFJJZZLWOKQ-SECBINFHSA-N 278.268 -0.022 5 20 CBBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCCN(C)C 550604085 FPJJQEBMAQYLHO-MRVPVSSYSA-N 298.299 -0.016 5 20 CBBD O=C(NCCNC(=O)C1CC1)c1c[nH]nc1[N+](=O)[O-] 554835132 OSLAMAGBUJYNHP-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD CC(CO)(CO)CNc1ncc([N+](=O)[O-])c(N)n1 590568167 BHJTXIZAEGLNLS-UHFFFAOYSA-N 257.250 -0.630 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCSC[C@H]1CO 708362063 FFDNDKIPPFNURY-MRVPVSSYSA-N 286.313 -0.272 5 20 CBBD COCCS(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])[nH]1 732521322 VKXACNKKVGEGDV-UHFFFAOYSA-N 277.258 -0.371 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 763698859 NIJLZUWIYPJCPH-YFKPBYRVSA-N 273.270 -0.507 5 20 CBBD O=C(O)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 819327439 FQSRDAZXVPBIRJ-QMMMGPOBSA-N 270.245 -0.423 5 20 CBBD COC(=O)[C@H]1CN(C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 840500428 WPEFRENJGYISBS-IVZWLZJFSA-N 285.300 -0.785 5 20 CBBD NC(=O)NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N 848943745 DCFMCOZZXHHRFM-UHFFFAOYSA-N 282.212 -0.471 5 20 CBBD CON1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CC1 854860558 CIQCEVODBYIFRY-UHFFFAOYSA-N 283.288 -0.195 5 20 CBBD CC(=O)N1CC(N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 967217054 YBKXMFBLWWRCTK-VXGBXAGGSA-N 296.327 -0.974 5 20 CBBD CSCC(=O)N1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 976481308 IUAPTRURCFXROW-DZEUPHNYSA-N 299.352 -0.412 5 20 CBBD COCCC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062368886 UJACMEQINMEMBW-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD C[C@@H](N)[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261492163 SQKJFHHVHARPKG-BDAKNGLRSA-N 282.304 -0.228 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H](CO)[C@H](CO)C1 1301428611 OXDNBBMHLVOUKQ-UWVGGRQHSA-N 296.279 -0.027 5 20 CBBD CN(CCO)C(=O)C(=O)NCCc1ccc([N+](=O)[O-])cc1 1321998133 VQYNPXOGKMCQBL-UHFFFAOYSA-N 295.295 -0.296 5 20 CBBD CCN(CC(N)=O)C(=O)c1c([N+](=O)[O-])cnn1C 1326235291 XINQJAHCNBHIKG-UHFFFAOYSA-N 255.234 -0.724 5 20 CBBD C[S@@](=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1339171796 DYFDUMLEBAIQOF-GOSISDBHSA-N 274.302 -0.324 5 20 CBBD O=C(O)[C@@H](F)CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 1602170564 DTLKMJWHXZUXMP-LURJTMIESA-N 293.232 -0.309 5 20 CBBD NC(=O)CCCCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1606416321 ZPHJDFAGTVGJIW-UHFFFAOYSA-N 280.248 -0.373 5 20 CBBD O=C(O)CSCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 1608768082 XWOYXUXJOCEJOY-UHFFFAOYSA-N 274.258 -0.135 5 20 CBBD CCOC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 48446656 MNKXWVGEFRYRKC-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD COc1cc(C(=O)NCC(N)=O)c([N+](=O)[O-])cc1OC 70271038 CPWKRQBYQWCCCJ-UHFFFAOYSA-N 283.240 -0.173 5 20 CBBD CC(C)N(CC(N)=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75611833 XDNRFQSHILCMKE-SNVBAGLBSA-N 285.304 -0.652 5 20 CBBD CCN(C)C(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 274855897 QMEYADFLLZBFTR-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD CCOC(=O)c1ccnc(NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 279539155 VHIMVWUAMHMZMP-ZETCQYMHSA-N 298.255 -0.575 5 20 CBBD NC(=O)[C@H]1CN(c2ccc(N)cc2[N+](=O)[O-])CCO1 283737016 INYHEZHATRQGFZ-SNVBAGLBSA-N 266.257 -0.133 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC(=O)N1C 337693117 OEQNPLDWQIJZKX-SSDOTTSWSA-N 281.272 -0.369 5 20 CBBD C[C@H](CN)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 347667461 FZIAEAULSSYGMN-SSDOTTSWSA-N 254.246 -0.780 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](O)[C@H](C)C1 351871537 UEDKOSSOFNCSRO-VXNVDRBHSA-N 268.273 -0.061 5 20 CBBD CNC(=O)CCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 354885353 OBONDGRLGRKRMJ-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD CNC(=O)c1ccc(N[C@H](CO)C(=O)NC)c([N+](=O)[O-])c1 358860236 KOYSNGQWUNEOSA-SECBINFHSA-N 296.283 -0.527 5 20 CBBD Cc1nn(C)c(N2CC[C@@H](S(N)(=O)=O)C2)c1[N+](=O)[O-] 358904106 QCEPQDAWQXIAII-SSDOTTSWSA-N 289.317 -0.496 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@@H](C)O 527195585 HXKGEBJWSFVVNW-MUWHJKNJSA-N 283.240 -0.358 5 20 CBBD COC[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 548942618 BJHUOXMNHSSFHN-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 592462846 AFXOVOKHWFBEOH-IONNQARKSA-N 297.267 -0.081 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1CN(C(=O)O)C1 740221438 YPYLNAOOMBAESB-UHFFFAOYSA-N 283.244 -0.422 5 20 CBBD CN(C[C@H](O)CO)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 825953303 DLUODOURDPRDRY-QMMMGPOBSA-N 294.271 -0.436 5 20 CBBD O=C(NC1CN(C(=O)Cc2ccoc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282136 WSGWQNPITYOIDZ-GHMZBOCLSA-N 293.279 -0.186 5 20 CBBD O=C(NC1(CCO)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1118783830 AKSMIQLUCHZKMU-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD COCC[C@@H](CO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1321647882 CMHBTSBXCXCKKC-QMMMGPOBSA-N 286.288 -0.236 5 20 CBBD CN(CCC(N)=O)S(=O)(=O)c1cccnc1[N+](=O)[O-] 1323546390 SZFWUPXISDETRJ-UHFFFAOYSA-N 288.285 -0.514 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1(CCO)CC1 1330550828 DWAKBPMOJGPFQM-UHFFFAOYSA-N 254.246 -0.027 5 20 CBBD CC(=O)OCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1588888027 IDKCZUFKINZDOZ-UHFFFAOYSA-N 253.178 -0.508 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])o1 19274157 NCJXBBROJGMQJN-PHDIDXHHSA-N 270.197 -0.152 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCn1cncn1 41863146 LIGXYSIIXLZALT-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD CC[C@H](C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 53835768 PWBHSKBPZPBHCG-IONNQARKSA-N 299.287 -0.110 5 20 CBBD Cc1nn(C)c(N2CCN(C(=O)[C@H](C)O)CC2)c1[N+](=O)[O-] 124997442 OTJUFKKPDZSILN-VIFPVBQESA-N 297.315 -0.334 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H](OCCO)C1 269442683 DYAICTJGUFECFS-JTQLQIEISA-N 298.299 -0.209 5 20 CBBD CN(C[C@H](O)CO)C(=O)CNc1ccccc1[N+](=O)[O-] 271316476 WNFRZTWFPQJACR-VIFPVBQESA-N 283.284 -0.182 5 20 CBBD C[C@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C[C@H](CO)O1 347554010 MRAFIJJYZGGHGY-IONNQARKSA-N 297.267 -0.083 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1nc[nH]n1 355795555 SLFIRMCPEMBXMY-SSDOTTSWSA-N 292.255 -0.248 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 356483036 QYPSUTXSIMACPN-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)C1CC(O)C1 408218979 KWVXAUBLWVKUMH-UHFFFAOYSA-N 254.246 -0.076 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[C@H]1N 429186846 VNAYICGDEIVECD-RKDXNWHRSA-N 267.289 -0.013 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2ncc([N+](=O)[O-])s2)C1 443511392 QGCYAYHKKZNGNL-RXMQYKEDSA-N 278.315 -0.082 5 20 CBBD CC[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)NC 450940129 LHZWBBJLGQSYCF-RXMQYKEDSA-N 254.250 -0.097 5 20 CBBD CN1CC[C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 584816755 YJLRVODXDOGKTB-ZETCQYMHSA-N 253.262 -0.001 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2COC[C@H]2O)c1 592432687 LTMZGKGUGFHWOH-CYZMBNFOSA-N 298.295 -0.316 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 594300528 AZRGKKFYTIYJFQ-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD NC(=O)N[C@@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 596180277 RGXLKGYDJYDQOB-ZCFIWIBFSA-N 266.261 -0.181 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCC(=O)N1 599697644 RBAYVPPNMVFBHJ-SCZZXKLOSA-N 295.299 -0.178 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](O)[C@@H](O)C1 600216676 AVUUPJVHONPMIP-IUCAKERBSA-N 284.272 -0.946 5 20 CBBD Cn1ncc(C(=O)OCCn2ccc([N+](=O)[O-])n2)n1 792524238 HJQUUQOLJUVMBM-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 863628557 LBQFIZVLZIWSBJ-YFKPBYRVSA-N 271.233 -0.544 5 20 CBBD NC(=O)C1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 1324071278 LBDFRNTVPUCQRF-UHFFFAOYSA-N 295.299 -0.095 5 20 CBBD CS(=O)(=O)[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1327085495 RGOPERMPAWIYDQ-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccnc(O)c1[N+](=O)[O-] 1328556753 MOMVDGGTNZONPN-LURJTMIESA-N 256.218 -0.786 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C(=O)O)C1 1328606408 JRXQKDYLTQGGFW-ZETCQYMHSA-N 296.287 -0.580 5 20 CBBD Nc1c([N+](=O)[O-])cnn1CC(=O)N1CCC(C(=O)O)CC1 1610649437 BQVSZLMXCGPYFN-UHFFFAOYSA-N 297.271 -0.303 5 20 CBBD COC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 19025756 IPAQPXZKRLAIGY-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD N[C@H]1C[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 36263984 SZRJTELTEBDRFJ-DTWKUNHWSA-N 257.271 -0.027 5 20 CBBD CNC(=O)CNC(=O)COc1ccc([N+](=O)[O-])c(OC)c1 66016883 CEZYBDYABAIBEN-UHFFFAOYSA-N 297.267 -0.156 5 20 CBBD C[C@H](O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173799694 NTJYTNGCEUJWMW-WPRPVWTQSA-N 258.278 -0.535 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CC(=O)N(C2CC2)C1 267951261 KQLIZAZVDHTNPK-QMMMGPOBSA-N 293.283 -0.329 5 20 CBBD NC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CCO1 274724532 BRXHUDPYKGQDOH-QMMMGPOBSA-N 280.284 -0.023 5 20 CBBD CC(=O)N[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])c2)C1 339651078 VLURFNHQKOPSHL-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 344254333 KYCOGGIVPDALEP-ZCFIWIBFSA-N 295.255 -0.585 5 20 CBBD O=C1OC[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN12 363812231 FKLKPZPXAGBLSJ-JTQLQIEISA-N 281.272 -0.072 5 20 CBBD CCn1cc(S(=O)(=O)NCCCCN)c([N+](=O)[O-])n1 447252855 ULZFEDMOELSWPG-UHFFFAOYSA-N 291.333 -0.172 5 20 CBBD CC(=O)N1CC(NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 548714884 CFIKYQOBPDWGJM-UHFFFAOYSA-N 279.256 -0.468 5 20 CBBD CN[C@@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 563118465 UYIKGTFDWDJWKQ-MRVPVSSYSA-N 286.313 -0.028 5 20 CBBD CN1CC[C@H]2CC[C@H](C1)N2C(=O)Cn1cnc([N+](=O)[O-])n1 566453800 LYCMNDVLACXNCX-NXEZZACHSA-N 294.315 -0.119 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 573980326 URBBKFNHDRCMEO-QMMMGPOBSA-N 293.283 -0.125 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 592910767 LORFNGZRMHGDRB-SFYZADRCSA-N 297.267 -0.081 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 609575022 XFUCPCJYEVBNNY-QMMMGPOBSA-N 272.286 -0.143 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC[C@@H](O)C1 611020508 AKIJPNRRRNBAKJ-SSDOTTSWSA-N 273.270 -0.255 5 20 CBBD NC(=O)CN1CCCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 728867836 TVXGJAOIVMNVBQ-UHFFFAOYSA-N 295.299 -0.444 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)O[C@H]1CCCNC1=O 767278475 FLEHCNFMBYMJHV-QMMMGPOBSA-N 268.229 -0.387 5 20 CBBD NC(=O)CONC(=O)c1cc([N+](=O)[O-])ccc1O 779678992 KKISRITVGOMOAH-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD Cn1nncc1COC(=O)Cn1ccc([N+](=O)[O-])n1 809129455 CXKOBUDQLCNHTA-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD NC(=O)COC1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 1318993664 NBJYYPQIGYNAJI-UHFFFAOYSA-N 297.315 -0.242 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 1326995726 FQGTXRHCDCLGTM-JGVFFNPUSA-N 284.272 -0.558 5 20 CBBD CC(=O)NCCN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1349456025 PDNDIEWXYJQOQR-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD CNS(=O)(=O)C1CCN(CC[N+](=O)[O-])CC1 1351246011 GMAUSGDKQPEOGB-UHFFFAOYSA-N 251.308 -0.723 5 20 CBBD O=C(O)[C@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1574620509 BTBPLUJEXUYKTR-KXUCPTDWSA-N 279.252 -0.141 5 20 CBBD Cn1nncc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592611749 OCHDCYONBNQXPC-UHFFFAOYSA-N 276.220 -0.852 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](O)C[C@H]2C(=O)O)n1 1597900221 WGHYGZIZKGHMOA-RQJHMYQMSA-N 298.255 -0.529 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 1601749047 ABUAMAFAGUKUKU-NXEZZACHSA-N 284.272 -0.299 5 20 CBBD O=C(O)c1ccnc(NCCn2cnnn2)c1[N+](=O)[O-] 1602484036 LZRNDSGHEQZMEN-UHFFFAOYSA-N 279.216 -0.213 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1CCn1cc([N+](=O)[O-])ccc1=O 90552530 JEQRKJGWIKTBNR-PWSUYJOCSA-N 297.311 -0.162 5 20 CBBD C[C@H]1C(=O)NCCN1CCn1ccc([N+](=O)[O-])n1 176226900 OTACUKUIZGMBNV-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD Cn1c(C(=O)NC[C@@]2(O)CCOC2)ccc1[N+](=O)[O-] 229686147 XFZAGFVSAUWEIY-NSHDSACASA-N 269.257 -0.186 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@H]1CCSC1=O 270429613 BIHDJPYNJUBUJJ-ZETCQYMHSA-N 297.292 -0.095 5 20 CBBD O=C1CN(CCNC(=O)c2csc([N+](=O)[O-])c2)CCN1 272907508 LDXGQSHAVXTGNG-UHFFFAOYSA-N 298.324 -0.182 5 20 CBBD C[C@H](CO)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 284804304 OUMRRMWTKFTDOE-PSASIEDQSA-N 258.278 -0.535 5 20 CBBD O=C1CC[C@@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])CN1 359031319 XYUDDPHTQZXJLV-SSDOTTSWSA-N 279.256 -0.188 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N(C)C[C@@H](O)CO 361057587 MSESDFGROIAPIL-MRVPVSSYSA-N 258.278 -0.091 5 20 CBBD O=C(CC(=O)NCC1CC1)NCCn1cc([N+](=O)[O-])cn1 427627293 ZDWJGGWWJVHNHT-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD CNC(=O)[C@@H](C)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 530966627 CKKJCEKJESPKOJ-ZCFIWIBFSA-N 288.285 -0.597 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cccc([N+](=O)[O-])c2O)CCOC1 572974586 ZMSPGZDIJVIGHI-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD Nc1nc(=NCc2cc3n(n2)CCCO3)[nH]cc1[N+](=O)[O-] 599100355 GVEIPKSUPSQDRG-UHFFFAOYSA-N 291.271 -0.020 5 20 CBBD O=C(NS(=O)(=O)C[C@H]1CCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 842331538 GGQZUNXDTIUEJU-BWZBUEFSSA-N 278.286 -0.723 5 20 CBBD CNC(=O)CC[S@](=O)CCn1cc([N+](=O)[O-])cn1 1118224719 OEFQNIIUCBUMJZ-SFHVURJKSA-N 274.302 -0.324 5 20 CBBD CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CCN(C)C(=O)C1 1263414835 LHOOUIAFYUYOMJ-UHFFFAOYSA-N 296.331 -0.011 5 20 CBBD NS(=O)(=O)CCCNc1ncc([N+](=O)[O-])cn1 45084080 XDTUIXVRDGALKU-UHFFFAOYSA-N 261.263 -0.525 5 20 CBBD Nc1ccc(C(=O)N[C@@H]2CCC(=O)NC2=O)cc1[N+](=O)[O-] 90020934 ZSUQIAJIJJDVLV-MRVPVSSYSA-N 292.251 -0.288 5 20 CBBD C[C@@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 127109707 MIDSPXJWWJEUPY-ZETCQYMHSA-N 257.250 -0.529 5 20 CBBD C[C@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCO1 174701853 DBILEVYEHUGMJI-ONGXEEELSA-N 270.289 -0.127 5 20 CBBD CN1N=C(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCC1=O 269122455 SSEXZNRTHXLPBY-UHFFFAOYSA-N 294.271 -0.484 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 338423322 MACIPBVUGZEBQP-ZCFIWIBFSA-N 296.326 -0.058 5 20 CBBD C[C@H]1[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCN1C 343565594 RUSZWJHHLGXTAD-IUCAKERBSA-N 282.304 -0.215 5 20 CBBD COc1c(C(=O)N[C@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 356640973 HISLUCLQWQSGHI-QMMMGPOBSA-N 294.267 -0.322 5 20 CBBD O=C(NCCn1ncnn1)c1cc(O)cc([N+](=O)[O-])c1 356799715 HORNJIMMJOQXEG-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD CN(CC(C)(CO)CO)c1nccc(C(N)=O)c1[N+](=O)[O-] 357426612 SXQIXXAKCXRFFU-UHFFFAOYSA-N 298.299 -0.484 5 20 CBBD Nc1c(C(=O)N2C[C@@H](O)C[C@H]2CO)cccc1[N+](=O)[O-] 371526950 UIWMITFQENEBST-YUMQZZPRSA-N 281.268 -0.255 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC(C)(CO)CO 393869896 DOOBHPZYWWQICH-UHFFFAOYSA-N 271.273 -0.346 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1c[nH]nc1[N+](=O)[O-] 554835288 QXVFXKOBMAEVEL-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD COC(=O)c1cc(C)nc(NCc2nn[nH]n2)c1[N+](=O)[O-] 587975197 KYTUJVSUDMGFMO-UHFFFAOYSA-N 293.243 0.210 5 20 CBBD NC1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCCC1 595967228 ORICEIAEEKUHCN-UHFFFAOYSA-N 268.277 -0.426 5 20 CBBD Nc1nc(N2CCCNC(=O)C2)ncc1[N+](=O)[O-] 726787767 WCRSEUIIPXRDLS-UHFFFAOYSA-N 252.234 -0.707 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 738375977 RJZZLVWMDWHNIB-SSDOTTSWSA-N 298.255 -0.438 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC1(CO)COC1 763662008 FLHQQWVYLGUSAO-UHFFFAOYSA-N 271.229 -0.657 5 20 CBBD CNC(=O)NC(=O)[C@H](C)OC(=O)c1c([N+](=O)[O-])cnn1C 766966647 NDPNQMNNUZPIOQ-YFKPBYRVSA-N 299.243 -0.671 5 20 CBBD C[C@@](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)(C(=O)O)C1CC1 827735016 OIFBHUGAXYSGOJ-PWSUYJOCSA-N 298.299 -0.005 5 20 CBBD CC(C)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 839721415 LXYSWNZZSHMVGP-RKDXNWHRSA-N 255.274 -0.269 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C)N1 923285898 HNSUHFXORFMARU-FOGDFJRCSA-N 283.332 -0.166 5 20 CBBD CCN(CCO)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1098366075 VSMOWVMWLXZQPQ-VXGBXAGGSA-N 285.344 -0.043 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N1CCC1 1117604673 RHOSSTPNLMANCX-UHFFFAOYSA-N 267.245 -0.860 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCNC2(CCC2)C1 1261495671 POFICBQBNWSCDI-SECBINFHSA-N 294.315 -0.023 5 20 CBBD CN1C[C@@H](C(=O)O)N(Cc2cccnc2[N+](=O)[O-])CC1=O 1598565594 GQTUJVQJBVTFPR-VIFPVBQESA-N 294.267 -0.283 5 20 CBBD CO[C@]1(C(=O)O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 1599076963 BYAXBBBVUDWEPY-LLVKDONJSA-N 284.272 -0.033 5 20 CBBD O=C(NCC[C@H](O)C(=O)O)c1cccc([N+](=O)[O-])c1O 1608451089 RQNZNHXESXVKGM-QMMMGPOBSA-N 284.224 -0.134 5 20 CBBD NC(=O)NC(=O)COC(=O)COc1ccc([N+](=O)[O-])cc1 9607234 XAVGXEKBWNUOQA-UHFFFAOYSA-N 297.223 -0.288 5 20 CBBD CN(CC(N)=O)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 43272335 XAAZSKHJJBIUJD-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD Cn1cc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 48944741 SGSMMQNEHOCLPW-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1 188520984 QDSALYMFLDKFBB-SECBINFHSA-N 295.299 -0.130 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)C(N)=O 228479611 ACPQFJOPCONTKQ-MRVPVSSYSA-N 267.241 -0.521 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CC[C@H](C(N)=O)O1 268317380 LVAVMOUEFZSSIL-NKWVEPMBSA-N 269.261 -0.227 5 20 CBBD C[C@H]1CC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 331247871 UCCJMWFFCWPAAU-IONNQARKSA-N 282.256 -0.453 5 20 CBBD COC(=O)c1cc(C(=O)NCC(N)=O)cc([N+](=O)[O-])c1 342332624 JWQUSZBUIUDIEJ-UHFFFAOYSA-N 281.224 -0.404 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 350107804 VDMNSHCMRALEQQ-UHFFFAOYSA-N 281.272 -0.268 5 20 CBBD Cc1nn(C)c(NCCn2ncnn2)c1[N+](=O)[O-] 352044765 KNIZQMCMOXQPKP-UHFFFAOYSA-N 252.238 -0.265 5 20 CBBD Nc1c(C(=O)NCC2(CO)COC2)cccc1[N+](=O)[O-] 438216236 OBIYYVINLQCRJT-UHFFFAOYSA-N 281.268 -0.084 5 20 CBBD Cn1cnnc1CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 445188562 IVNSCVGGFYIKLZ-UHFFFAOYSA-N 292.255 -0.204 5 20 CBBD NC(=O)NC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840311778 XXFIPQLFWXHKPW-DJLDLDEBSA-N 270.289 -0.299 5 20 CBBD O=C(NC[C@H]1C[C@@H](NCc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1086084222 IGXCDQWHMJWEAS-JZSSXWJLSA-N 295.299 -0.281 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCCO1 1118228613 VLQPRVMYSVPSFV-ZETCQYMHSA-N 269.261 -0.492 5 20 CBBD O=C(NC1(C(F)F)OCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 1279182200 ZGJWSUKMYXWBLY-RFZPGFLSSA-N 252.173 -0.267 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H]2CNCCO2)c1[N+](=O)[O-] 1326450106 DETXZKFXGDPHJI-QMMMGPOBSA-N 283.288 -0.645 5 20 CBBD NCC[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332449486 GDTJNUYXBRUWNG-SECBINFHSA-N 282.304 -0.226 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1592654930 NJKQSRZCJAIKGR-ZETCQYMHSA-N 283.240 -0.407 5 20 CBBD CN(CCNC(=O)c1ccc([N+](=O)[O-])[nH]1)CC(=O)O 1598493141 QVCDCMGIMZOQDA-UHFFFAOYSA-N 270.245 -0.331 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CCF)C(=O)O 1601386633 FQDYAYYGAWNWGU-ZCFIWIBFSA-N 274.208 -0.280 5 20 CBBD O=C(O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1611471044 NGIWBLPKWUIUIL-SECBINFHSA-N 254.198 -0.171 5 20 CBBD O=C(CO)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 137135833 UYOADLKIYPGFMW-MRVPVSSYSA-N 266.257 -0.005 5 20 CBBD NC(=O)C1(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 152437757 CYTLQWFGEZXSHK-JTQLQIEISA-N 295.295 -0.058 5 20 CBBD C[C@H]1CCNC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 186761189 WRQPJKCGNZPVNQ-ONGXEEELSA-N 294.311 -0.129 5 20 CBBD NC(=O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 227830005 YLRROQWZILPVSO-QMMMGPOBSA-N 270.201 -0.239 5 20 CBBD O=C(CCN1C[C@H](O)[C@H](O)C1)Nc1ccccc1[N+](=O)[O-] 278859163 RXHMSUIAWSLIFG-TXEJJXNPSA-N 295.295 -0.039 5 20 CBBD C[C@@H](NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(N)=O 311399764 FMRHKJAZAGFYFN-RXMQYKEDSA-N 291.260 -0.114 5 20 CBBD Cn1c(C(=O)N[C@H]2CCCNC2=O)ccc1[N+](=O)[O-] 330582328 VDQUJUISFAGBHH-ZETCQYMHSA-N 266.257 -0.058 5 20 CBBD CNC(=O)C1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1 331589024 UNAAQFDEEBISTM-UHFFFAOYSA-N 281.272 -0.545 5 20 CBBD CNC(=O)N[C@@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)C1 332610583 DBBSIDHDJYJZNL-MRVPVSSYSA-N 282.304 -0.168 5 20 CBBD Nc1ncncc1CNC(=O)c1cc([N+](=O)[O-])cnc1N 351732296 XHYNYRMDMLACGU-UHFFFAOYSA-N 289.255 -0.126 5 20 CBBD NC(=O)CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356332560 YUDRKKHEQZMQJX-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 356609692 NWMJVPXJYJNPHC-ZCFIWIBFSA-N 269.261 -0.086 5 20 CBBD C[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H](CO)O1 357711223 XQYXJFSGTRNNAL-SFYZADRCSA-N 296.283 -0.325 5 20 CBBD CN(C(=O)N=c1cc[nH]cc1[N+](=O)[O-])[C@@H]1CCNC1=O 359020339 QHJUTNHKNNNQLF-MRVPVSSYSA-N 279.256 -0.236 5 20 CBBD Nc1nc(N[C@H](CO)C2CCOCC2)ncc1[N+](=O)[O-] 360183155 BNXIXXCXXXCZBV-MRVPVSSYSA-N 283.288 0.166 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1C=C[C@@H](CO)C1 360757193 XQMWUYOHKQREAK-HTQZYQBOSA-N 266.257 -0.005 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@@]1(O)CCOC1 413650976 DXNVDAQGRONGAI-GFCCVEGCSA-N 292.251 0.561 5 20 CBBD CN(CC(=O)N1CCNCC1)Cc1c([N+](=O)[O-])ncn1C 430659602 ZWXRGCMISFYLJN-UHFFFAOYSA-N 296.331 -0.808 5 20 CBBD COc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 450616077 RBTAPTBHALZSMG-QMMMGPOBSA-N 294.267 -0.322 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CO)[C@H](O)C1 564402037 SVHDYGUAUWNNAC-GZMMTYOYSA-N 295.295 -0.008 5 20 CBBD O=C(O)CN1CC[C@@H](n2cnc([N+](=O)[O-])c2)C1=O 596011137 DEZATSDUWPHABN-ZCFIWIBFSA-N 254.202 -0.351 5 20 CBBD CO[C@@H]1COC[C@H]1Nc1ccc(N)c([N+](=O)[O-])n1 596288574 LWMZQQDFVUUYKM-HTQZYQBOSA-N 254.246 0.398 5 20 CBBD CNc1c(C(=O)NC[C@@H](O)C(N)=O)cccc1[N+](=O)[O-] 597586773 PWILKZWJAMQYHA-MRVPVSSYSA-N 282.256 -0.788 5 20 CBBD CCNC(=O)CN(C)CCn1ccc([N+](=O)[O-])n1 610484843 IKHITZKJPKPWAL-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD COC[C@H](O)C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 766142806 BEGFKROIODOTKQ-VIFPVBQESA-N 286.240 -0.693 5 20 CBBD CS(=O)(=O)NC[C@@H]1CCCN(CC[N+](=O)[O-])C1 787731912 UHACBSPQXJGTJK-VIFPVBQESA-N 265.335 -0.476 5 20 CBBD O=C(NCCn1cnnn1)c1cccc([N+](=O)[O-])c1O 807921863 AFJMKUGYXIZEQB-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@]1(F)CCNC1 831411783 IUDUOPGNEHLVPI-JTQLQIEISA-N 271.252 -0.391 5 20 CBBD COC1(OC)CCOC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 912840207 GGAHFBPQGLWEMZ-HLTSFMKQSA-N 274.273 -0.454 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)C(F)F)C1 954240018 KFIUZQWHKVIOBP-RNFRBKRXSA-N 277.227 -0.414 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnns1 990353385 JWOBPMNCALDTBC-RNFRBKRXSA-N 297.296 -0.856 5 20 CBBD O=C(NC1CN(Cc2csnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030292633 PUXSWXCZTGGCAW-RKDXNWHRSA-N 283.313 -0.496 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCS(=O)CC1 1253825030 IFWRKPHGBRBRPK-UHFFFAOYSA-N 258.259 -0.478 5 20 CBBD COC[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@@H](C)O1 1350598043 MBNUIOIUMOXFGK-BDAKNGLRSA-N 285.304 -0.168 5 20 CBBD COCC[C@H]1CNCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1579010104 FJULKABAEGQSSU-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CNC(=O)CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 25604017 MCDOFLBSOCHYKI-UHFFFAOYSA-N 281.224 -0.201 5 20 CBBD CN1CCC(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 37887434 IXETXFGYNFLXPR-LBPRGKRZSA-N 283.332 -0.164 5 20 CBBD CC(C)CNC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 42650120 CKAQYDLISCDTGR-UHFFFAOYSA-N 296.283 -0.372 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)NC1CC1 44680291 FNKSQMUPVDFKKS-UHFFFAOYSA-N 267.245 -0.814 5 20 CBBD C[C@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)N(C)C 45107363 PQWHHYUQFNBSSM-MWLCHTKSSA-N 271.321 -0.308 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CN(C)CCO1 119053888 HVGQNISZXNUILD-ZJUUUORDSA-N 297.315 -0.373 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCCNC1 124181310 DQDOBIRSUSUHLA-VIFPVBQESA-N 267.289 -0.032 5 20 CBBD CN(C(=O)CN(CCO)CCO)c1ccc([N+](=O)[O-])cc1 140182725 WNEPBNNRIYIEEO-UHFFFAOYSA-N 297.311 -0.156 5 20 CBBD NC(=O)[C@@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 176231503 BQYFXURMNYJGAA-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD NC(=O)[C@H](O)CNc1nc2sccn2c1[N+](=O)[O-] 227830780 VQINVEXGQXIUIA-SCSAIBSYSA-N 271.258 -0.438 5 20 CBBD CCN1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 330368628 AEZLRYWTDVMJQH-UHFFFAOYSA-N 268.277 -0.650 5 20 CBBD CCC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 343464085 WIVZLDGFUDZTIG-YFKPBYRVSA-N 255.234 -0.298 5 20 CBBD CC(C)(C(=O)NCCOCCO)n1cc([N+](=O)[O-])cn1 448373499 QMHYTGFOBAAGAD-UHFFFAOYSA-N 286.288 -0.349 5 20 CBBD COC[C@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 565275524 MKRDXXAOYAWDEY-LLVKDONJSA-N 284.272 -0.102 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@H](C)N)c([N+](=O)[O-])n1 592383344 OQTSXXSGBRFAIT-LURJTMIESA-N 277.306 -0.563 5 20 CBBD COC(=O)CN(CCN1CCOCC1)CC[N+](=O)[O-] 798194992 BYXCYOMMMVWGOM-UHFFFAOYSA-N 275.305 -0.930 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@](F)(CO)C1 1116956897 PFSJVHOZEKMDEP-SNVBAGLBSA-N 272.236 -0.125 5 20 CBBD COCC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)OC 1324251415 NZSMDGMDRHKAPB-LURJTMIESA-N 286.244 -0.374 5 20 CBBD NCCN(CCO)C(=O)COc1ccccc1[N+](=O)[O-] 1580308280 UWXLGIAPRZSWTC-UHFFFAOYSA-N 283.284 -0.247 5 20 CBBD COCC(=O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1599140904 GZFSTUCDFGCCDX-UHFFFAOYSA-N 270.197 -0.330 5 20 CBBD CN(CCN1CCNCC1)c1nn(C)cc1[N+](=O)[O-] 231671878 BRWHAKYJCBCMNN-UHFFFAOYSA-N 268.321 -0.330 5 20 CBBD Nc1nc(N2CC(=O)N(C3CC3)C2)ncc1[N+](=O)[O-] 279071473 KCMOYHMMDJUELF-UHFFFAOYSA-N 264.245 -0.265 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@]1(CCO)CCOC1 331348879 UHPAOCSOYWTDMW-GFCCVEGCSA-N 298.299 -0.243 5 20 CBBD CC(=O)N1CC(NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 343278041 SUDZJXACUVZTQO-UHFFFAOYSA-N 253.218 -0.722 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CCC(=O)NC2)c1[N+](=O)[O-] 345862565 LBUMBLWSCNDMEV-ZCFIWIBFSA-N 281.272 -0.111 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1COC[C@H]1O 353360843 MQMZNBSBNBIHCR-DTWKUNHWSA-N 255.230 -0.245 5 20 CBBD CC(C)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 356151898 YIRRZKZBAVALCR-UHFFFAOYSA-N 283.288 -0.027 5 20 CBBD COC(=O)[C@](C)(O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 361674619 RGWJSNMLHSNFLP-LLVKDONJSA-N 298.255 -0.575 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC1 375298905 XTKQMDRYKUNPSA-RKDXNWHRSA-N 253.258 -0.611 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 548407781 CDIUAKUQKIPNBX-LURJTMIESA-N 267.245 -0.345 5 20 CBBD C[C@@H](CCN=c1nc(N)c([N+](=O)[O-])c[nH]1)N(C)C 596424280 FVAKQIUALJXKQS-ZETCQYMHSA-N 254.294 0.141 5 20 CBBD CSc1cccc(C(=O)NC[C@H](O)C(N)=O)c1[N+](=O)[O-] 597585235 IIVHIEZVRKAKSE-ZETCQYMHSA-N 299.308 -0.107 5 20 CBBD O=[N+]([O-])c1cc(S(=O)(=O)N2C[C@H](O)[C@H](O)C2)cs1 768884717 VYBPRYSDYNLXSB-KNVOCYPGSA-N 294.310 -0.618 5 20 CBBD COc1ncc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C(N)=O 839703726 JCGJTGRZWVMCLX-HTRCEHHLSA-N 280.240 -0.207 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1cccnn1 1255910545 YQLBCNAMQFYBFP-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1319888545 STKGTKPGEPGECB-SFYZADRCSA-N 295.299 -0.027 5 20 CBBD O=[N+]([O-])c1cnc(N2CC[C@H](CO)[C@H](O)C2)nc1 1343664504 APNFFIOMIIJCIX-VXNVDRBHSA-N 254.246 -0.436 5 20 CBBD Cc1nc([N+](=O)[O-])c(NC[C@](C)(O)C(=O)O)n1C 1777526182 LIHFRRCTGKCTKM-VIFPVBQESA-N 258.234 -0.116 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1 35160312 OYTCANVSLBXYDJ-SECBINFHSA-N 268.225 -0.142 5 20 CBBD CC(C)(C(=O)NCC(=O)NC1CC1)n1cc([N+](=O)[O-])cn1 102221796 ZVWPGEAKNXQVDK-UHFFFAOYSA-N 295.299 -0.079 5 20 CBBD C[C@@H](O)CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 120638759 FIHWUWQGTRTQEJ-MRVPVSSYSA-N 281.268 -0.178 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCN1 331251578 PKNMWQKTHYJIQP-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD CC(=O)NC[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 344432707 MBVXOVFTAMSBAV-QMMMGPOBSA-N 296.287 -0.692 5 20 CBBD CC(C)C[C@H](CO)NC(=O)Cn1cnc([N+](=O)[O-])n1 348004038 LCILCWDLLZZWKF-MRVPVSSYSA-N 271.277 -0.291 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])o1 354482403 YKKXAUBOXQZWGG-UHFFFAOYSA-N 282.212 -0.531 5 20 CBBD N[C@@H]1C[C@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 575331432 WHJWSATYOSJZES-VHSXEESVSA-N 277.284 -0.262 5 20 CBBD Cn1cc(COC(=O)Cn2cc([N+](=O)[O-])cn2)nn1 759584613 PYUAHTSHAFZTIU-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1 923285409 BJAWIUBBGPUIBC-KOLCDFICSA-N 269.305 -0.554 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2[C@H]3CC[C@H]2CNC3)c1 923398304 KHAHWPLCVLQMLY-NHCYSSNCSA-N 281.316 -0.412 5 20 CBBD COCCCCNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126938763 KEEXPKRDYRDRLZ-NXEZZACHSA-N 259.306 -0.216 5 20 CBBD CN(C(=O)CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 1157760655 GQLVHZFMJYHVCS-GHMZBOCLSA-N 298.343 -0.632 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1326696656 BMZZQFCEVPQKRC-UHFFFAOYSA-N 270.249 -0.681 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCS(=O)(=O)C1 35121754 PKQKLSVLXJDCKV-ZCFIWIBFSA-N 260.275 -0.073 5 20 CBBD O=C(Cn1ccccc1=O)NCCn1cc([N+](=O)[O-])cn1 122752343 GBVIITVNCYEIFR-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 274701150 PYBQUXVJZFVOQF-QMMMGPOBSA-N 284.224 -0.436 5 20 CBBD COC(=O)C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CCO1 287575684 QTIRNMRNOQRRRH-ZETCQYMHSA-N 298.255 -0.278 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 290321891 FBQOEGLQZAYYMZ-UWVGGRQHSA-N 297.267 -0.714 5 20 CBBD C[C@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCOC1=O 291927289 BRCKZMQUYWOMNZ-VIFPVBQESA-N 254.202 -0.247 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)[C@@H](CO)C2)n1 316920408 VJHRVYLALHTHSH-HZGVNTEJSA-N 283.240 -0.523 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCC[C@H]1O 352661009 QEMYBLCNIUGYTB-SDDRHHMPSA-N 284.316 -0.003 5 20 CBBD COC[C@H](CNC(=O)Cn1cc([N+](=O)[O-])nc1C)OC 357913101 BJABRTYKXGBSFT-VIFPVBQESA-N 286.288 -0.123 5 20 CBBD COc1ccc(NC(=O)C(=O)NCCO)cc1[N+](=O)[O-] 360821748 ZGTSJCGDGNQIEB-UHFFFAOYSA-N 283.240 -0.350 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CCN1CCO 428144793 JNSJOGPDXGGDKO-SECBINFHSA-N 297.315 -0.533 5 20 CBBD CN1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C(=O)N1 450615585 QHWODNKNEUQLBK-SECBINFHSA-N 282.231 -0.191 5 20 CBBD COC(=O)C[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 489331189 XIJGHIAICXNJJK-SSDOTTSWSA-N 298.255 -0.278 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 524876100 GGKYZDXWRUYKGR-UHFFFAOYSA-N 252.230 -0.163 5 20 CBBD COCCN1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1=O 596177004 AYHZWPHNHMXRMV-UHFFFAOYSA-N 295.299 -0.133 5 20 CBBD O=C(NC(CO)CO)c1cc2c(cc1[N+](=O)[O-])OCO2 612556495 HRVTYQIQLGWCQA-UHFFFAOYSA-N 284.224 -0.594 5 20 CBBD CC[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 727002406 PVGYFOMCJOENNL-MRVPVSSYSA-N 283.240 -0.436 5 20 CBBD CC[C@]1(C)NC(=O)N(NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 769812228 JHGCMELMECKBMR-JTQLQIEISA-N 296.243 -0.317 5 20 CBBD COCCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839666452 NDVRNRPPBOLDOJ-OPRDCNLKSA-N 257.290 -0.512 5 20 CBBD CCONC(=O)CNC(=O)CCn1cc([N+](=O)[O-])nc1C 846497773 JFLAPVLDVAKDEQ-UHFFFAOYSA-N 299.287 -0.326 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ncc[nH]1 1001777936 SPGWHHYUHMUNBX-RKDXNWHRSA-N 293.283 -0.737 5 20 CBBD CC(C)OC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321286543 FJKGGZQODIZFTB-UHFFFAOYSA-N 256.218 -0.001 5 20 CBBD CC[C@H](C(=O)O)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1350847556 PUOGBBVGWHOIDP-VHSXEESVSA-N 286.288 -0.053 5 20 CBBD CC[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1576655169 SRPDKVBBWTWPTG-LURJTMIESA-N 294.275 -0.114 5 20 CBBD O=C(O)[C@@]1(O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 1601722567 PFKYGDLDDDYTTC-SNVBAGLBSA-N 270.245 -0.687 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)NCC(=O)O 1609796418 BRZBLADLOJDCBE-ZCFIWIBFSA-N 299.239 -0.321 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCOC1 41367352 RYTPLHRTAGEDDZ-MRVPVSSYSA-N 254.246 -0.056 5 20 CBBD O=[N+]([O-])c1ccc(NC(CO)CO)c2nonc12 87753082 SMCPLJHRIKNFCP-UHFFFAOYSA-N 254.202 -0.104 5 20 CBBD CNC(=O)C1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 186177655 YIBKDGSUQMCWKK-UHFFFAOYSA-N 281.272 -0.696 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1n[nH]c2ccc([N+](=O)[O-])cc12 297068763 VEKRCTCHWNVRHI-NXEZZACHSA-N 292.251 -0.039 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1CCn1cc([N+](=O)[O-])cn1 305129911 MMWMSGRCCFTIIA-GXSJLCMTSA-N 270.289 -0.127 5 20 CBBD CN1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1=O 330420756 CZZSMGCMTQMSPF-QMMMGPOBSA-N 295.299 -0.127 5 20 CBBD CC(C)(C(=O)Nc1nn[nH]n1)n1cc([N+](=O)[O-])cn1 345554200 UGUGZHPLWNWUOW-UHFFFAOYSA-N 266.221 -0.322 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H](C)O 354698606 TYFSVQDKGMGFBS-LDWIPMOCSA-N 298.251 -0.047 5 20 CBBD Nc1nc(N2CCO[C@H](CF)C2)ncc1[N+](=O)[O-] 413478006 QUBNDEALMLMFNA-ZCFIWIBFSA-N 257.225 0.142 5 20 CBBD COC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOC1 446621265 BBXBQTMFOLIQAG-NSHDSACASA-N 283.240 -0.015 5 20 CBBD O=C(O)C[C@H]1C(=O)NCCN1CCn1ccc([N+](=O)[O-])n1 833207096 HTWYPTBLRUJYPP-QMMMGPOBSA-N 297.271 -0.934 5 20 CBBD Cn1cc([C@@H](CO)NC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 1319632446 WCTSXBMWHKMPTO-SECBINFHSA-N 294.271 -0.625 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](CO)[C@H]1CCOC1 1339740062 CNJMCQQBMWBTBW-VHSXEESVSA-N 298.299 -0.448 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1COC(=O)C1 1351012086 GOSPXBCCQHGNFC-YFKPBYRVSA-N 254.202 -0.626 5 20 CBBD Nc1nccnc1C(=O)NCCn1cc([N+](=O)[O-])cn1 129991369 ZLBLZPBSDHKLDG-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD NC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 194858240 NTITYIXTXIDTOL-UHFFFAOYSA-N 273.270 -0.252 5 20 CBBD C[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](CO)O1 249386612 RFKFYFQKOKKIBQ-JQWIXIFHSA-N 297.311 -0.162 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1[C@@H]2CNC[C@@H]21 252410402 LLBFREDKXCDSKD-MBTKJCJQSA-N 250.258 -0.119 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCNC1=O 340227049 VLCKQANVMMCKJU-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CCc1[nH]nc(C(=O)NCCc2nc(=O)o[nH]2)c1[N+](=O)[O-] 447633442 ZIOIPZGGAJPQQV-UHFFFAOYSA-N 296.243 -0.471 5 20 CBBD COC(=O)NCC(=O)OCCn1c([N+](=O)[O-])cnc1C 491180503 YPLZTXALLSIJHE-UHFFFAOYSA-N 286.244 -0.001 5 20 CBBD CC(C)NC(=O)OC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 496643524 UABZXPLSBDJNDV-RKDXNWHRSA-N 271.273 -0.003 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccn(CC(N)=O)n1 516527842 PGUPTDKQETXFAU-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD COC(=O)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])o1 538823658 RSZXZLZUNPBIQW-UHFFFAOYSA-N 285.212 -0.793 5 20 CBBD C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@H](CO)O1 559034949 WYDDHVALNSFPAI-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD NS(=O)(=O)CCCn1cc([N+](=O)[O-])cc(F)c1=O 567048118 MPUUVYPNUKYQGQ-UHFFFAOYSA-N 279.249 -0.426 5 20 CBBD Nc1nc(=NC[C@H]2CCCNC2=O)[nH]cc1[N+](=O)[O-] 591183104 KKYSGHVDYDWBHO-ZCFIWIBFSA-N 266.261 -0.673 5 20 CBBD CN1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCC1=O 598294774 IZPAGUVZUGRSHM-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD CC1(C)OC[C@@H](COC(=O)Cn2cnc([N+](=O)[O-])n2)O1 776541960 BVKOHILQLXIGKK-SSDOTTSWSA-N 286.244 -0.119 5 20 CBBD CCNC(=O)C(C)(C)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839707280 BDNXYKVZTKEVAE-HTQZYQBOSA-N 257.290 -0.070 5 20 CBBD O=C(NC1CN(C(=O)c2ccccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991279349 KSGGBHHZHTYZOY-MWLCHTKSSA-N 290.279 -0.313 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1261441513 NSFQNJZGETUCCG-ZCFIWIBFSA-N 295.255 -0.795 5 20 CBBD O=C(NCCn1ccnc1)c1c[nH]nc1[N+](=O)[O-] 1321754265 ZLLMCIUYOYRXLG-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)[C@H]2CCOC2)c1=O 1342569917 LRGWGULNIZYLDW-ZETCQYMHSA-N 295.251 -0.539 5 20 CBBD Cn1nnnc1CCNc1nc(C(=O)O)ccc1[N+](=O)[O-] 1610617765 HQDDFQRDCNVGHJ-UHFFFAOYSA-N 293.243 -0.134 5 20 CBBD CN1C(=O)C[C@@H](Nc2c([N+](=O)[O-])ncn2C)C1=O 115263583 RVFYEORSOMPKIZ-RXMQYKEDSA-N 253.218 -0.503 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 330567341 CRGUHCDMLIVMMM-UHFFFAOYSA-N 255.234 -0.522 5 20 CBBD CC(=O)N1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 330604356 YDLZRAMJUWKQCU-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD O=C1NC[C@H]2[C@@H]1CCCN2C(=O)c1cc([N+](=O)[O-])n[nH]1 343306035 XDGKWHVNDGYGOR-XPUUQOCRSA-N 279.256 -0.332 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H](CO)[C@@H]1CCCO1 344844277 HVCUHRBXBLLZSX-QWRGUYRKSA-N 298.299 -0.163 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H]1COC[C@@H]1O 359659108 SKUIOHZIIKDOEU-BDAKNGLRSA-N 283.240 -0.473 5 20 CBBD COC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])cnc2N)C1 492412260 LRIHWXDIFJCUNS-UHFFFAOYSA-N 295.255 -0.248 5 20 CBBD NC(=O)c1ccnc(N[C@H]2C[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 593496062 YDEIZJNGFGNXTN-OLQVQODUSA-N 279.256 -0.236 5 20 CBBD COC(=O)[C@](C)(CO)NCCn1cc([N+](=O)[O-])ccc1=O 595532528 SVJDWYJQRYHLFA-LBPRGKRZSA-N 299.283 -0.730 5 20 CBBD Nc1c(C(=O)Nn2c(O)nnc2O)cccc1[N+](=O)[O-] 820292077 PAAIAQYHCRBYKX-UHFFFAOYSA-N 280.200 -0.436 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C(=O)O)C2)n1 821298678 WFUXMBKTCRLAMW-ZCFIWIBFSA-N 268.229 -0.125 5 20 CBBD Cn1nnc(NC(=O)CCn2cc([N+](=O)[O-])cn2)n1 1116315071 YQMVSCOCUGGEHN-UHFFFAOYSA-N 266.221 -0.656 5 20 CBBD Cc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])on1 1126932424 XCWVYCODWVPQIO-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD Cc1nc(N2CC(N3CC[C@@H](O)C3)C2)ncc1[N+](=O)[O-] 1329648760 USJRZSSBDVWWSJ-SNVBAGLBSA-N 279.300 -0.052 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1341344032 ZWUJGHHSICGFAL-UHFFFAOYSA-N 299.287 -0.539 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCNC[C@H]1O 1580562412 RRZXPXRIIDIEGL-NWDGAFQWSA-N 295.295 -0.187 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cn1 1601911656 WLDLPDLRPGVPNE-ZETCQYMHSA-N 269.213 -0.445 5 20 CBBD COC(=O)CCNC(=O)Cn1nccc1[N+](=O)[O-] 119724981 SUGBYOFZMUTUJI-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD CN(C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152834447 FOFIJBWUHBQIMF-UHFFFAOYSA-N 263.279 -0.813 5 20 CBBD CC(=O)NC[C@H](C)OC(=O)Cn1ccc([N+](=O)[O-])n1 157290957 URCFQUKQTHDEDF-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD C[C@@H](N)[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])CCO1 231672432 ZHAFFXKQUDKUSG-APPZFPTMSA-N 255.278 -0.119 5 20 CBBD CO[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 267639534 IKCQFSKWNDMRBJ-MNOVXSKESA-N 270.289 -0.127 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@H](O)C1CC1 269094265 IMIQLWFBZKIMJU-JTQLQIEISA-N 283.288 -0.139 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])c(NC(CO)CO)s1 271333664 DYLLARXQPBEBLC-UHFFFAOYSA-N 296.326 -0.175 5 20 CBBD COCCNC(=O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 272373239 DOZPBPCZYOHCBD-UHFFFAOYSA-N 296.283 -0.331 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])nc1C 290419442 MZZLBCQSFIWLTC-IUCAKERBSA-N 284.272 -0.370 5 20 CBBD COC(=O)[C@H](CNc1ncc([N+](=O)[O-])cn1)OC 291626042 BCIMQWAQKZCMEG-ZETCQYMHSA-N 256.218 -0.015 5 20 CBBD O=C1C[C@H](Nc2nccc(C(=O)O)c2[N+](=O)[O-])CN1 311827522 JLABEWVBRYMMEE-YFKPBYRVSA-N 266.213 -0.012 5 20 CBBD O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[C@@H](O)CO 339182421 WLCJOYFAEJPFBB-SECBINFHSA-N 281.224 -0.235 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H](O)C(F)F 355133036 AXQWGGNYNRCLAG-ZETCQYMHSA-N 278.215 -0.076 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](C(N)=O)C(C)(C)C 359507944 YIZLRFBKXCKXLY-MRVPVSSYSA-N 283.288 -0.042 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C(=O)N1 450619338 WOWNPSGNHGJMJW-LURJTMIESA-N 267.245 -0.992 5 20 CBBD CNC[C@@H](O)CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 519660269 ZGZJZTNIXDMBAO-VXGBXAGGSA-N 299.327 -0.496 5 20 CBBD C[C@]1(CO)CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 546103500 CQLVOSLTFGABDJ-VXGBXAGGSA-N 284.316 -0.001 5 20 CBBD C[C@H](CO)CNS(=O)(=O)c1ncccc1[N+](=O)[O-] 594761150 GQOZYGPRZLQJLZ-ZETCQYMHSA-N 275.286 -0.104 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CN(C)CCO1 610907212 FPWHMRMGTLITMF-MWLCHTKSSA-N 297.315 -0.373 5 20 CBBD C=CC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])cn1 732100344 LAYYGUXHMJHZRP-UHFFFAOYSA-N 281.272 -0.400 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NS(=O)(=O)CC1CC1 733704290 SRJFHFQMOYNKJO-UHFFFAOYSA-N 288.285 -0.353 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cccc(C)c1[N+](=O)[O-] 763705438 FKQXNMHYLBYELS-VIFPVBQESA-N 281.268 -0.260 5 20 CBBD COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 787236739 RGPZOBWIFUDRHZ-SNVBAGLBSA-N 296.283 -0.203 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)c1cn(CC(=O)N(C)C)nn1 814042840 OTSUXWKIDISRKN-SSDOTTSWSA-N 285.260 -0.812 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](N2CCOC2=O)C1 855505687 NOKFWASJKSJSCY-SSDOTTSWSA-N 295.255 -0.015 5 20 CBBD CCC(=O)N[C@H]1[C@@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@@H]21 1060373158 WPGZEEPGZXYGTD-MTBHXBHISA-N 292.299 -0.072 5 20 CBBD NC(=O)CC(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1 1097162100 IZRMJPMUKOUEJP-OCAPTIKFSA-N 293.283 -0.076 5 20 CBBD COC(=O)c1ncn(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1322998157 GDHATALXASCQFN-MRVPVSSYSA-N 296.243 -0.770 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@](O)(C(=O)O)C1 1607967609 SXJCTPHTLCORDZ-NSHDSACASA-N 298.255 -0.852 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 54052832 RYLDFGDIGBDVCO-LURJTMIESA-N 256.218 -0.277 5 20 CBBD O=C(O)C[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 129440080 ZOPUFFJDDRUESW-MRVPVSSYSA-N 298.255 -0.507 5 20 CBBD CN(CC(=O)N1CCOCC1)c1ncc([N+](=O)[O-])c(N)n1 263934149 BRUBEHQEGVMROU-UHFFFAOYSA-N 296.287 -0.738 5 20 CBBD CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCNC1=O 281979488 WEQVCIUSYFPMEZ-NSHDSACASA-N 294.311 -0.033 5 20 CBBD C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)S(N)(=O)=O 359569200 XYPQMJCVLOLHEO-YFKPBYRVSA-N 277.258 -0.405 5 20 CBBD NC(=O)c1c[nH]c(C(=O)NCCn2cc([N+](=O)[O-])cn2)c1 492788023 HARYINWOMBQIQP-UHFFFAOYSA-N 292.255 -0.352 5 20 CBBD CNc1nccc(C(=O)NCCC(=O)N(C)C)c1[N+](=O)[O-] 563877805 VEMSSKBZQSXMDC-UHFFFAOYSA-N 295.299 0.240 5 20 CBBD CNc1nccc(C(=O)NC(C)(C)CC(N)=O)c1[N+](=O)[O-] 574216077 AUNCIXCWRDAYOK-UHFFFAOYSA-N 295.299 0.415 5 20 CBBD Cn1cc(COC(=O)Cn2ccc([N+](=O)[O-])n2)nn1 759567277 MSTWKKBORPFELL-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD Cn1nnc(COC(=O)c2ccc([N+](=O)[O-])n2C)n1 799462586 PPJMINMCRQFAJC-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD CC(C)(C(N)=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839697074 PLRAAJWPZOJNEW-RKDXNWHRSA-N 284.316 -0.940 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)CCC(C)(C)[N+](=O)[O-] 854463481 BZSBIOYWJAKVCQ-VIFPVBQESA-N 261.322 -0.139 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1nncn1C 1319729657 PPLADCPHNFPFAN-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD CN(CCCN)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1327601217 JHLKTMFQHVYYBI-UHFFFAOYSA-N 268.273 -0.436 5 20 CBBD CNCCOCCNC(=O)Cn1c([N+](=O)[O-])cnc1C 1578710004 YNKWLCXKZXOZQR-UHFFFAOYSA-N 285.304 -0.548 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)O 1594238254 LSUMRAORQJLMLE-BYPYZUCNSA-N 254.202 -0.225 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCOCN1 1607077333 QUXWSXGJDBRIAX-UHFFFAOYSA-N 278.232 -0.531 5 20 CBBD Cc1noc(CN[C@](C)(CO)C(=O)O)c1[N+](=O)[O-] 1608027891 MSTMBKDIVIBUMA-SECBINFHSA-N 259.218 -0.184 5 20 CBBD CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 66614235 HZUUBAJXUTUEER-UHFFFAOYSA-N 295.251 -0.077 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2O)C1=O 265659048 ALTBLDRZIVRTRO-SECBINFHSA-N 294.267 -0.002 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 275242227 XIEAUMPKSCERIY-SSDOTTSWSA-N 284.224 -0.436 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)c1n[nH]cc1[N+](=O)[O-] 344094386 SZXWLCIRQDCZPN-RQJHMYQMSA-N 279.256 -0.189 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[C@@H](CO)O1 356522140 SEHUYGYKGAUSNR-QWRGUYRKSA-N 298.299 -0.163 5 20 CBBD CNC(=O)[C@@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CCO1 408172421 WAPOQNKSCIABNE-QMMMGPOBSA-N 283.288 -0.412 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC(O)CC1 426976300 WWJNKZPLYNTOKJ-UHFFFAOYSA-N 283.288 -0.042 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NCC(N)=O)c1 505368612 MNBMWLQMTOKGAU-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD O=C(O)Cc1ccc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 574640890 OGVLIHFCWMDTBM-MRVPVSSYSA-N 270.241 -0.013 5 20 CBBD COC(=O)c1nc(=NCCn2cc([N+](=O)[O-])cn2)cc[nH]1 596165846 MPVLGHFLNOXFFZ-UHFFFAOYSA-N 292.255 -0.098 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCNC[C@H]1O 710425546 ZXGXVILSABKBCA-PSASIEDQSA-N 268.273 -0.614 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NN1CCCNC1=O 779446576 MLMSBENRHJPNNY-UHFFFAOYSA-N 296.287 -0.064 5 20 CBBD Nc1ccc(NC(=O)CN2CCOCC2=O)cc1[N+](=O)[O-] 854495789 UIMQAUVTGDREMX-UHFFFAOYSA-N 294.267 -0.026 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1c([N+](=O)[O-])c(C)nn1C 920660881 INXYAMMGGSWHEQ-UHFFFAOYSA-N 299.243 -0.751 5 20 CBBD O=C(c1cc[nH]c1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1011114799 YBMXGBVWBXQQET-GHMZBOCLSA-N 292.295 -0.036 5 20 CBBD COCC(=O)N1CC2(CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 1018686248 WTWUXNHDXDLHIG-NXEZZACHSA-N 297.311 -0.641 5 20 CBBD CCn1ncnc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292288 AZVLNAWPWYWQRZ-NXEZZACHSA-N 294.315 -0.736 5 20 CBBD Cn1cncc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031662089 UMOZOTFFDOTXRT-VXGBXAGGSA-N 293.327 -0.367 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CO)CCF 1118271528 QXBQHMUEXFVGLN-ZCFIWIBFSA-N 260.225 -0.221 5 20 CBBD O=C(NCCNCc1nc(C2CC2)no1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936691 QRXXXSUWNQWHEM-RKDXNWHRSA-N 295.299 -0.182 5 20 CBBD O=C(NCC1OCCCO1)c1n[nH]cc1[N+](=O)[O-] 1320782476 MZPMKXBFRRKWKW-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD COC[C@H](Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)OC 1605054435 DIWPFCJITDURCR-LURJTMIESA-N 283.248 -0.367 5 20 CBBD O=C(N[C@@H](CCF)C(=O)O)c1cc([N+](=O)[O-])n[nH]1 1608397520 ROHLYQMNDDHXLH-BYPYZUCNSA-N 260.181 -0.140 5 20 CBBD Cc1c(C(=O)NCC(=O)NCC(=O)O)cccc1[N+](=O)[O-] 35097268 ZYBCRGMQLZTUMJ-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD C[C@](O)(CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 90275460 ASEWDHVWAOMRER-VIFPVBQESA-N 257.202 -0.512 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 263345538 YXEKHIRTMPZSIH-SSDOTTSWSA-N 283.240 -0.312 5 20 CBBD CC(C)[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 268697829 XOVVHPIRUVPPMH-SNVBAGLBSA-N 283.284 -0.110 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 281232304 PJRXTXKBHWNHNU-SSDOTTSWSA-N 270.245 -0.189 5 20 CBBD C[C@@H](C[S@@](C)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 345568525 LXOYTYVLFXXVAW-ULCDLSAGSA-N 274.302 -0.326 5 20 CBBD C[C@H](CN(C)C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 346238117 ZXBDWHCJTLLIEU-SECBINFHSA-N 282.300 -0.177 5 20 CBBD CSc1cccc(C(=O)NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 597585234 IIVHIEZVRKAKSE-SSDOTTSWSA-N 299.308 -0.107 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 597653161 HKENUBMUSZMQEX-ZETCQYMHSA-N 283.288 -0.776 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)C(C)(C)NS(C)(=O)=O 814045725 YJKKLRAKWUGXGX-LURJTMIESA-N 268.291 -0.477 5 20 CBBD Cc1noc(COC(=O)Cn2ncn(C)c2=O)c1[N+](=O)[O-] 853910532 JHMODYSQCLUNJL-UHFFFAOYSA-N 297.227 -0.470 5 20 CBBD O=C(NC1CCN(Cc2cnon2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1002788058 MKJWKMQOAIBHOY-GHMZBOCLSA-N 295.299 -0.185 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCN(CCCO)C2)C1 1072726010 XELFBUMBVHOUGC-GHMZBOCLSA-N 283.328 -0.432 5 20 CBBD Cn1ccnc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157760749 IGNOMXUGUMHNQU-NXEZZACHSA-N 281.316 -0.319 5 20 CBBD Cn1cnc(C(=O)OCCn2cc([N+](=O)[O-])cn2)n1 1324194047 ZDBPYIKLSVBEJZ-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1344097606 FAKMPLURQBUNCX-RDDDGLTNSA-N 284.272 -0.402 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)CC(N)=O 1344493712 TWINCDTZJGMRAZ-ZETCQYMHSA-N 283.288 -0.130 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 1347018951 PCAZMHUQDIORMP-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)C1(O)CNC1 1574327020 OVVGRWDDFHWCSW-UHFFFAOYSA-N 287.222 -0.177 5 20 CBBD O=[N+]([O-])c1cn(Cc2cc[nH]n2)nc1-c1nn[nH]n1 1593486437 SRYGRIGQEHRRBC-UHFFFAOYSA-N 261.205 -0.257 5 20 CBBD N[C@@H](CC(=O)O)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 1601201208 JNNTZOMIBRMYFI-JTQLQIEISA-N 297.267 -0.108 5 20 CBBD O=C(O)[C@@H]1OCC[C@@H]1NCCn1cc([N+](=O)[O-])cn1 1602202473 CTHMNVAGNXJZEU-DTWKUNHWSA-N 270.245 -0.377 5 20 CBBD Nc1nc(N2C[C@@H](F)C[C@H]2C(=O)O)ncc1[N+](=O)[O-] 1608277418 XCVJYCDTWHVIDV-WHFBIAKZSA-N 271.208 -0.032 5 20 CBBD C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 10057652 UXINUJJBQXJTDP-RXMQYKEDSA-N 252.230 -0.219 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 90275091 KZRGQPBTQDIBOT-SECBINFHSA-N 257.202 -0.512 5 20 CBBD COC[C@H](O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 278092051 QEHANHLPCYHHLQ-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD CN1CCO[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@@H]21 284646705 FXQDGYNOOVLIOE-VHSXEESVSA-N 295.299 -0.137 5 20 CBBD CN(C)c1n[nH]c(NC(=O)c2cc([N+](=O)[O-])[nH]n2)n1 286033952 PHGJOJDSRTWCMZ-UHFFFAOYSA-N 266.221 -0.246 5 20 CBBD Cn1c(C(=O)N[C@H]2CCS(=O)(=O)C2)ccc1[N+](=O)[O-] 330544964 YMGHWLACJXEUEP-ZETCQYMHSA-N 287.297 -0.150 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[C@H](CO)O1 349625532 FDTLIARCIKQEDT-VHSXEESVSA-N 298.299 -0.244 5 20 CBBD Nc1c(C(=O)N2C[C@H](O)C[C@@H]2CO)cccc1[N+](=O)[O-] 371526942 UIWMITFQENEBST-HTQZYQBOSA-N 281.268 -0.255 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O 550216437 XZULGYSFONLJCH-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 566686925 GZDORAWAFXCCNJ-YUMQZZPRSA-N 296.283 -0.206 5 20 CBBD COC(=O)c1ccnc(N2C[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 598629049 BFRNTEONNGPMEN-CBAPKCEASA-N 297.267 -0.434 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 600471281 WENAOHYYCUCBJR-LURJTMIESA-N 271.229 -0.423 5 20 CBBD O=C(NCc1nn[nH]n1)c1ccc([N+](=O)[O-])cc1O 613950788 XEFKQFBVNCQYMI-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD CCN1CCN(Cn2nccc2[N+](=O)[O-])CC1=O 758278158 RZJYGGRDMDAHRM-UHFFFAOYSA-N 253.262 -0.087 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nc(O)n[nH]1 774937020 NHZHOWIDTUKYEF-UHFFFAOYSA-N 282.216 -0.333 5 20 CBBD O=C(O)CNC(=O)COC(=O)c1ccc([N+](=O)[O-])o1 821531027 CFCONCHNUCEDPT-UHFFFAOYSA-N 272.169 -0.455 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 846493407 YTOXUQPMGXAXSE-UHFFFAOYSA-N 283.244 -0.631 5 20 CBBD CC(C)[C@H](O)COC(=O)Cn1cnc([N+](=O)[O-])n1 849704999 RNXVEKAJXYYINC-SSDOTTSWSA-N 258.234 -0.254 5 20 CBBD CN(CCO)Cc1cn(CC(C)(C)[N+](=O)[O-])nn1 864641995 GDWRLSYFAHBSOP-UHFFFAOYSA-N 257.294 -0.243 5 20 CBBD O=[N+]([O-])CCN[C@H]1CCN(CCN2CCOCC2)C1 905122692 TZMVFVIBIOZKFR-LBPRGKRZSA-N 272.349 -0.741 5 20 CBBD NS(=O)(=O)N1CCN(c2cccnc2[N+](=O)[O-])CC1 917038527 HDYUUMZFDNJJAN-UHFFFAOYSA-N 287.301 -0.685 5 20 CBBD COCC(=O)N1CCC(C)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 956369277 PPBOUPQZNSWMQN-NXEZZACHSA-N 299.327 -0.205 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@H]2C[C@]2(CO)C1 1320586858 LCFVDTVKAHICJX-RDDDGLTNSA-N 266.257 -0.217 5 20 CBBD C[C@@H](NC(=O)c1cnc(N)c([N+](=O)[O-])c1)C(=O)O 1574658264 JIKQLYFLPCKCRE-SCSAIBSYSA-N 254.202 -0.225 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@@H](O)C2)cc1-c1nn[nH]n1 1607082915 WOBIKFSMAWGVEA-UWVGGRQHSA-N 292.255 -0.683 5 20 CBBD O=C(O)[C@@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 90262974 OOBCYNQJBHKPDJ-QMMMGPOBSA-N 290.253 -0.681 5 20 CBBD COC[C@H](CCO)NC(=O)Cn1ccc([N+](=O)[O-])n1 229799501 JFJVMTZBNXEYES-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD O=C(Nc1ccc([N+](=O)[O-])cc1)NC(CO)(CO)CO 236488219 LVXZIDBLWXKFGM-UHFFFAOYSA-N 285.256 -0.568 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 265041732 WOEDLFQECREMAX-MRVPVSSYSA-N 297.267 -0.176 5 20 CBBD CN1CC[C@@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 265657946 NZHJUXFRBIUGMW-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD NC(=O)COCCNC(=O)COc1ccc([N+](=O)[O-])cc1 268643996 PQVSHPWPBJIYAJ-UHFFFAOYSA-N 297.267 -0.408 5 20 CBBD COc1cc(C(=O)NCC(=O)NCCO)ccc1[N+](=O)[O-] 269547376 NEOSAEZNWOJSBN-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 286229881 YEMHYMNHIDQXLC-UHFFFAOYSA-N 253.218 -0.864 5 20 CBBD CCc1nn(C)c(N2CCC(O)(C(N)=O)CC2)c1[N+](=O)[O-] 314478140 BTQGVKVXNPOPFK-UHFFFAOYSA-N 297.315 -0.293 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343684178 CFLJYJNDUHBKQR-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCN([C@H]2CCNC2)CC1 352495765 ONMSLSOQNNICLO-NSHDSACASA-N 294.359 -0.192 5 20 CBBD CCc1[nH]nc(C(=O)N(CCO)CCOC)c1[N+](=O)[O-] 444332118 YOZMXEKPBUMCSU-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@H](CO)[C@@H](O)C1 561784855 NAQOLDHVJGWQRK-PWSUYJOCSA-N 297.311 -0.568 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@]12CCNC2 574037256 JSAVBXOPMYYDJF-JQWIXIFHSA-N 279.300 -0.093 5 20 CBBD Nc1ccc(N2CCN3C(=O)[C@@H](N)C[C@H]3C2)nc1[N+](=O)[O-] 596013650 ITVYQHDBMIGKBY-CBAPKCEASA-N 292.299 -0.680 5 20 CBBD CS(=O)(=O)C1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 596221965 IBOGSNHQELBXTN-UHFFFAOYSA-N 299.308 -0.073 5 20 CBBD C[C@@]1(CO)CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@]1(C)CO 599165953 WQEGKCITLHJURR-TXEJJXNPSA-N 297.315 -0.216 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)c3c([N+](=O)[O-])cnn3C)C[C@@H]21 599998896 AXTPOCRQFRFKFA-MBTKJCJQSA-N 279.300 -0.040 5 20 CBBD COC[C@H](CO)NS(=O)(=O)c1csc([N+](=O)[O-])c1 795281302 DKRMKNLNVSVQNC-LURJTMIESA-N 296.326 -0.058 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CN2C[C@H](O)[C@@H](O)C2)cc1 859455261 AJOVJWJPFDTTKD-WOPDTQHZSA-N 268.269 -0.334 5 20 CBBD CC[C@@H](CN1CCOCC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 928646338 JWOQEGDVBGHJIE-HBNTYKKESA-N 271.317 -0.121 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cn[nH]c1 973058760 XTTPPFXLHWMMRZ-ZYUZMQFOSA-N 293.283 -0.548 5 20 CBBD Cc1n[nH]cc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991286681 DRJNORKOXPSJHE-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD O=C(NCC1CN(C(=O)C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001809088 WIQWEWHWCUPKFS-NXEZZACHSA-N 267.285 -0.364 5 20 CBBD Cc1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)on1 1030291900 MSDJUCYADRSONM-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1cc(C)c([N+](=O)[O-])cn1 1100705919 CDRQNGQRBKZRMD-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD O=c1c([N+](=O)[O-])cn(CCN2CCOCC2)cc1[N+](=O)[O-] 1333432026 XWAGRPJXIWLYMI-UHFFFAOYSA-N 298.255 -0.003 5 20 CBBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H](N)CC(N)=O 37810264 ZKOZFUJLDLDGIY-VIFPVBQESA-N 280.284 -0.244 5 20 CBBD CC[C@H](CO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 37888175 OHTZDYFKOQFSTR-PSASIEDQSA-N 258.278 -0.487 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H](O)CN1 238091412 BKHUZGBWWUCNBF-ONGXEEELSA-N 294.311 -0.154 5 20 CBBD CC(=O)C[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 273418886 XFTXPSGJPOULSH-JTQLQIEISA-N 296.283 -0.002 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 275436406 BFWVVZTXIMPVDB-IONNQARKSA-N 298.255 -0.544 5 20 CBBD C[C@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCOC1 330666221 WISDZALNXBIKCJ-JTQLQIEISA-N 269.261 -0.128 5 20 CBBD CS(=O)(=O)CCCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 425266180 ZSRSXXHCLYWACW-UHFFFAOYSA-N 289.317 -0.374 5 20 CBBD O=C(NC[C@@]1(O)CCSC1)c1c[nH]nc1[N+](=O)[O-] 558757534 HTOODHAWWNOURY-VIFPVBQESA-N 272.286 -0.084 5 20 CBBD CN(C)[C@H]1CN(Cc2c([N+](=O)[O-])ncn2C)C[C@@H]1O 565370795 MCAQQRRFEUYNMH-WPRPVWTQSA-N 269.305 -0.565 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2OCCN[C@H]2C1 572167425 FKQVVJJNULWEMU-GXSJLCMTSA-N 281.316 -0.109 5 20 CBBD O=C1C[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)CN1 577007059 UBKRJSLTNXWZCD-ZCFIWIBFSA-N 262.229 -0.062 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](CO)[C@H](O)C2)n1 581491448 TYHLFBNFAIHMGM-OIBJUYFYSA-N 297.267 -0.133 5 20 CBBD Nc1nccc(C(=O)N[C@H](CO)CCF)c1[N+](=O)[O-] 594373421 TUDWAENPQPKZTN-LURJTMIESA-N 272.236 0.022 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1C[C@@H]2CNC[C@H]2C1 611185730 VVBXUHYJWPPJDA-QWRGUYRKSA-N 278.312 -0.092 5 20 CBBD COc1c(C(=O)OCC(=O)NC(N)=O)cccc1[N+](=O)[O-] 796308070 BZEHEMUJYBWBRQ-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD O=C(NCC1=CCN(CCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1000673609 HMKZZXFTFMDEQW-GHMZBOCLSA-N 269.301 -0.608 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ccc(F)cc1[N+](=O)[O-] 1100294823 QTFXQHKGGYYZKI-UHFFFAOYSA-N 284.247 -0.228 5 20 CBBD C[C@@H](N)C[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118271019 SXNCMJCLCRUKMV-RKDXNWHRSA-N 282.300 -0.002 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC2CC1(C(=O)O)C2 1350322016 HXJFUCAFYSOAKJ-UHFFFAOYSA-N 281.228 -0.738 5 20 CBBD COC(=O)[C@H](CO)NC(=O)Cc1cccc([N+](=O)[O-])c1 135861801 VFKMWTNVGDRPJV-JTQLQIEISA-N 282.252 -0.213 5 20 CBBD Cc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 227869855 RUDGKAQTDHOOTO-SECBINFHSA-N 267.241 -0.521 5 20 CBBD NC(=O)CNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 272730001 LFSNGDUREPTNFA-SNVBAGLBSA-N 292.251 -0.311 5 20 CBBD C[C@H](O)CN(CCO)CCn1cc([N+](=O)[O-])ccc1=O 289738510 JKPINJNVOOHFKC-JTQLQIEISA-N 285.300 -0.568 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1COC[C@H]1O 353360845 MQMZNBSBNBIHCR-RKDXNWHRSA-N 255.230 -0.245 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@H](C)CN1 356926267 SQLGKBIEJOVXFQ-VHSXEESVSA-N 294.311 -0.035 5 20 CBBD CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H]1OC 362767610 ZJTKVSODMDHICL-RKDXNWHRSA-N 284.272 -0.186 5 20 CBBD O=C1CCCN1CCNc1ncc([N+](=O)[O-])cn1 405400138 QDDYZVKJGPMFBE-UHFFFAOYSA-N 251.246 0.419 5 20 CBBD NCCNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1 428736451 HNWRXCWFCQAQEX-MRVPVSSYSA-N 296.283 -0.133 5 20 CBBD C[C@@H]1CN(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 523715197 VDXQYQUSTLTJRO-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 565726496 YOGXGOUEUYSWPF-NSHDSACASA-N 284.272 -0.301 5 20 CBBD Cc1nn(C)c(N2CC[C@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 583476686 RZJCKVMRMQVCKP-BDAKNGLRSA-N 270.289 -0.184 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1C[C@H](F)C[C@H]1C(N)=O 585786546 RUVTXVDHTBVRGP-RITPCOANSA-N 257.225 -0.270 5 20 CBBD CNC(=O)[C@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843109837 HFVUUXZECYCNJO-GHMZBOCLSA-N 283.284 -0.675 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cc1F 1100294620 FZUGOIRPHWJUIH-UHFFFAOYSA-N 284.247 -0.228 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 1261494990 MUZGEULUIKTVGE-JGVFFNPUSA-N 268.277 -0.557 5 20 CBBD Cc1noc(COC(=O)C2(CO)COC2)c1[N+](=O)[O-] 1327706786 BCQONFMGEGHYSG-UHFFFAOYSA-N 272.213 -0.057 5 20 CBBD C[C@@H]1[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CCS1(=O)=O 1329102934 QWVPSXFFLXSEEE-PHDIDXHHSA-N 288.285 -0.377 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC(OCCO)CC1 1341684126 NPQKCEKUJYLXDL-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD C[C@@H](O)[C@@H](CO)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1591731423 GTTMQRFDRZUXBM-LHLIQPBNSA-N 294.271 -0.072 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 1602190771 HBZVVTTYHMCWSS-APPZFPTMSA-N 296.235 -0.040 5 20 CBBD O=C(O)[C@H]1CNCCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1608646754 UOEOPZSYNYPMQW-SSDOTTSWSA-N 283.244 -0.793 5 20 CBBD CC(=O)NCCCn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1609621321 AHDVGWHCGNDRNU-UHFFFAOYSA-N 283.240 -0.019 5 20 CBBD O=C(O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 11804458 ODRNWXKZYMBRBO-UHFFFAOYSA-N 260.227 -0.042 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCN1CCOC1=O 52034877 XOVPVCBOLNOQBD-UHFFFAOYSA-N 285.216 -0.818 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CN(C)CCO1 119054084 HVGQNISZXNUILD-NXEZZACHSA-N 297.315 -0.373 5 20 CBBD Cn1c(C(=O)NC[C@@H]2CNCCO2)ccc1[N+](=O)[O-] 134255612 XTAFYVFQGYBXSR-QMMMGPOBSA-N 268.273 -0.349 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 282142471 JLCZQRJKISCUCL-HZGVNTEJSA-N 294.267 -0.050 5 20 CBBD Cn1cncc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 291305077 SRSJPHVHHLCSSU-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD Cn1c(C(=O)NCCCC(N)=O)ccc1[N+](=O)[O-] 347657354 SIBXBKWCXAWVGB-UHFFFAOYSA-N 254.246 -0.071 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[C@H](CO)O1 356522143 SEHUYGYKGAUSNR-WDEREUQCSA-N 298.299 -0.163 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 362357372 FKLIRLYUOQEISJ-APPZFPTMSA-N 297.267 -0.083 5 20 CBBD C[C@H]1[C@@H](C)NCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 434672742 ZLVFBTOWZHVGEA-SFYZADRCSA-N 268.277 -0.605 5 20 CBBD C[C@@H](CN)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 441617725 DETIRZWUSFTODC-QMMMGPOBSA-N 268.273 -0.533 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](COC)OC)c1[N+](=O)[O-] 563390820 XGLRCHIWYTUFLN-QMMMGPOBSA-N 298.299 0.423 5 20 CBBD Nc1ccc(N2CC[C@@H](CO)[C@@H](O)C2)nc1[N+](=O)[O-] 596207974 UDFSAPXFGRWXCG-CBAPKCEASA-N 268.273 -0.249 5 20 CBBD CCN(CCN)S(=O)(=O)c1cccnc1[N+](=O)[O-] 599105836 FZCMSDVIHFISEZ-UHFFFAOYSA-N 274.302 -0.041 5 20 CBBD NC(=O)c1cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)n[nH]1 610872297 ARYHFEYKHQNXLV-UHFFFAOYSA-N 293.243 -0.358 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CCCNC1=O 619867888 LMUGMZVPDJZKKV-SECBINFHSA-N 295.299 -0.258 5 20 CBBD C=CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 732101615 JARBGHQQZNJXMN-UHFFFAOYSA-N 252.230 -0.045 5 20 CBBD NC(=O)c1cn(CCOC(=O)c2ccc([N+](=O)[O-])[nH]2)nn1 805945170 IVWHNCONNJCXOP-UHFFFAOYSA-N 294.227 -0.530 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nn1c(O)nnc1O 820281779 HDLAPOQQYQHHTK-UHFFFAOYSA-N 279.212 -0.090 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 833291499 WOVFSBSGMGRJID-SFYZADRCSA-N 270.245 -0.689 5 20 CBBD CN(CC(=O)N1CCCC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839473593 DHSLFCUKFAZCIJ-RKDXNWHRSA-N 255.274 -0.268 5 20 CBBD O=C(NS(=O)(=O)CC1CCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 842328574 ZNZLBLKQZRJGSO-HTQZYQBOSA-N 262.287 -0.102 5 20 CBBD CNC[C@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 843081721 UQTALSYGTDQZQI-RYUDHWBXSA-N 269.301 -0.202 5 20 CBBD CCOCCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1124691505 SZPXJTIZPCDCHG-UHFFFAOYSA-N 299.331 -0.039 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)CCN1C(=O)CCC1=O 1324085006 JIMDBLAAMKHQFK-UHFFFAOYSA-N 295.255 -0.194 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 1337497043 YYUYUCQTFOJTIT-LURJTMIESA-N 280.248 -0.808 5 20 CBBD CO[C@H]1CN(c2nnc(CCC[N+](=O)[O-])n2C)C[C@H]1OC 1519567205 WGNPSXOVCOLGRA-AOOOYVTPSA-N 299.331 -0.126 5 20 CBBD O=C(O)CCNC(=O)COc1cccnc1[N+](=O)[O-] 1602022593 GCXIEUNMZNFTCN-UHFFFAOYSA-N 269.213 -0.041 5 20 CBBD C[C@H](O)C[C@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 129988027 SXTUWEBTNJZEPT-YUMQZZPRSA-N 283.288 -0.057 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1c1ncc([N+](=O)[O-])c(N)n1 131862372 MFTYYYZIPPOOFA-RQJHMYQMSA-N 269.261 -0.447 5 20 CBBD C[C@H]1CN(C(=O)Cn2ncc([N+](=O)[O-])c2N)CCO1 177760352 FKZRRWNUWVPEMB-ZETCQYMHSA-N 269.261 -0.379 5 20 CBBD C[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 184927139 QNSXIIRTSDWPOB-RXMQYKEDSA-N 253.214 -0.096 5 20 CBBD NC(=O)c1ccc(N[C@@H]2CNC(=O)C2)c([N+](=O)[O-])c1 225823871 JIQOMWSKEGWSFX-ZETCQYMHSA-N 264.241 -0.006 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)O 262462124 XUHCZPPKCAVXQR-LLVKDONJSA-N 283.240 -0.258 5 20 CBBD CCOC[C@@H](O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 311743976 SGTQRRWGTUSXON-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD CN(C(=O)Cn1cnnn1)c1ccc([N+](=O)[O-])nc1 344203308 WEPHVCXBEDQEOH-UHFFFAOYSA-N 263.217 -0.361 5 20 CBBD C[C@@H]1C[C@H](O)CN1C(=O)NCCn1cc([N+](=O)[O-])cn1 349594850 BFVJEMJOYAOELT-SCZZXKLOSA-N 283.288 -0.044 5 20 CBBD O=C1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CN1 353939580 ONBWXOLPIRWEBF-MRVPVSSYSA-N 279.252 -0.022 5 20 CBBD COC[C@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCCN1 357257086 LKXNPRNECXTZCB-GFCCVEGCSA-N 297.315 -0.324 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H](O)C[C@H]1CO 363705912 YWKVQNKSWNJYEW-VHSXEESVSA-N 296.279 -0.072 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)OC[C@H]2C1 378162826 XFUNZIGRADZTLN-SECBINFHSA-N 295.255 -0.546 5 20 CBBD NC[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 428627637 XYNQSAMKZXXAOP-SECBINFHSA-N 267.289 -0.011 5 20 CBBD N[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 429061098 CBGONQOMLCSXSB-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD Cn1nnc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)n1 490605763 WITSHWINFJAUDC-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD COc1ccc(CC(=O)NCC(N)=O)cc1[N+](=O)[O-] 518801037 WPIRFYGLZOOSRG-UHFFFAOYSA-N 267.241 -0.253 5 20 CBBD O=C(NCc1nn[nH]n1)c1cc2c(c([N+](=O)[O-])c1)OCO2 611513983 AXDGMMOPECTACG-UHFFFAOYSA-N 292.211 -0.233 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCOCCO 740219811 ZANGAWNJLAQRON-UHFFFAOYSA-N 259.218 -0.657 5 20 CBBD C[C@H](OC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 744927460 MFOXVRLAMSWSKI-LURJTMIESA-N 270.245 -0.057 5 20 CBBD CNC(=O)[C@@H](O)CNc1nc2ccccn2c1[N+](=O)[O-] 758113493 ITTURVWZCQOVBF-ZETCQYMHSA-N 279.256 -0.239 5 20 CBBD CCOCC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 777040788 FFCXUZOPFLRJAQ-UHFFFAOYSA-N 271.229 -0.060 5 20 CBBD Cc1[nH]nc(C(=O)N[C@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 832847723 QWEZUFWBXFRSDQ-SNVBAGLBSA-N 284.228 -0.400 5 20 CBBD CC(=O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840414772 FNXYOIGWLNJKTG-OPRDCNLKSA-N 256.258 -0.142 5 20 CBBD C[C@H]1CO[C@H](C)CN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 855405960 BFKGWKHOGUUEHD-LNFKQOIKSA-N 271.317 -0.123 5 20 CBBD CCc1nc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])no1 1157761122 NQSRQIVGXWXFMN-RKDXNWHRSA-N 297.315 -0.107 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CNCCCO1 1326170117 UUMXTKYKMRDNME-JTQLQIEISA-N 297.315 -0.406 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1339894220 NJGBSXDXZHWCEA-HTRCEHHLSA-N 281.272 -0.417 5 20 CBBD CCn1nncc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1348478408 JBOKTGZPOAKSAK-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD CNC[C@@H](C)NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 1350332308 ROXZPOBIGYQODI-SECBINFHSA-N 294.311 -0.065 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@](C)(CO)C(=O)O 1600748321 LDYUDHKRAFIXRF-SNVBAGLBSA-N 286.244 -0.948 5 20 CBBD C[C@]1(C(=O)O)CN(CCn2ccc([N+](=O)[O-])n2)CCO1 1776507253 CVWAEZKQJBAPCX-LLVKDONJSA-N 284.272 -0.033 5 20 CBBD NS(=O)(=O)c1ccc(NCc2ncn[nH]2)c([N+](=O)[O-])c1 138702261 WZYWIODHUSQBRX-UHFFFAOYSA-N 298.284 -0.028 5 20 CBBD O=C(Cn1cn[nH]c1=O)Nc1cc([N+](=O)[O-])ccc1O 156883690 WCKANRVUYAUUBA-UHFFFAOYSA-N 279.212 -0.176 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NCCn1ccc([N+](=O)[O-])n1 193582957 CLNPGVMBYWRBEK-WCBMZHEXSA-N 267.289 -0.095 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228705373 UIZXXISQDNJTSE-LDYMZIIASA-N 284.272 -0.553 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 280895834 DXWHRCSMODPDIW-LBPRGKRZSA-N 295.299 -0.224 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C(=O)N(C)C 330556202 GXWYKSPFFHZHGX-SSDOTTSWSA-N 283.288 -0.307 5 20 CBBD Cc1nc(=NC(=O)c2cc([N+](=O)[O-])n[nH]2)n(C)[nH]1 356025188 PLLBYWCHJSIVCS-UHFFFAOYSA-N 251.206 -0.571 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@H](O)C[C@@H]1CO 357643485 LPXCRIKXPNONPM-MWLCHTKSSA-N 282.252 -0.132 5 20 CBBD NC[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 358512676 HVBZCOAHDNPUTN-SNVBAGLBSA-N 283.288 -0.633 5 20 CBBD CN(CC(N)=O)C(=O)c1ccc(O)c([N+](=O)[O-])c1 436946227 ABWKRTKDYOABPW-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cccc(OC)c1[N+](=O)[O-] 444311220 DPDFKRBCDGZERO-QMMMGPOBSA-N 298.251 -0.133 5 20 CBBD COC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCOC1 446631209 KJKOTXMKYMJZTL-NSHDSACASA-N 283.240 -0.015 5 20 CBBD CN1CC[C@@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@@H]21 450787119 IAJMCDOUYKHLLM-APPZFPTMSA-N 264.289 0.107 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@@H](CO)[C@@H](O)C1 565929260 IXYFJRVCZPOZPQ-ONGXEEELSA-N 298.299 -0.617 5 20 CBBD Cc1nn(C)c(NC[C@](C)(O)C(=O)O)c1[N+](=O)[O-] 576469300 PBSCAZWZXPVAHM-VIFPVBQESA-N 258.234 -0.116 5 20 CBBD C[C@@H]1CNCCN1S(=O)(=O)c1cccnc1[N+](=O)[O-] 578892406 UPYRSMZLBWGHGI-MRVPVSSYSA-N 286.313 -0.028 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 588863769 KHQRDTXQQWZOFE-MRVPVSSYSA-N 299.331 -0.077 5 20 CBBD C[C@H](O)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 611932531 AGDOEZFFWVFREM-ZETCQYMHSA-N 275.286 -0.009 5 20 CBBD CN1CCN(C(=O)CNc2ncc([N+](=O)[O-])cn2)CC1 760518633 ADMYOOXJOLVCFX-UHFFFAOYSA-N 280.288 -0.429 5 20 CBBD CCS(=O)(=O)NCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840671254 SEXZLQNYJUZBDI-RNFRBKRXSA-N 266.275 -0.866 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)[C@@H](CN)C1 843357092 CEOHGBWOGSXOQF-JTQLQIEISA-N 293.327 -0.108 5 20 CBBD Cc1cc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 991280342 PNIFAEBIZSUFLI-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCOC2(CN(CCF)C2)C1 1053253414 JGLPYIZHBHMVEK-NXEZZACHSA-N 287.291 -0.466 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCc1ccno1 1322578411 PMSAPFUGTGROHQ-UHFFFAOYSA-N 253.174 -0.082 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@H]2CCNC2=O)c1[N+](=O)[O-] 1324502013 JWMFRQBETCNWPP-LURJTMIESA-N 267.245 -0.413 5 20 CBBD O=[N+]([O-])c1cccnc1S(=O)(=O)N1CC2(CCNC2)C1 1580875991 VLTRORKBCJSMIJ-UHFFFAOYSA-N 298.324 -0.026 5 20 CBBD CN1CCN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C[C@@H]1CO 1598623152 YRYIHMIROAHPSL-MRVPVSSYSA-N 296.283 -0.199 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)Cn1cc([N+](=O)[O-])cn1 46884490 FYRFFJUVKSIKCL-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD COC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 71264793 UDYCEMNMOYIOPY-SSDOTTSWSA-N 271.229 -0.980 5 20 CBBD NC(=O)[C@@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1 76267122 IVCODPVRMZSGIU-YFKPBYRVSA-N 252.234 -0.579 5 20 CBBD C[C@@H](CN(C)C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 168903959 IAHNYXZGBHSHDT-ONGXEEELSA-N 271.321 -0.308 5 20 CBBD NS(=O)(=O)c1ccc(NC[C@H](O)CO)c([N+](=O)[O-])c1 270967464 PMSFWBDDPOFYJV-LURJTMIESA-N 291.285 -0.993 5 20 CBBD CN(CCC(N)=O)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 343459209 ZWSAVRCLVIWSRR-UHFFFAOYSA-N 283.288 -0.140 5 20 CBBD NC(=O)Cn1ccc(NC(=O)c2ccccc2[N+](=O)[O-])n1 343805957 PCZGXRVUOOZIKU-UHFFFAOYSA-N 289.251 0.529 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@H]1CCCO1 344883234 SMOGOUZOOGPECW-IONNQARKSA-N 284.272 -0.402 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCn1cncn1 350397761 ZETBHNWXCVUNFA-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD Cc1noc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 350682554 PRISWJRDUWKFSD-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD NC[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 358512672 HVBZCOAHDNPUTN-JTQLQIEISA-N 283.288 -0.633 5 20 CBBD COC(=O)C1(C)CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 425165209 SCFFIIKILUMHQZ-UHFFFAOYSA-N 282.256 -0.037 5 20 CBBD Cn1cc(C(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)cn1 427573565 KJZPHCWKPXVPEA-UHFFFAOYSA-N 292.255 -0.476 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 594330629 FWBYSKLSUYKGAT-SFYZADRCSA-N 296.283 -0.401 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC1CC(CO)(CO)C1 599178840 KKUDQSMBMUUDKF-UHFFFAOYSA-N 256.262 -0.126 5 20 CBBD Nc1nccc(C(=O)N[C@H]2C[C@H](C(N)=O)C2)c1[N+](=O)[O-] 600315826 WBXAJKWYMYBNAI-OLQVQODUSA-N 279.256 -0.434 5 20 CBBD O=[N+]([O-])c1cnn(CCNC[C@@H](O)CN2CCCC2)c1 600727779 MLRPACCGCJCHKP-GFCCVEGCSA-N 283.332 -0.162 5 20 CBBD CN1C(=O)NCC12CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2 819756823 OZTLQYGCAGIGTI-RKDXNWHRSA-N 282.300 -0.332 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)Nn1c(O)nnc1O 820289570 YFHKSHKFZRZSMI-UHFFFAOYSA-N 280.200 -0.436 5 20 CBBD CN(C)C(=O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821578177 QYGHTKACCANWOT-UHFFFAOYSA-N 292.259 -0.330 5 20 CBBD O=C(O)NCC(=O)OCCn1ccc([N+](=O)[O-])n1 832401616 ABLBCCGWDJECRK-UHFFFAOYSA-N 258.190 -0.398 5 20 CBBD O=C(NC1CN(Cc2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030292533 NFMQEXJGDFFDTA-NXEZZACHSA-N 266.257 -0.360 5 20 CBBD CCONC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1118270847 CIOHASCUPYUYFW-UHFFFAOYSA-N 257.206 -0.885 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1319869651 FZDFMUKMPBNORK-ZCFIWIBFSA-N 269.261 -0.499 5 20 CBBD COCCN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1=O 91839400 IRQJINOQUQETKS-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD CNC(=O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 159901168 FDJBMGNUTYRWPF-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1Cn1cc([N+](=O)[O-])cn1 172610296 HERURBVVZAIZEE-QMMMGPOBSA-N 274.302 -0.132 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 282142478 JLCZQRJKISCUCL-RCOVLWMOSA-N 294.267 -0.050 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@@H](O)C1 299494090 JDSWNFGTAKRHHU-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD Nc1nc(NCC2(O)CCOCC2)ncc1[N+](=O)[O-] 301192320 MCZZRVKQOHUTTK-UHFFFAOYSA-N 269.261 -0.080 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1nnc2ccccn12 352655648 UYGWNMYBQAWVSS-UHFFFAOYSA-N 288.227 -0.132 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCCn1cc(CO)nn1 357589776 CNUKJZLLVAEWIL-UHFFFAOYSA-N 281.276 -0.086 5 20 CBBD CC(CO)(CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 357750220 VYYKJVPFBHMMAW-UHFFFAOYSA-N 270.245 -0.955 5 20 CBBD COc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 537579109 QQCGFAUORLEAQA-MRVPVSSYSA-N 294.267 -0.322 5 20 CBBD O=C(CN1CCNCC1=O)Nc1cc([N+](=O)[O-])ccc1O 566251739 WRZXNDHYANKXRG-UHFFFAOYSA-N 294.267 -0.329 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1[C@H]2CC[C@H]1CNC2 595998136 XJENPKNCQZQMRB-IUCAKERBSA-N 265.273 -0.246 5 20 CBBD CCOC(=O)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 597675283 YCIITSVXYDXGHB-LURJTMIESA-N 286.244 -0.638 5 20 CBBD COC(=O)c1cnc(N2C[C@@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1 598630581 ZPWFRCLWVMZDEF-WCBMZHEXSA-N 297.267 -0.434 5 20 CBBD NC(=O)NCCCOC(=O)Cn1ccc([N+](=O)[O-])n1 744147028 IKLYTOJOVZLKBU-UHFFFAOYSA-N 271.233 -0.607 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@H]1COC(=O)O1 763930711 IXAWLBQXQVWLOQ-LURJTMIESA-N 271.185 -0.130 5 20 CBBD COCCNC(=S)NCCn1cc([N+](=O)[O-])cn1 768480994 VTZVITUSIWTNKK-UHFFFAOYSA-N 273.318 -0.098 5 20 CBBD CS(=O)(=O)CCNC(=O)c1c(N)cccc1[N+](=O)[O-] 779479686 NTKWLXBYRBXTCI-UHFFFAOYSA-N 287.297 -0.049 5 20 CBBD O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 862580912 BAJWAUGOLAWQMK-UWVGGRQHSA-N 297.223 -0.319 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])cnn2C)CCC1=O 894576916 KQCMNCILVQOCQZ-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD O=C(NCC1CN(CC[N+](=O)[O-])C1)C(F)(F)F 899894430 ZZLQSONBQREMKU-UHFFFAOYSA-N 255.196 -0.127 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](C)C(N)=O 915755714 YHYKMOFKZVZFJU-ZETCQYMHSA-N 294.267 -0.168 5 20 CBBD CN(C(=O)CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC1 1030292529 MWVIDHYAZLDOCR-GHMZBOCLSA-N 296.327 -0.927 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H](n2cncn2)C1 1320566720 OTJURJIXKOZURE-SECBINFHSA-N 291.271 -0.144 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC(n2cncn2)C1 1324599329 JMDSRHPVRYXMHS-UHFFFAOYSA-N 263.217 -0.394 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCc1ccns1 1334236197 ZOZPPOIJDVUDJX-UHFFFAOYSA-N 268.258 -0.041 5 20 CBBD CCOCCN1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1341370993 GHSAPAXUCMLBTI-UHFFFAOYSA-N 298.347 -0.250 5 20 CBBD C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)C(=O)O 1604398599 TZTRAKRYMQNHQO-LURJTMIESA-N 285.212 -0.233 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](CF)C(=O)O 1608377041 KLNCQVVJJNHAJC-SSDOTTSWSA-N 287.203 -0.705 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 44859392 BOGHFAOWEYHJMW-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD C[C@@](O)(CNC(=O)COc1ccccc1[N+](=O)[O-])C(=O)O 90274661 LAXSGBFDUNZQLV-GFCCVEGCSA-N 298.251 -0.075 5 20 CBBD CC[C@@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 90550027 VHBHBSYGAHKPCG-LLVKDONJSA-N 294.311 -0.033 5 20 CBBD CC(C)(C(=O)NCC(=O)O)n1cc([N+](=O)[O-])cn1 236702417 HEMVSOHLWBTZAB-UHFFFAOYSA-N 256.218 -0.273 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](N2CCNCC2)C1 262051360 MOJFMIJUBDDAMY-VIFPVBQESA-N 294.315 -0.562 5 20 CBBD CCCc1[nH]nc(C(=O)Nn2cn[nH]c2=O)c1[N+](=O)[O-] 272085542 KCXZSVAJCHHYCD-UHFFFAOYSA-N 281.232 -0.461 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](C)O 276235450 NRJKBKBZEPMLLJ-LHLIQPBNSA-N 297.267 -0.171 5 20 CBBD NC(=O)[C@@H]1CN(c2c(F)cccc2[N+](=O)[O-])CCN1 286312725 ZEYWEPYZFCFZBX-QMMMGPOBSA-N 268.248 -0.003 5 20 CBBD CCN(CCO)S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 330445818 DINBSMSPNPDXSW-UHFFFAOYSA-N 292.317 -0.186 5 20 CBBD CN1CCC(CN(C)C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 330579980 PMWJLUUBILTFHB-UHFFFAOYSA-N 296.331 -0.014 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 345443432 DNKVEZSJYBGCPV-LBPRGKRZSA-N 299.283 -0.023 5 20 CBBD CCCN(CCn1ccc([N+](=O)[O-])n1)CC(N)=O 429178612 ULHUGBRHNSEHFC-UHFFFAOYSA-N 255.278 -0.011 5 20 CBBD CCc1[nH]nc(C(=O)N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 737244998 DTGARXNWWKCGTO-ZETCQYMHSA-N 298.255 -0.194 5 20 CBBD Cn1c(C(=O)Nn2c(O)nnc2O)ccc1[N+](=O)[O-] 816731658 ZSQDBZATWWJXRZ-UHFFFAOYSA-N 268.189 -0.680 5 20 CBBD CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839529799 HVLZXOWBBHEDPJ-HRDYMLBCSA-N 255.274 -0.221 5 20 CBBD CN(C)CC(=O)N1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891713897 OTMWGTMRLNPGSB-UHFFFAOYSA-N 296.331 -0.462 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cncnc1 990962951 RUDKWUXZHXMYKU-NXEZZACHSA-N 291.267 -0.918 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCN1 1326046569 GMVLQQITMXVBOZ-ZETCQYMHSA-N 253.262 -0.190 5 20 CBBD O=C(NCc1nc([C@@H]2CCCO2)n[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 1327653792 JGLANGADBBGSCP-PRJMDXOYSA-N 281.272 -0.062 5 20 CBBD C[C@@H](CN(C)C(=O)c1c([N+](=O)[O-])cnn1C)c1nn[nH]n1 1342900809 ZZBRARMHHDKOEU-LURJTMIESA-N 294.275 -0.283 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1C[C@H](O)C[C@@H](C(=O)O)C1 1608159404 QSMVLVIPCHDPNU-RNFRBKRXSA-N 270.245 -0.400 5 20 CBBD CN1C[C@@H](O)[C@H](N(C)c2ncc(C(=O)O)cc2[N+](=O)[O-])C1 1777093267 DBZMNICHSLRJST-NXEZZACHSA-N 296.283 -0.201 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 49498140 VVLVABXZYGWOPE-ZCFIWIBFSA-N 283.240 -0.036 5 20 CBBD O=C1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCCN1 112207122 SACQIKXPKBEWQR-UHFFFAOYSA-N 267.245 -0.860 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CCO1 112669648 MACINYVWTHCZRB-SECBINFHSA-N 297.267 -0.053 5 20 CBBD C[C@H]1CO[C@H](CO)CN1c1ncc([N+](=O)[O-])cn1 129620120 FROZAAWGEMNPHI-CBAPKCEASA-N 254.246 -0.029 5 20 CBBD Cc1nn(C)c(N2CCN(C)C(=O)C2)c1[N+](=O)[O-] 156644982 JGWDWNWAXFOJHA-UHFFFAOYSA-N 253.262 -0.085 5 20 CBBD CCN(CCOCCO)C(=O)Cn1ccc([N+](=O)[O-])n1 282359253 FOWHYACVRJZFOW-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD CN(C)CCN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 331291131 WIIFDJVDTASWRI-UHFFFAOYSA-N 256.266 -0.794 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 342367502 DMPQADWOSSBYCL-NXEZZACHSA-N 298.299 -0.256 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 343722550 MAKKSDZMFDVYNO-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CO[C@@H]1C[C@H](CO)N(Cc2c([N+](=O)[O-])ncn2C)C1 344894731 FIYSZSYWMJSWRF-RKDXNWHRSA-N 270.289 -0.090 5 20 CBBD CC[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)O 386757087 HRTVMCKIUMLTGI-GDPRMGEGSA-N 272.305 -0.099 5 20 CBBD NC(=O)[C@H](CO)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 492840080 OCCSDCAFIIZINL-NWPZZWLHSA-N 279.252 -0.430 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H]2CNC[C@H]2C1 569358661 FYQFGZBAIWBZBH-SFYZADRCSA-N 265.273 -0.001 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 609575021 XFUCPCJYEVBNNY-MRVPVSSYSA-N 272.286 -0.143 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H](c2nc(O)n[nH]2)C1 843876875 APVGWESXMGSNRW-XLPZGREQSA-N 281.272 -0.119 5 20 CBBD O=C(C1CC1)N1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1 959777780 RHZWCMHADXEECG-WRWGMCAJSA-N 293.323 -0.022 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](CO)OC[C@@H]2C)c1[N+](=O)[O-] 1319815669 KNTJARKUIMLKOX-IONNQARKSA-N 298.299 -0.141 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)C1[C@H]2CNC[C@H]12 1578389347 FUOJRSUZRCLACE-WDSKDSINSA-N 251.246 -0.392 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@]1(C(=O)O)C[C@H](O)C1 1600748333 MFRMBQULGLFFRU-DGFRNANFSA-N 298.255 -0.806 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cccc([N+](=O)[O-])c1O 1608485643 ORTLRUSORYYBBW-LURJTMIESA-N 270.197 -0.524 5 20 CBBD O=C(O)[C@@H](C[C@H]1CCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608534539 ZOIIRBFREXZWET-FNCVBFRFSA-N 272.257 -0.210 5 20 CBBD NC(=O)c1ccc(CN2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 93092359 KEEWOZSFFLVXNR-PHIMTYICSA-N 281.268 -0.769 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 106362214 JVLIEWSVPGYBDD-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CN(C)CCO1 160622244 ZLZBDONREFTLQX-VXNVDRBHSA-N 283.288 -0.233 5 20 CBBD NC(=O)CCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 164744846 DAVRIWHNWFIVMD-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 217695042 PCQLSRFNTLPQKK-SECBINFHSA-N 268.225 -0.142 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1 227840402 ZJWMUDRHOOFMEO-QMMMGPOBSA-N 268.229 -0.438 5 20 CBBD NS(=O)(=O)c1ccc(N2CC[C@H](O)C2)c([N+](=O)[O-])c1 301156628 ALXGZTRJDKPYPV-ZETCQYMHSA-N 287.297 -0.187 5 20 CBBD CN1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 424962626 XFDAXCBQCMLKED-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NCCO 426031677 UASSCBHKMWBPPE-UHFFFAOYSA-N 296.283 -0.498 5 20 CBBD O=C(N[C@H]1[C@@H]2CNC[C@@H]21)c1cc([N+](=O)[O-])cnc1O 564957622 WEUQRGPIDULIGG-BRPSZJMVSA-N 264.241 -0.357 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@H](O)C[C@H]2CO)n1 592978990 ZGSHZTUOMSWAOD-JGVFFNPUSA-N 297.267 -0.072 5 20 CBBD Cc1n[nH]cc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 997284153 OFSAJAFLOKPDOK-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 1320905892 KOPGTUJIYYVRNH-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD C[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])N1CCN(C)CC1 1321104433 FCXOCQCHKZFUEG-SECBINFHSA-N 296.331 -0.316 5 20 CBBD O=C(O[C@H]1CCN(C2CC2)C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1325278189 MAFZUVBWMXDSIV-HLTSFMKQSA-N 254.242 -0.042 5 20 CBBD Cn1nncc1C(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 1325941413 DYZUIVZCQCKAAY-UHFFFAOYSA-N 294.227 -0.504 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN2CC[C@H]1C2 1328329447 WNYMLDQXWPLCEV-QMMMGPOBSA-N 266.261 -0.897 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H]2COCO2)c1[N+](=O)[O-] 1351593797 YAKHIDKEXMWQLR-SSDOTTSWSA-N 270.245 -0.261 5 20 CBBD CN(C)[C@@H]1CN(c2nccc(C(=O)O)c2[N+](=O)[O-])C[C@H]1O 1777036939 JGGUMJBBOWTQMM-RKDXNWHRSA-N 296.283 -0.201 5 20 CBBD Cc1cccc(C(=O)NCC(=O)NCC(=O)O)c1[N+](=O)[O-] 35097359 PSTIZADKYHLLGU-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 42694654 ZWSACJVZPRBVLW-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCN(C(=O)CO)CC1 192725549 KQZAMVZCGQQMEU-UHFFFAOYSA-N 297.315 -0.239 5 20 CBBD CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CC(=O)NC1=O 264142757 FUUKTYDPCBRJDX-ZCFIWIBFSA-N 295.255 -0.496 5 20 CBBD C[C@@H]1COCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266505584 XMDMDWYNVNZPEV-KOLCDFICSA-N 270.289 -0.127 5 20 CBBD Cc1nc(NCC(=O)NCCO)ccc1[N+](=O)[O-] 268468834 IUNVVPGAEYAIPU-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD COCCN1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1=O 282571549 ZQOKDFLTEJWLRG-UHFFFAOYSA-N 297.271 -0.485 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@@H](C)O)c([N+](=O)[O-])n1 339039478 IJTWZJGPGZRLCJ-ZCFIWIBFSA-N 278.290 -0.530 5 20 CBBD Cn1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)nn1 342118874 DNNLCVMVBWQYNV-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD Cc1nn(CC(=O)N2CCCC[C@@H]2C(N)=O)cc1[N+](=O)[O-] 344772199 DJPBNPCFDVDILH-SECBINFHSA-N 295.299 -0.034 5 20 CBBD CCCC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 347260276 LWFSZAQOMDTOMK-ZETCQYMHSA-N 285.260 -0.054 5 20 CBBD COC(=O)COCC(=O)NCCn1cc([N+](=O)[O-])cn1 355022010 SXUOKKUHKUDBBW-UHFFFAOYSA-N 286.244 -0.903 5 20 CBBD CON1CCC(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 567694596 XXONJSIJAMPANF-GFCCVEGCSA-N 299.331 -0.232 5 20 CBBD CO[C@@H]1COC[C@@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 570155592 NUJXGPKCNNQGCL-OUAUKWLOSA-N 286.288 -0.844 5 20 CBBD Cn1c(C(=O)N[C@]2(C(N)=O)CCOC2)ccc1[N+](=O)[O-] 573979014 DXXBRMNNDXQRSX-LLVKDONJSA-N 282.256 -0.693 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN([C@H]2CCNC2)CC1 578745978 QVFCGBMFPQDUFA-VIFPVBQESA-N 294.315 -0.562 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1cc([N+](=O)[O-])n[nH]1 600530431 BBSARXISUJYFPT-SSDOTTSWSA-N 269.261 -0.886 5 20 CBBD Cn1c(C(=O)OCCNS(C)(=O)=O)ccc1[N+](=O)[O-] 730601080 PGABQCMBLGYYPV-UHFFFAOYSA-N 291.285 -0.361 5 20 CBBD Nc1nc(N2C[C@H]3C[C@]3(CO)C2)ncc1[N+](=O)[O-] 782407283 PCGKFETZGLKKKE-LHLIQPBNSA-N 251.246 -0.214 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1 798248027 MBEDYZMKGHRZNG-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD O=Cc1ccc([N+](=O)[O-])c(OCC(=O)NCC(=O)O)c1 821554401 UCESXWJPUZQDCC-UHFFFAOYSA-N 282.208 -0.013 5 20 CBBD COCOCCCNC(=O)Cn1ccc([N+](=O)[O-])n1 848173012 YRPXQUWYTYHFND-UHFFFAOYSA-N 272.261 -0.082 5 20 CBBD O=C(NC1CN(C(=O)c2csnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991287467 KPDQJEKLSAOQNR-HTRCEHHLSA-N 297.296 -0.856 5 20 CBBD NC(=O)CC(=O)NCCNCc1ccccc1[N+](=O)[O-] 1125080029 LVYHZTZVGWDFHC-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD O=[N+]([O-])CCNCc1nc(-c2nn[nH]n2)cs1 1593467144 UELUMXWEHQTUSB-UHFFFAOYSA-N 255.263 -0.311 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](C(=O)O)O[C@H](C)C2)c1[N+](=O)[O-] 1599968529 XUHPHCZCRBJUPY-VDTYLAMSSA-N 298.255 -0.060 5 20 CBBD NC(=O)NCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 96731164 HGRBWHLTQBZXLF-UHFFFAOYSA-N 267.245 -0.425 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@H](CN)C1 124324478 JMXPEBDZMVWQFN-SNVBAGLBSA-N 281.316 -0.352 5 20 CBBD CCN(C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152836902 SYSUORJPPZRCAW-UHFFFAOYSA-N 277.306 -0.423 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NC(CO)CO 164857090 QZCQWBKKNLSRAM-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1c1c([N+](=O)[O-])ncn1C 168541972 GJAHVOIIFZQIMQ-HTQZYQBOSA-N 256.262 -0.086 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 272378868 QWPNWZSTKLGYLG-QMMMGPOBSA-N 284.224 -0.436 5 20 CBBD C[C@H](O)CN(CCO)CCn1ccc([N+](=O)[O-])n1 351936888 MWCBIPFMQDILCL-VIFPVBQESA-N 258.278 -0.534 5 20 CBBD Cc1nn(C)c(NC[C@H]2CNCCN2C)c1[N+](=O)[O-] 394759847 DIKYGYBWCGYWBV-SECBINFHSA-N 268.321 -0.048 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1=O 559277145 ZBYNXUXHZFRDDG-SSDOTTSWSA-N 292.251 -0.336 5 20 CBBD N[C@H]1C[C@H](NS(=O)(=O)c2cccnc2[N+](=O)[O-])C1 563132869 QYOMZIQYHQCJLD-LJGSYFOKSA-N 272.286 -0.242 5 20 CBBD CO[C@H]1C[C@H](C(=O)O)N(CCn2ccc([N+](=O)[O-])n2)C1 568067126 MXEDICLMCNDOBQ-DTWKUNHWSA-N 284.272 -0.035 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H]2CNC[C@@H]2C1 569358660 FYQFGZBAIWBZBH-JGVFFNPUSA-N 265.273 -0.001 5 20 CBBD COCCNC(=O)CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 596061335 OXJBETTXSSOMPY-UHFFFAOYSA-N 296.283 -0.132 5 20 CBBD CN(CC(=O)NC(CO)CO)c1ccccc1[N+](=O)[O-] 612556463 CKLIDGBJXVTGHD-UHFFFAOYSA-N 283.284 -0.500 5 20 CBBD CNC(=O)C1(C(=O)OCCn2cnc([N+](=O)[O-])n2)CCC1 749078899 KARXBHGYDGPUFE-UHFFFAOYSA-N 297.271 -0.354 5 20 CBBD O=C1C[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CO1 816680454 JTTRFLCUEGNDPX-LURJTMIESA-N 267.197 -0.259 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCCCO 823625162 RQQWOXJPLNWRKP-UHFFFAOYSA-N 265.233 -0.036 5 20 CBBD C[C@](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)(C(=O)O)C1CC1 827735017 OIFBHUGAXYSGOJ-ZYHUDNBSSA-N 298.299 -0.005 5 20 CBBD CC(C)(C)n1nnc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 847187376 BMPXBEWPYUQBRN-RNFRBKRXSA-N 268.277 -0.291 5 20 CBBD CN(C)C(=O)NC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 908786660 QRNFTUWGQMXUNK-NXEZZACHSA-N 284.316 -0.086 5 20 CBBD COCC(=O)NCCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1095457123 OAFJRRFPRPJHFD-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD Cc1nc(NC2(CNC(=O)C(N)=O)CC2)ccc1[N+](=O)[O-] 1110324437 OJQSTJWYMBWHGN-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD Cn1ccnc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1253825616 OGCFRFONLAFKRJ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cc1nn(C)c(C(=O)N(C)C[C@H](O)CO)c1[N+](=O)[O-] 1320163977 CZVBAQLSNLAMBQ-ZETCQYMHSA-N 272.261 -0.938 5 20 CBBD Cn1nncc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1323290023 HCFFLPKVLLZWOK-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD C[C@@](O)(CO)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1589992889 DOFAXBUULGWVIV-JTQLQIEISA-N 295.259 -0.675 5 20 CBBD C[C@H](O)[C@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589995177 IVKIQMGFRGMMJY-WHFBIAKZSA-N 253.222 -0.087 5 20 CBBD CON(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H](C)C(=O)O 1594039386 BFIDMLOCPIFTLU-YFKPBYRVSA-N 272.217 -0.195 5 20 CBBD CCCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 44867314 QCUVECHRVOPNPF-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(OC)c1 142808223 UEZWMEITXZQIIN-MRVPVSSYSA-N 298.251 -0.133 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)COc1ccccc1[N+](=O)[O-] 227050886 LXGNDXOZKDDKJC-VIFPVBQESA-N 298.251 -0.376 5 20 CBBD O=C1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCN1 272620559 UGLHZEUQJFEIKI-UHFFFAOYSA-N 265.225 -0.128 5 20 CBBD COCC(=O)Cn1cc(C(=O)OC)cc([N+](=O)[O-])c1=O 279899089 IXSFJILUAIGIQL-UHFFFAOYSA-N 284.224 -0.241 5 20 CBBD C[C@@]1(C(N)=O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 280260369 NWXZZNNAGHPUJK-SNVBAGLBSA-N 266.261 -0.331 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 281801527 JVBFIVCOPCYFHN-YFKPBYRVSA-N 281.228 -0.717 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 332681841 KBWMHVVYWAOVCW-SSDOTTSWSA-N 282.256 -0.037 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCOC1 337359648 CJYQVXYXIXXUBB-MRVPVSSYSA-N 267.241 -0.338 5 20 CBBD C[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 339189428 PKJREWOIRQSRMW-SSDOTTSWSA-N 255.230 -0.747 5 20 CBBD C[C@H](CO)N1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 355160568 FXADWVZKVXORBR-SECBINFHSA-N 297.315 -0.153 5 20 CBBD CN1C[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 561220144 KACBFVLTIPXBLN-LURJTMIESA-N 279.256 -0.468 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)C1(O)CNC1 595931200 GXQYXOFCGKHUIQ-UHFFFAOYSA-N 281.268 -0.446 5 20 CBBD Cn1cc([C@@H](CO)Nc2ccc(N)c([N+](=O)[O-])n2)cn1 596175075 KXPDQIARGWZZFX-SECBINFHSA-N 278.272 0.451 5 20 CBBD Nc1nccc(C(=O)NC[C@H](O)[C@H]2CCCO2)c1[N+](=O)[O-] 600242757 QOYOUDGOQYRKCP-DTWKUNHWSA-N 296.283 -0.158 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1cc([N+](=O)[O-])c[nH]1 600526314 HECSTJNKQUFAMS-SECBINFHSA-N 268.273 -0.281 5 20 CBBD Nc1c(C(=O)NOCCO)cc(F)cc1[N+](=O)[O-] 776579850 PSNJWEJZGPQRFQ-UHFFFAOYSA-N 259.193 -0.030 5 20 CBBD CCc1nn(C)c(NCCn2cnnn2)c1[N+](=O)[O-] 845573515 ADFJDSHVGGDJEW-UHFFFAOYSA-N 266.265 -0.011 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H]3C[C@H]2C(=O)O3)c1[N+](=O)[O-] 861871167 DTTIRWZEAYKYNM-RITPCOANSA-N 266.213 -0.234 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 863630622 JUSWKTWRFCPZFK-LURJTMIESA-N 297.271 -0.290 5 20 CBBD COCCOCCN1CCN(CC[N+](=O)[O-])CC1 930865720 RIANNFLFKXMQIK-UHFFFAOYSA-N 261.322 -0.456 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 1020533886 MOQJQWRBDNTGQM-MGCOHNPYSA-N 292.295 -0.183 5 20 CBBD CC(C)NC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1116496690 PASAXMMCMNLKJO-UHFFFAOYSA-N 269.261 -0.417 5 20 CBBD Cc1nccnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126938931 NYSNQSIKMATECN-MWLCHTKSSA-N 279.300 -0.344 5 20 CBBD COC[C@H](O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319656934 HQNIRMPVAHVSTG-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCS(=O)(=O)C1 1345369392 WRJDHTKPQDLNEY-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CS(=O)(=O)c1ccc(N2CCNC(=O)C2)c([N+](=O)[O-])c1 6250276 KHSCRMFTGAKNSJ-UHFFFAOYSA-N 299.308 -0.066 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1N)C(=O)NC(N)=O 21741938 FZMSTRAEUVIUCU-YFKPBYRVSA-N 296.239 -0.083 5 20 CBBD O=C(CCN1CCCC1=O)NCCn1cc([N+](=O)[O-])cn1 122301761 SJMSMFHVLNYDEH-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 165549948 KXJUBVGXICHTDR-MRVPVSSYSA-N 254.246 -0.277 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 286664555 CUSDHLHKSHRLLF-QMMMGPOBSA-N 283.288 -0.544 5 20 CBBD Nc1nc(NC[C@@H]2CCCS2(=O)=O)ncc1[N+](=O)[O-] 301698123 CYQBMFWLNDZFSC-LURJTMIESA-N 287.301 -0.044 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 332739272 YHDIBBFFEHOAHM-ZETCQYMHSA-N 282.256 -0.037 5 20 CBBD CN(C)CCn1ccc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n1 343368976 GMQUQAKWKKVPBB-UHFFFAOYSA-N 293.287 0.328 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(CCO)CC1 349247049 IRBNYPCJMNSSFC-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)OC 351789004 UBPXBRYWAWXDHO-ZETCQYMHSA-N 285.256 -0.149 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 354533746 AIQFSTABNSVZKO-UHFFFAOYSA-N 284.276 -0.339 5 20 CBBD O=C1C[C@@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])CN1 429613158 SQIQGYWOUYJDRJ-ZCFIWIBFSA-N 265.229 -0.578 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 435988395 WNXSCXPXTBQZPH-LLVKDONJSA-N 281.272 -0.084 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 554876050 DOTIZQOKESQCRA-LURJTMIESA-N 288.285 -0.423 5 20 CBBD N[C@@H]1C[C@@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 578787364 MHXXJTGEGNADMQ-RKDXNWHRSA-N 277.284 -0.262 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)CC(N)=O)c1[N+](=O)[O-] 579372103 IUDDSDCTGIRAPP-ZCFIWIBFSA-N 281.272 0.025 5 20 CBBD CCc1nn(C)c(N2C[C@@H](CO)[C@H](CO)C2)c1[N+](=O)[O-] 599129102 YQYSCEBNKJJOMS-IUCAKERBSA-N 284.316 -0.072 5 20 CBBD NC(=O)[C@@H]1CN(c2sccc2[N+](=O)[O-])CCN1 611411412 UGZMEZOKCQCWKY-LURJTMIESA-N 256.287 -0.080 5 20 CBBD COC(=O)c1coc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 846482008 OITVEHNTDHIKES-IYSWYEEDSA-N 269.213 -0.257 5 20 CBBD Cc1cnc(N[C@H]2C[C@@H](NC(=O)C(N)=O)C2)c([N+](=O)[O-])c1 1059803982 OIGFOGWSTLJODE-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cnn(CCF)c1 1329545077 RXMGXBGSRZOROA-UHFFFAOYSA-N 283.223 -0.009 5 20 CBBD NCCNC(=O)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 1331474772 KXDVIKJHWMPSFN-UHFFFAOYSA-N 296.283 -0.835 5 20 CBBD CCCNC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1353862307 VHYXKFCTXKNUNJ-ZETCQYMHSA-N 283.288 -0.027 5 20 CBBD C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 50418265 JTDRYWUTPHKJOV-PSASIEDQSA-N 295.303 -0.369 5 20 CBBD C[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 67292556 RDTKVPFXKSSEFI-MRVPVSSYSA-N 283.288 -0.226 5 20 CBBD CC[C@H]1C(=O)NCCN1Cn1cc([N+](=O)[O-])cn1 106855703 HAXFVUJKZLJEKO-VIFPVBQESA-N 253.262 -0.041 5 20 CBBD NS(=O)(=O)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1 113702177 ZICIJPPIFYFJDV-UHFFFAOYSA-N 291.260 -0.248 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 175633216 QENQXROIPAFVAL-MRVPVSSYSA-N 283.288 -0.368 5 20 CBBD O=C(NCCC(=O)N1CCOCC1)c1ccc([N+](=O)[O-])[nH]1 298886311 UNRARADDFVANMB-UHFFFAOYSA-N 296.283 -0.098 5 20 CBBD CN(C)C[C@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CCO1 330650997 JYUSCFYZWGVLFX-VIFPVBQESA-N 297.315 -0.269 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 330693414 HWENGLJRSZTPNZ-SNVBAGLBSA-N 296.331 -0.847 5 20 CBBD C[C@@H](NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)C(N)=O 341447816 BKJVKFFJPWFKLB-ZCFIWIBFSA-N 280.240 -0.477 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)O1 347736677 RRLZWQGVDVHLEH-IONNQARKSA-N 282.256 -0.314 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@]2(O)CCN(C)C2)c1[N+](=O)[O-] 358060121 DVIHCUAUPFOCSG-NSHDSACASA-N 283.288 -0.577 5 20 CBBD CN(C)C(=O)COC1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 362135636 ATROKOAIUDTHNY-UHFFFAOYSA-N 296.287 -0.740 5 20 CBBD Nc1nc(N2CCO[C@@H](CF)C2)ncc1[N+](=O)[O-] 413477983 QUBNDEALMLMFNA-LURJTMIESA-N 257.225 0.142 5 20 CBBD CO[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 439569236 JUPBDDYVXYWAMM-ZETCQYMHSA-N 255.234 -0.224 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@@H](C)N1 579714779 VUXLCPBWDDVANW-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD CN(CC(=O)N1CCOCC1)C(=O)c1c[nH]nc1[N+](=O)[O-] 580536961 FLVWCRDLRRJTEZ-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD NC[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCCO1 583993448 CKMNQFYUYIRGDU-LLVKDONJSA-N 297.315 -0.242 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H](CO)C2CC2)c1 763068664 MMQDUQBVIMXKKD-MNOVXSKESA-N 270.289 -0.487 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OCc1nc(O)n[nH]1 781666335 OKIDGKGKMGYPBP-UHFFFAOYSA-N 280.200 -0.247 5 20 CBBD CNC(=O)[C@@H](O)CNc1nc(C(=O)OC)ccc1[N+](=O)[O-] 804649837 OOSHVQNMYUOVQY-QMMMGPOBSA-N 298.255 -0.705 5 20 CBBD COC[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C)O1 839734573 SKHHXFGGWYOEEC-SGIHWFKDSA-N 258.274 -0.086 5 20 CBBD C[C@@H](COC(=O)Cn1nc2n(c1=O)CCCC2)[N+](=O)[O-] 845574877 DWYFIPLKBCZLTJ-QMMMGPOBSA-N 284.272 -0.411 5 20 CBBD C[C@@H](COC(=O)[C@@H]1CC(=O)N(c2cnn(C)c2)C1)[N+](=O)[O-] 860777715 UDAFNYVAHUUWDY-DTWKUNHWSA-N 296.283 -0.019 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NN1CCOC1=O 862700467 VOFDJYQGOIGEPK-UHFFFAOYSA-N 282.212 -0.760 5 20 CBBD O=C(Cn1ncnn1)NCCNc1ccc([N+](=O)[O-])cc1 1093890048 UOUGFVGCNOQONA-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ncc([N+](=O)[O-])cc1F 1100294878 UFKRYDKHCMPSKG-UHFFFAOYSA-N 285.235 -0.833 5 20 CBBD Cc1nncn1CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1318783388 ZTIGOUVUQAINPI-UHFFFAOYSA-N 293.287 -0.102 5 20 CBBD Cc1nnc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])n1C 1324889167 CJCPQBQBDVSAMV-UHFFFAOYSA-N 265.233 -0.315 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1326086806 FYGXZEATTGMKTO-IONNQARKSA-N 283.288 -0.484 5 20 CBBD NC[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1328462579 TUDOEIBUACLZRT-SECBINFHSA-N 267.289 -0.011 5 20 CBBD CC(C)CNC(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1336413528 SPGDDYNIZKZSCQ-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 1342824312 IINHPAUYKIJZBI-SSDOTTSWSA-N 281.272 -0.403 5 20 CBBD COC[C@]1(C(=O)O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1593966745 ARENNWADTNSWGS-NSHDSACASA-N 298.255 -0.119 5 20 CBBD CO[C@]1(C(=O)O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1599074635 JFOKYFSZLFHFNE-BRDIYROLSA-N 258.230 -0.646 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1608643559 HAVRISPFVDUMIY-LURJTMIESA-N 270.201 -0.757 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NC(N)=O 3520644 QTBTYPKRONMNSB-BYPYZUCNSA-N 271.185 -0.072 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C(N)=O)O1 122785122 QFOLPNGJMSKBPL-BDAKNGLRSA-N 283.288 -0.634 5 20 CBBD COCC(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 157701022 XWIZZUGXUCTHPZ-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CN1C[C@H](O)[C@@H](O)C1 278659515 HTICRBQHTSHOIZ-USWWRNFRSA-N 298.295 -0.628 5 20 CBBD O=C(N[C@H](CO)CN1CCCCC1)c1cc([N+](=O)[O-])[nH]n1 298619439 OZYSNRWXXVQCCL-VIFPVBQESA-N 297.315 -0.106 5 20 CBBD CCCNC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 298664536 CERVNFIVCZMPIJ-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD C[C@@](CO)(NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 313508303 ZTWHCVKOSZNAOI-VIFPVBQESA-N 257.202 -0.512 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)n1cncn1 348564229 SCVNJKIGRKVONN-QMMMGPOBSA-N 279.260 -0.240 5 20 CBBD CNC(=O)Cn1nc(Nc2ncc([N+](=O)[O-])cn2)cc1C 354581558 VITYDNADMAYKJG-UHFFFAOYSA-N 291.271 0.379 5 20 CBBD C[C@@H]1C[C@H](O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 385022072 LTDNASVJXZFUBK-SFYZADRCSA-N 254.246 -0.227 5 20 CBBD N=c1nc(Cn2cc(Cl)cc([N+](=O)[O-])c2=O)[nH]c(=N)[nH]1 432254133 RIGIYYQORDLQOJ-UHFFFAOYSA-N 297.662 -0.532 5 20 CBBD COC(=O)Cn1cc(CCn2nccc2[N+](=O)[O-])nn1 448106693 FYVPJANELHZNGZ-UHFFFAOYSA-N 280.244 -0.202 5 20 CBBD N=C(O)OCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 496458132 JOAAJIAAZPHNBO-UHFFFAOYSA-N 270.201 -0.065 5 20 CBBD Cn1nncc1C(=O)Cn1cccc([N+](=O)[O-])c1=O 505500378 IQJBGSFVFCYOIC-UHFFFAOYSA-N 263.213 -0.232 5 20 CBBD Nc1nc(N[C@@H]2C[C@@H](C(=O)O)C[C@@H]2O)ncc1[N+](=O)[O-] 595977567 GYJUZLISXHORIX-XAHCXIQSSA-N 283.244 -0.397 5 20 CBBD CO[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@H]1O 596256840 GXDFNCZMASTEKV-GHMZBOCLSA-N 281.268 -0.110 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 597652404 AZWZCKLFESDQBW-VIFPVBQESA-N 299.331 -0.435 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 597654216 PSCQSZJBWZLISZ-SSDOTTSWSA-N 256.262 -0.425 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 763696961 HUILLRZZFDZJDB-SNVBAGLBSA-N 281.268 -0.640 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nnnn1C 779466150 CLHPULJEMPXVMA-UHFFFAOYSA-N 266.221 -0.738 5 20 CBBD COCC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 787236738 RGPZOBWIFUDRHZ-JTQLQIEISA-N 296.283 -0.203 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)Nn2c(O)nnc2O)n1 854610268 BADZXVULBMDUND-UHFFFAOYSA-N 283.204 -0.802 5 20 CBBD O=C(CCn1cnccc1=O)OCCC[N+](=O)[O-] 860918494 KATITEBSWSWMEX-UHFFFAOYSA-N 255.230 -0.157 5 20 CBBD Cc1nn(C)c(C(=O)NCCCC(N)=O)c1[N+](=O)[O-] 1320684502 CFUSUWFDBVZRGF-UHFFFAOYSA-N 269.261 -0.368 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)Cc1nc[nH]n1 1339506832 QVFXSOKZHSYIQH-UHFFFAOYSA-N 279.260 -0.124 5 20 CBBD O=C(O)C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 1601907789 XXCPNBAZNGSFRV-QWRGUYRKSA-N 298.299 -0.005 5 20 CBBD CNC(=O)CNC(=O)CNc1ccccc1[N+](=O)[O-] 49423251 YXLSGZAMDNENAZ-UHFFFAOYSA-N 266.257 -0.131 5 20 CBBD Cc1nn(CCNS(C)(=O)=O)c(C)c1[N+](=O)[O-] 78552609 POLYXVINCHAJOZ-UHFFFAOYSA-N 262.291 -0.043 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 178995147 MNYCDHURIWMUJZ-UHFFFAOYSA-N 283.288 -0.320 5 20 CBBD CN(CC(=O)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262707847 NOAGDBDIIUQOLU-UHFFFAOYSA-N 269.213 -0.701 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CNC(=O)C1 330730185 HZDUDPLZALBMCO-MRVPVSSYSA-N 281.272 -0.505 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 359492580 NWLAUCHKVMJNCZ-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCSCC1 408026551 HXEFHKKTICSNSG-UHFFFAOYSA-N 257.275 -0.238 5 20 CBBD CCNC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 604480428 GYIPZVOQTOCUKC-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD CN1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 619444717 KKXPLHJFKTUWHR-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3C[C@@]3(CO)C2)c1 782616047 LRGCNRLVKUOYHX-JLLWLGSASA-N 282.300 -0.534 5 20 CBBD Cc1nc(N(C)CCCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1095719205 VFIRFAOOBQETDC-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD COCCC(=O)N1CCC(NCC[N+](=O)[O-])CC1 1337852911 DMKWSXQDGRVJLK-UHFFFAOYSA-N 259.306 -0.120 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)c1c([N+](=O)[O-])cnn1C 1338563758 HUJXLGYWPQQMRM-UHFFFAOYSA-N 298.299 -0.058 5 20 CBBD CC1(C(=O)O)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1593807570 GBEACHFSLMCXPS-SECBINFHSA-N 284.272 -0.441 5 20 CBBD CC(C)(C)NC(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1603080821 IXJYVCVMFAVKRA-UHFFFAOYSA-N 294.275 -0.114 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@]2(CC(=O)O)CCOC2)c1[N+](=O)[O-] 1607499791 DAWGNRBNEUPMNX-LLVKDONJSA-N 298.255 -0.010 5 20 CBBD COC(=O)c1cc(C(=O)N(C)CC(N)=O)cc([N+](=O)[O-])c1 58254160 XXEZKEJJYWZAMT-UHFFFAOYSA-N 295.251 -0.061 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])cn1 185544439 FLCIFGNOEFWHAO-NXEZZACHSA-N 284.272 -0.601 5 20 CBBD COCCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1O 225791119 AEZAXSCIZJRCTK-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228705384 UIZXXISQDNJTSE-KWQFWETISA-N 284.272 -0.553 5 20 CBBD C[C@]1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 267225417 JXWYYFBFELMUEK-LBPRGKRZSA-N 281.268 -0.260 5 20 CBBD COC(=O)[C@@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 271246245 QLRJSQIABMJZSU-LLVKDONJSA-N 284.272 -0.287 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 274908202 SMIFWXHLBNWTEY-YFKPBYRVSA-N 269.213 -0.013 5 20 CBBD CN(C)S(=O)(=O)CCn1cccc([N+](=O)[O-])c1=O 285201357 PAZWWPHRYBPOPJ-UHFFFAOYSA-N 275.286 -0.352 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCn1ncnn1 338960775 ICVCXZBEFYOHBU-UHFFFAOYSA-N 294.275 -0.707 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)[C@@H]1CCCO1 344855485 FCUHIQKTOAXHPY-IUCAKERBSA-N 284.272 -0.553 5 20 CBBD COc1c(C(=O)NCCOCC(N)=O)cccc1[N+](=O)[O-] 356408149 AVNKXHIYQNQPQL-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCNC(=O)C1CC1 356493375 YAJFDWDEQVSFKD-UHFFFAOYSA-N 281.272 -0.416 5 20 CBBD CO[C@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1 359474466 ZXEXSIXWYZOYLT-NSHDSACASA-N 284.272 -0.287 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@H]1CNC(=O)O1 495719017 SDMYITJFZNSHQZ-ZCFIWIBFSA-N 270.201 -0.557 5 20 CBBD CC[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 548082346 XSKLZQIOMYFDNH-ZCFIWIBFSA-N 254.246 0.073 5 20 CBBD Nc1ncc2c(n1)CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)C2 573031443 BVRBOOJCIOIUPE-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD CCn1cc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)nn1 598142063 IEQZCBXDECNBRM-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD NS(=O)(=O)c1ccc(NCc2cnn[nH]2)c([N+](=O)[O-])c1 610663308 RGTNTHSCVSOEJZ-UHFFFAOYSA-N 298.284 -0.028 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCO1 615927477 KZBMIFLKFUKVKR-LBPRGKRZSA-N 297.267 -0.412 5 20 CBBD Nc1ccc(C(=O)N[C@@H](CO)C(=O)O)cc1[N+](=O)[O-] 739205385 QROOKDZLGQQOKH-ZETCQYMHSA-N 269.213 -0.648 5 20 CBBD Cc1cc(C(=O)NCc2nn[nH]n2)c(N)c([N+](=O)[O-])c1 749388190 QXLLQFFLFKBLQG-UHFFFAOYSA-N 277.244 -0.071 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(n2ccnn2)C1 779556864 HOKWJNOQIUIBPA-UHFFFAOYSA-N 291.271 -0.225 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 793921817 VOISCZJZUWXXDO-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD C[C@@H](O)[C@@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843062100 LURSNGXHSPLPQK-GGZOMVNGSA-N 270.285 -0.041 5 20 CBBD COC(=O)C1CC(OC(=O)Cn2cnc([N+](=O)[O-])n2)C1 860951262 BKFNMAYQLVCJMK-UHFFFAOYSA-N 284.228 -0.319 5 20 CBBD CC(C)=CC(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042975572 OFVKUPHRGSQCOO-NXEZZACHSA-N 297.311 -0.693 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1255176232 SSFIHNCOOWSDLD-YUMQZZPRSA-N 284.272 -0.796 5 20 CBBD COCC1(O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1324856433 BRFDUAPRUMWAQC-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD C[C@@H](c1nnc(N(C)CCS(C)(=O)=O)n1C)[N+](=O)[O-] 1343689703 VHWBHUZJEUELEW-ZETCQYMHSA-N 291.333 -0.366 5 20 CBBD CCc1nc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)no1 1578619994 IFPJEVQLNPAWOQ-UHFFFAOYSA-N 291.231 -0.035 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H]2CC[C@@H]1N2 1580578475 FWKZZBWOYOKOAB-JEZHCXPESA-N 265.273 -0.200 5 20 CBBD C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1589144624 SELHEPZCZYZLLF-JTQLQIEISA-N 269.213 -0.445 5 20 CBBD O=c1ccn(-c2cncc(-c3nn[nH]n3)n2)cc1[N+](=O)[O-] 1593497991 VMJPAZIRCAJBQO-UHFFFAOYSA-N 286.211 -0.284 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC(=O)N(C)C 65868887 VAIGMNYUMHYMQL-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD Cc1[nH]nc(C(=O)NCC(F)(F)CO)c1[N+](=O)[O-] 274359395 KNQIORPFUDSLPB-UHFFFAOYSA-N 264.188 -0.016 5 20 CBBD Cc1c([N+](=O)[O-])cc(C(=O)NC(CO)CO)cc1[N+](=O)[O-] 276014026 QVKDVDKZKZPGJK-UHFFFAOYSA-N 299.239 -0.106 5 20 CBBD COCCNC(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 298306968 NNZMNOQLGUHDSS-UHFFFAOYSA-N 297.271 -0.737 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1CO 362089704 JUQJNGNJBWVYKM-CKYFFXLPSA-N 284.316 -0.288 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)[C@H](N)C[C@@H]3C2)c1[N+](=O)[O-] 577887148 GKIIIQGYLOHIGA-RKDXNWHRSA-N 294.315 -0.615 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN1CCCC1=O 580458854 MEAGXOXJPKKDBC-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 583947872 ISKJNXTWUBUFAL-RXMQYKEDSA-N 281.228 -0.887 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@@H]2C[C@@H]21 590437249 WIJQZBLTUGQPKS-DTWKUNHWSA-N 252.230 -0.209 5 20 CBBD O=C(O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 819490218 OYPQESJIEABEII-UHFFFAOYSA-N 271.233 -0.435 5 20 CBBD CCn1ncn(NC(=O)c2cccc([N+](=O)[O-])c2N)c1=O 820390496 CPYXLJXNEMAHAX-UHFFFAOYSA-N 292.255 -0.061 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCCN(C=O)CC1 866127217 YCOMDCVHQIUUGS-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC[S@@](=O)CC(=O)N(C)C 871610029 HHMGPHCITZZNFT-LJQANCHMSA-N 288.329 -0.063 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ncccn1 998266419 QYDNDTREUYPITG-RKDXNWHRSA-N 291.267 -0.918 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnsn2)C1 1042704970 DWHYEDZPBUPSBY-NXEZZACHSA-N 297.340 -0.154 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ccnc(O)c2[N+](=O)[O-])CC1 1110324199 CKFPOXNUVRUMCB-UHFFFAOYSA-N 295.255 -0.759 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)N(C)C 1116628896 WRMCIGHXHFFSBR-LURJTMIESA-N 269.261 -0.465 5 20 CBBD O=C(N[C@@]1(CCO)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1255999289 QJFJAYPCUFGHPV-JTQLQIEISA-N 270.245 -0.411 5 20 CBBD COC[C@H](O)CNC(=O)CCn1cc([N+](=O)[O-])nc1C 1321274033 QCOYQBKKZXXION-SECBINFHSA-N 286.288 -0.387 5 20 CBBD COC(=O)CN(C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1324790429 WGRYMNFCYQFOGP-UHFFFAOYSA-N 299.287 -0.988 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CC[C@H]2O)c1 1334770335 HDMWISMRPQNTSG-OPRDCNLKSA-N 256.262 -0.735 5 20 CBBD O=C(O)[C@@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 1602171537 KOMWWBSTOPZHNG-ZJUUUORDSA-N 270.241 -0.337 5 20 CBBD Cc1[nH]nc(C(=O)N[C@]2(CC(=O)O)CCOC2)c1[N+](=O)[O-] 1607499794 DAWGNRBNEUPMNX-NSHDSACASA-N 298.255 -0.010 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc(O)c([N+](=O)[O-])c1 1610683497 UKBJZRNCXLRWCK-ZCFIWIBFSA-N 270.197 -0.524 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc(F)cc1[N+](=O)[O-] 159802159 WMIZSGBUMHBALG-MRVPVSSYSA-N 286.215 -0.002 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)Cn1cc([N+](=O)[O-])cn1 162011463 KBWPFOYPMUQLNJ-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD CCN(C)C(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 184535114 LSKPZLYPNXIFJY-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2O)C1=O 217315896 KFKOHBIGVATQDC-ZETCQYMHSA-N 293.235 -0.213 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 227047546 NCWIZCXEPSKICQ-RXMQYKEDSA-N 274.254 -0.080 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 271294956 QYYQIDCNPLBGMX-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H]3CNC[C@@H]3C2)c1[N+](=O)[O-] 280043812 QXMHYJNZJGKUEB-OCAPTIKFSA-N 265.273 -0.082 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](O)[C@H](O)C1 289796188 YBLJGMAUXZOYFI-OCAPTIKFSA-N 256.262 -0.339 5 20 CBBD O=C1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CN1 357464261 HNHYPLAYKCLZAL-SSDOTTSWSA-N 265.225 -0.081 5 20 CBBD COC(=O)[C@@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 361668669 YOQVMGCFRFYBJL-VIFPVBQESA-N 271.233 -0.697 5 20 CBBD CCNCCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 574690262 ACIMPMJRZAVISE-UHFFFAOYSA-N 274.302 -0.122 5 20 CBBD CNc1nccc(C(=O)N=c2nc(C)[nH]n2C)c1[N+](=O)[O-] 590446226 BPJGNGZXVRYHQI-UHFFFAOYSA-N 291.271 0.143 5 20 CBBD Nc1ccc(N[C@@H]2C[C@H](C(=O)O)C[C@@H]2O)nc1[N+](=O)[O-] 595981989 ZOWOQWRWVYVMHO-ARDNSNSESA-N 282.256 0.208 5 20 CBBD Cn1[nH]c(COC(=O)c2cc([N+](=O)[O-])ccc2N)nc1=O 765432894 YWOKNBXDXGNFTK-UHFFFAOYSA-N 293.239 -0.044 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 825630717 PEMKYHYXNSMZGR-KWQFWETISA-N 293.279 -0.025 5 20 CBBD CCONC(=O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 846498879 UIKZMLQEMQVJPM-UHFFFAOYSA-N 299.287 -0.290 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1COCO1 861969260 OLLFGUVHTWRVMF-VIFPVBQESA-N 283.240 -0.754 5 20 CBBD CC(C)(COC(=O)[C@@H]1CSCC(=O)N1)[N+](=O)[O-] 1123061637 VIBCOOKOSJAJNY-LURJTMIESA-N 262.287 -0.184 5 20 CBBD CCOC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1321738250 YECUFWDBFYHLDC-UHFFFAOYSA-N 284.224 -0.137 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@@H]1O 1324550297 LSIKHEUEEZANOO-SKDRFNHKSA-N 295.295 -0.014 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)c1n[nH]cc1[N+](=O)[O-] 1324600097 QQYLAFZSGATJHZ-UHFFFAOYSA-N 276.274 -0.566 5 20 CBBD CNC(=O)CSc1nccc(C(N)=O)c1[N+](=O)[O-] 1327600232 GPCUZZAGLJDCMQ-UHFFFAOYSA-N 270.270 -0.073 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H](C(=O)O)O1 1329712054 GIFBOOHNSPWZAQ-PSASIEDQSA-N 284.272 -0.035 5 20 CBBD COCCN(C)c1nnc(C[N+](=O)[O-])n1CCOC 1341519015 ZUGMHWIBEDKKCX-UHFFFAOYSA-N 273.293 -0.216 5 20 CBBD CN(C)C(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1598134586 SLGTULPFLKKGTQ-UHFFFAOYSA-N 269.213 -0.457 5 20 CBBD O=C(NCCc1ncn[nH]1)c1cc([N+](=O)[O-])c[nH]c1=O 80582540 NVQHUWUUAAJXAC-UHFFFAOYSA-N 278.228 -0.626 5 20 CBBD O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1n[nH]cc1[N+](=O)[O-] 131395910 ZAPHKMGFPIPQPH-LURJTMIESA-N 279.256 -0.189 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(C(=O)O)CCC1 164849289 QCQFUEJLWOXLMZ-UHFFFAOYSA-N 268.229 -0.085 5 20 CBBD CN1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1=O 263746250 BFGAMTPZWKUXDT-QMMMGPOBSA-N 294.267 -0.897 5 20 CBBD CNC(=O)CN(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 269494293 MWQCCQSAUSZBNA-UHFFFAOYSA-N 280.284 -0.129 5 20 CBBD COC(=O)C1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285832723 ONXLGAKIJVYVEA-UHFFFAOYSA-N 254.202 -0.247 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)NCCn1cc([N+](=O)[O-])cn1 290697284 JNLUXNKMVZCNIU-UWVGGRQHSA-N 299.287 -0.496 5 20 CBBD CCn1cc(S(=O)(=O)NCCOC)c([N+](=O)[O-])n1 331216188 DLIMGQOOULRUBA-UHFFFAOYSA-N 278.290 -0.264 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 345790298 YKJBDBJQYSYHBB-LURJTMIESA-N 281.272 -0.172 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)C1=O 549764887 XFULTGVAACCIAP-RXMQYKEDSA-N 267.197 -0.325 5 20 CBBD COC[C@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 565726495 YOGXGOUEUYSWPF-LLVKDONJSA-N 284.272 -0.301 5 20 CBBD C[C@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CNC(=O)C1 802194130 UBAUWAOGUVTSOV-LLVKDONJSA-N 282.256 -0.139 5 20 CBBD CN(CC(N)=O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 1324700525 MPTONWUVEIBXKB-UHFFFAOYSA-N 254.202 -0.747 5 20 CBBD NC1(CO)CCN(c2nc(C(=O)O)ccc2[N+](=O)[O-])CC1 1608250636 LFRGAIWOQUHYGC-UHFFFAOYSA-N 296.283 -0.022 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)C(=O)O 262049893 FKGSQNQNUDOTQD-LURJTMIESA-N 270.245 -0.063 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 276609505 MZLPNEJOYKRJNQ-QMMMGPOBSA-N 283.288 -0.226 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(CO)CC1 331804175 ADUOHDRNLDTYJA-UHFFFAOYSA-N 254.246 -0.259 5 20 CBBD CN(CCC(N)=O)c1ncc([N+](=O)[O-])cc1C(N)=O 344021925 YMZBYWOOJKCURN-UHFFFAOYSA-N 267.245 -0.600 5 20 CBBD Nc1nc(N[C@H]2CC[S@@](=O)C2)ncc1[N+](=O)[O-] 348745930 XFYAVAKXWFAHFC-AAODDVHNSA-N 257.275 -0.100 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)OC 352093227 NQCPVQCRNPVGMA-MRVPVSSYSA-N 298.255 -0.510 5 20 CBBD COC[C@]1(CNC(=O)c2c([N+](=O)[O-])cnn2C)CCCN1 564449621 GTRMFOREQQPKHH-GFCCVEGCSA-N 297.315 -0.173 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cccc([N+](=O)[O-])c2O)CCOC1 572974587 ZMSPGZDIJVIGHI-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD CC(C)(C(N)=O)C(=O)OCCn1cc([N+](=O)[O-])cn1 769686180 AZRJZOBGTHADPZ-UHFFFAOYSA-N 270.245 -0.154 5 20 CBBD CC1(C)COC(=O)[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 816583905 WQJMYUIOSGNTQY-SSDOTTSWSA-N 268.229 -0.001 5 20 CBBD CCS(=O)(=O)NCCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840670936 NMBYCTANJVQNLZ-HTQZYQBOSA-N 280.302 -0.476 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCCNC1 1118082273 WPMHQEMJZUVOSV-RKDXNWHRSA-N 282.304 -0.309 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCNCC1 53299352 FNJJDFPLJJAHBE-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD CN1CCO[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 129969943 AHNHKCDERZMTKT-JTQLQIEISA-N 283.288 -0.762 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CNC(CO)CO)cc1 134757671 UAPNQZSNZLAKEC-NSHDSACASA-N 256.258 -0.429 5 20 CBBD O=C(O)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262105590 JPBFLRZWGAEYQX-SECBINFHSA-N 295.251 -0.168 5 20 CBBD Nc1nc(N2CCN3C(=O)NC[C@@H]3C2)ncc1[N+](=O)[O-] 267717096 UMCBZXUYYPIPHX-ZCFIWIBFSA-N 279.260 -0.819 5 20 CBBD C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](O)[C@H](O)C1 278556883 BFKUKUQKNZCIGM-GGZOMVNGSA-N 295.295 -0.041 5 20 CBBD CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1COC[C@H]1O 343616900 AUJQWGDKYJKUBR-GHMZBOCLSA-N 281.268 -0.110 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 345277409 BDYYZDPYYDQOEM-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD CCc1[nH]nc(C(=O)NC2(c3nn[nH]n3)CC2)c1[N+](=O)[O-] 357081825 WGFBHLHYVUSSFK-UHFFFAOYSA-N 292.259 -0.188 5 20 CBBD NC(=O)c1ccnc(NC[C@H]2COCCO2)c1[N+](=O)[O-] 357234968 PCKRHHVZWYEFIF-ZETCQYMHSA-N 282.256 -0.084 5 20 CBBD Cc1nn(C)c(N2CCS(=O)(=O)CC2)c1[N+](=O)[O-] 408169994 RDQRWOFCFQPQAG-UHFFFAOYSA-N 274.302 -0.128 5 20 CBBD Cc1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)nn1C 439594093 IGQJUKLBRNMCSK-UHFFFAOYSA-N 264.245 0.472 5 20 CBBD Cn1ccc(CC(=O)NCCn2cc([N+](=O)[O-])cn2)n1 611760370 KCVKOOCVNRMOMJ-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1OCCCO1 787964396 LBKSMOAEWIMKQF-UHFFFAOYSA-N 297.267 -0.364 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)NCCn1cnnn1 807920459 UCBHQUFSRFTLHG-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD O=C(O)[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CCO1 821513221 SOLJTRDUKQUASY-SNVBAGLBSA-N 297.267 -0.458 5 20 CBBD CN(C)C(=O)OCCNC(=O)Cn1ccc([N+](=O)[O-])n1 855652020 XAKRMSBRIBAXHR-UHFFFAOYSA-N 285.260 -0.394 5 20 CBBD COCCC(=O)N(C)CCNc1ncc([N+](=O)[O-])c(N)n1 1101485557 QQVLRDQPZKIYKL-UHFFFAOYSA-N 298.303 -0.126 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)NC(=O)[C@H]2C1 1116504541 NKVPCHKZFPEXFX-ZCFIWIBFSA-N 280.244 -0.931 5 20 CBBD Cc1nncn1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1319001508 KZMQEDAGSXUJBU-UHFFFAOYSA-N 279.260 -0.492 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@]1(O)CCOC1 1319585807 JQDAWQCZAZGXFE-LLVKDONJSA-N 284.272 -0.633 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]1CO 1319888725 UTPNCZSQRJOKQM-SSDOTTSWSA-N 254.246 -0.075 5 20 CBBD NC1(c2noc(Cn3cnc([N+](=O)[O-])n3)n2)CCC1 1345929954 IHUUSKMVJWRTSK-UHFFFAOYSA-N 265.233 -0.045 5 20 CBBD CC1(C(=O)O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1593804781 HPMBAACUKHERBF-UHFFFAOYSA-N 254.202 -0.135 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H](O)CN1 50015951 IJQDMLSHAVVODG-UWVGGRQHSA-N 265.269 -0.066 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1C(=O)CCC1=O 72945331 ZTZDZBGDYYYLSI-UHFFFAOYSA-N 267.245 -0.111 5 20 CBBD COCCN(CCn1ccc([N+](=O)[O-])n1)CC(=O)OC 176243649 ODZWFMZNHAARSB-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CNC(=O)C1 230415414 SBEYIYCVQNANKH-ZCFIWIBFSA-N 264.241 -0.205 5 20 CBBD O=C(CNc1nc2sccn2c1[N+](=O)[O-])NCCO 268315258 LDTDCUSARIYOPB-UHFFFAOYSA-N 285.285 -0.176 5 20 CBBD CN(CCOCCO)CCn1cc([N+](=O)[O-])ccc1=O 337418851 AIIZYROZXXXWDL-UHFFFAOYSA-N 285.300 -0.303 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1 352989705 MYORNQYFAKGTCF-MRVPVSSYSA-N 253.214 -0.829 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 555318999 WYMFMEYXKWKPOA-FSPLSTOPSA-N 267.245 -0.428 5 20 CBBD C[C@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)NCCF 578376960 BFFCLQVVBJXTMU-LURJTMIESA-N 299.262 -0.224 5 20 CBBD Nc1nccc(C(=O)NCCN2CCC2)c1[N+](=O)[O-] 594326580 PPGIMPUGQVAVOV-UHFFFAOYSA-N 265.273 0.008 5 20 CBBD Nc1ccc(NCc2nnnn2C2CC2)nc1[N+](=O)[O-] 596142026 ORTRHGLSFFDQNH-UHFFFAOYSA-N 276.260 0.506 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] 597586619 PEGMKWKOGFICGV-SECBINFHSA-N 285.231 -0.761 5 20 CBBD COC[C@@H](CO)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 619504576 XIEZFVNRECMTAM-SSDOTTSWSA-N 291.285 -0.725 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 782596675 SNSRXRMZBFWODO-KOLCDFICSA-N 297.315 -0.685 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 819253197 PDSHBOGIZKHRQI-ZCFIWIBFSA-N 269.217 -0.881 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccc(O)c([N+](=O)[O-])c1 820291665 JKCOQKIFPGKLGP-UHFFFAOYSA-N 281.184 -0.313 5 20 CBBD CCOCC(=O)N1CC(N(CC)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1079744181 VPIIOUOCOFGONH-GHMZBOCLSA-N 299.327 -0.253 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)N(C)C 1116628897 WRMCIGHXHFFSBR-ZCFIWIBFSA-N 269.261 -0.465 5 20 CBBD CCn1c(CCC[N+](=O)[O-])nnc1N1CCN(C)C(=O)C1 1121758300 LYUIZYFFZJNBKO-UHFFFAOYSA-N 296.331 -0.214 5 20 CBBD C[C@@]1(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 1323924317 ZRJCZKUSOXXSRR-MWLCHTKSSA-N 284.272 -0.553 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCCNC1 1326354524 WXMVNVAHCNJOSB-ZETCQYMHSA-N 253.262 -0.190 5 20 CBBD COC[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@H](C)O1 1350598044 MBNUIOIUMOXFGK-DTWKUNHWSA-N 285.304 -0.168 5 20 CBBD COc1cc(C(=O)N[C@@H]2CNC[C@@H]2O)c([N+](=O)[O-])cc1F 1579142162 JUMOKEUSFHXMCI-SCZZXKLOSA-N 299.258 -0.195 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 191729481 GRDCXSNMPCZQCL-SCZZXKLOSA-N 284.272 -0.601 5 20 CBBD C[C@@H]1C[C@H](O)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 340973308 PKHWYFCBFFOZFG-DVVUODLYSA-N 270.289 -0.393 5 20 CBBD Cc1nc(NC(=O)Cn2ccc([N+](=O)[O-])n2)nn1C 344550093 DQSYDLHDRIXRBU-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 346343199 FLEAEYCWBSXPRW-RQJHMYQMSA-N 281.272 -0.038 5 20 CBBD NC(=O)NC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 359770490 WSGQEVUNWJTYRI-UHFFFAOYSA-N 281.276 -0.396 5 20 CBBD COC(=O)c1cn(CCn2cc([N+](=O)[O-])ccc2=O)nn1 428947764 STPMAZSSJIUSBO-UHFFFAOYSA-N 293.239 -0.165 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 444390848 XLRZKBKXLCXYLF-SECBINFHSA-N 297.315 -0.533 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 571213553 IHHNGLZXCKZLTK-RNFRBKRXSA-N 270.245 -0.230 5 20 CBBD C[C@@H](O)C1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 598383191 BRKGVCWOVLKBKJ-MRVPVSSYSA-N 281.268 -0.214 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(CO)CC1 610768577 HDRAXRXTTFPFLN-UHFFFAOYSA-N 281.268 -0.355 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1c(F)cccc1[N+](=O)[O-] 714027973 BGGXWLCWOBOWAP-LURJTMIESA-N 272.188 -0.091 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(=O)N(C)C[C@H]2C)c1[N+](=O)[O-] 783760154 NJBYZWDXQXKSNB-ZCFIWIBFSA-N 281.272 -0.071 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 787639199 RMUOIMKFXWWWNJ-LURJTMIESA-N 281.232 -0.381 5 20 CBBD O=C(N[C@H](CO)CN1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 840452968 MBCZRMRJPVWNGZ-HBNTYKKESA-N 271.317 -0.385 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NOCCN1CCCC1=O 856039348 XKRUEBFJTWZSEB-UHFFFAOYSA-N 297.271 -0.539 5 20 CBBD CCOC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 919378857 DERMISBBHOUSKG-UHFFFAOYSA-N 257.202 -0.102 5 20 CBBD COCc1nccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1331460280 GGDIIOGBGBBHOK-UHFFFAOYSA-N 293.243 -0.239 5 20 CBBD CO[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@](C)(C(=O)O)C1 1599135657 VRSACDWKQKNKTQ-RFOGZPIASA-N 272.257 -0.258 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)Cn1cc([N+](=O)[O-])cn1 36981182 DSYHGTIMQIJNFB-LURJTMIESA-N 256.218 -0.229 5 20 CBBD CN(C)C(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 135797017 DPAYDSJHHCOWDG-UHFFFAOYSA-N 296.287 -0.243 5 20 CBBD COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285727615 GEWMLMCTQVHLPL-LURJTMIESA-N 258.234 -0.555 5 20 CBBD COCCN(C)CCNC(=O)c1c([N+](=O)[O-])cnn1C 347157655 OYWOXPMBNBNCHZ-UHFFFAOYSA-N 285.304 -0.364 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)c1c([N+](=O)[O-])cnn1C 347163515 VVIVXCXPKQYKDW-LURJTMIESA-N 270.245 -0.133 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@@H](O)C[C@H]1CO 363703618 FVEXSNBMMKWNDZ-YUMQZZPRSA-N 282.252 -0.132 5 20 CBBD COC[C@@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 394601774 DIOHIXHNNJYWCM-JTQLQIEISA-N 272.261 -0.695 5 20 CBBD Nc1nc(=NCCN2C[C@@H]3CC[C@H](C2)O3)[nH]cc1[N+](=O)[O-] 450795118 SOVMNVAYHCRPQF-DTORHVGOSA-N 294.315 -0.336 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnnn1C 787639200 RMUOIMKFXWWWNJ-ZCFIWIBFSA-N 281.232 -0.381 5 20 CBBD C[C@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])S(C)(=O)=O 856435716 QBCLWLDYRBAQLV-FSDSQADBSA-N 250.276 -0.799 5 20 CBBD CNC(=O)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318843600 QLRGJDFKVIWUEO-UHFFFAOYSA-N 269.261 -0.497 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1323291703 UJOXTIAAUAYUPG-SECBINFHSA-N 295.299 -0.095 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H]2CNCCO2)c1[N+](=O)[O-] 1326450090 DETXZKFXGDPHJI-MRVPVSSYSA-N 283.288 -0.645 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CCNC1 1579877578 UKDBNSREIWISAU-LBPRGKRZSA-N 280.284 -0.248 5 20 CBBD O=[N+]([O-])c1cccnc1S(=O)(=O)N1C[C@@H]2C[C@H]1CN2 1580875340 IZQITBSYAYDXLM-YUMQZZPRSA-N 284.297 -0.275 5 20 CBBD C[C@](O)(CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)O 1603256470 QPGYSDWCPIFGKQ-SKDRFNHKSA-N 298.251 -0.420 5 20 CBBD Cc1nc(N2C[C@@H](O)C[C@H](C(=O)O)C2)ncc1[N+](=O)[O-] 1610557048 PIHQDKAFJOPEDN-YUMQZZPRSA-N 282.256 -0.035 5 20 CBBD CCN(C)C(=O)[C@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 231849571 HVSMZXRAPYCNQJ-ONGXEEELSA-N 299.331 -0.391 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H]1C 245915033 WACHDGSPHCGNIB-BDAKNGLRSA-N 297.315 -0.155 5 20 CBBD CN1C(=O)C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 266076372 ANAHJJXRBLCXKE-SCSAIBSYSA-N 266.217 -0.864 5 20 CBBD CNC(=O)C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 285358616 WKBCXJRBIKWQLO-UHFFFAOYSA-N 279.252 -0.070 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 313822441 BHASGJWIMSDBCO-GFCCVEGCSA-N 294.267 -0.761 5 20 CBBD NC(=O)C[C@H](N)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 353260080 TUPSHGXPRMCICP-NSHDSACASA-N 292.295 -0.318 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1cc([N+](=O)[O-])cnc1N 353872444 DFPWQPAXGXZCOW-UHFFFAOYSA-N 298.299 -0.365 5 20 CBBD Cn1cnc(NC(=O)CCn2cc([N+](=O)[O-])cn2)n1 356411967 DOILJESQHNWKCP-UHFFFAOYSA-N 265.233 -0.051 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 436554160 IQXVKMJYUHLYBB-UHFFFAOYSA-N 289.269 -0.681 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)C1 436919590 OPGKUWCLMKMXKE-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD C[C@@H](CC(=O)NCCn1cc([N+](=O)[O-])cn1)NC(N)=O 594322017 JUDJLOXIHTZNNL-ZETCQYMHSA-N 284.276 -0.646 5 20 CBBD Nc1ccc(N2CCN(C(=O)CO)CC2)nc1[N+](=O)[O-] 596179754 PVXJPAOMRHEFIS-UHFFFAOYSA-N 281.272 -0.787 5 20 CBBD CC[C@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600650752 BAYPNTJNEAXTLX-YFKPBYRVSA-N 292.273 -0.530 5 20 CBBD COC[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 780677428 VRXXRFNXEFWLAE-VIFPVBQESA-N 283.240 -0.470 5 20 CBBD CCn1ncn(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c1=O 820387912 GIGYEPJKIRJJIP-UHFFFAOYSA-N 295.259 -0.601 5 20 CBBD Cc1nocc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292792 VXUVLVURJDUCTK-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD NC(=O)CC(=O)NCCNc1ncc([N+](=O)[O-])cc1F 1093539090 UJFHYURBWLGLLG-UHFFFAOYSA-N 285.235 -0.468 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1cn(C)nn1 1325808595 UZKIUASMXRQZGM-UHFFFAOYSA-N 280.244 -0.028 5 20 CBBD CO[C@]1(C(=O)O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 1777155544 LRFZMDLFMCIXCY-LLVKDONJSA-N 284.272 -0.033 5 20 CBBD CS(=O)(=O)CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 42092968 WNBPBIOPTJWRQG-UHFFFAOYSA-N 287.297 -0.049 5 20 CBBD Nc1nc(NC[C@H]2CCS(=O)(=O)C2)ncc1[N+](=O)[O-] 48557257 RCUJICQIOGTEIV-ZCFIWIBFSA-N 287.301 -0.186 5 20 CBBD CC(C)(CC(N)=O)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 186210469 QGKVKOOMSVLLKO-SECBINFHSA-N 285.304 -0.604 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C(F)F 230239828 IDCXBZPSRGZJKS-ZCFIWIBFSA-N 264.188 -0.467 5 20 CBBD Nc1nc(NC[C@H]2CN3CCN2CC3)ncc1[N+](=O)[O-] 269523561 WNJCKXLGYWDLCJ-QMMMGPOBSA-N 279.304 -0.621 5 20 CBBD CNC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])n1C 330519071 HKBQSKMICXFBHF-UHFFFAOYSA-N 254.246 -0.249 5 20 CBBD CN(C)C(=O)CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343219186 CXXNETLYQZKUQB-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD Cc1nc2n(n1)CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2 344008403 JBBSDUKFNGVTRU-UHFFFAOYSA-N 277.244 -0.126 5 20 CBBD CCOC[C@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 355738556 BSJPQXMZSLLPIP-MRVPVSSYSA-N 284.272 -0.102 5 20 CBBD O=C(NC1(c2nn[nH]n2)CC1)c1ccc([N+](=O)[O-])[nH]1 430325286 SBMFLXMKBGHMCM-UHFFFAOYSA-N 263.217 -0.145 5 20 CBBD O=C1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CN1 436976713 CROPJRUJNMJQMO-ZCFIWIBFSA-N 265.225 -0.081 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cncc2nncn12 442464257 AXTXMTMLSLWFKS-UHFFFAOYSA-N 288.227 -0.132 5 20 CBBD C[C@@H](O)CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H](C)CO 571742813 JLKZWECWWYKCJA-RNFRBKRXSA-N 272.261 -0.478 5 20 CBBD Cn1cc([C@H](O)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 797245665 SGTOTVKYLGWAPS-MRVPVSSYSA-N 280.244 -0.485 5 20 CBBD O=C1CC[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)N1 798589970 NYQVGKVPOMHJON-ZETCQYMHSA-N 282.212 -0.860 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H](N2CCOCC2)C1 854727735 BMGSVOONVGHNKA-QJPTWQEYSA-N 283.328 -0.025 5 20 CBBD CN(CCNC(=O)C1CC1)c1ncc([N+](=O)[O-])c(N)n1 1099892073 DFIRFYOBRHNBSZ-UHFFFAOYSA-N 280.288 -0.071 5 20 CBBD C[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@@]2(CCOC2)O1 1121300211 UUVPDJPYHOVAMR-JOYOIKCWSA-N 297.315 -0.024 5 20 CBBD Nc1c([N+](=O)[O-])cnn1Cc1ncnn1CCF 1261655833 HHVZGWNZPIIANH-UHFFFAOYSA-N 255.213 -0.017 5 20 CBBD CN(Cc1nncn1C)C(=O)CCn1cc([N+](=O)[O-])cn1 1342802246 SXHUOOWOVOEYEI-UHFFFAOYSA-N 293.287 -0.032 5 20 CBBD O=CN1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 1347758151 ALIMCOYVRZBQSK-GFCCVEGCSA-N 297.315 -0.684 5 20 CBBD COC[C@H](NC(=O)Cn1c([N+](=O)[O-])cnc1C)C(=O)O 1599169810 HWWOIBBBUZLIGS-ZETCQYMHSA-N 286.244 -0.684 5 20 CBBD O=[N+]([O-])c1ncn(Cc2ccncc2-c2nn[nH]n2)n1 1607086597 ZTSXFEBUNPYQMX-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD CN1C(=O)CC[C@H](Nc2ncc([N+](=O)[O-])cn2)C1=O 90031848 GHFCJHAPOZOXGJ-ZETCQYMHSA-N 265.229 -0.056 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 186816954 MQQXNAATOOPNHF-MRVPVSSYSA-N 283.288 -0.544 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CC(=O)N(C2CC2)C1 267951257 KQLIZAZVDHTNPK-MRVPVSSYSA-N 293.283 -0.329 5 20 CBBD CNC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 286354602 ZJHGTVAAAAWTJK-UHFFFAOYSA-N 282.260 -0.585 5 20 CBBD Cc1nc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n[nH]1 348053495 VDOAYLRRZXVIRC-UHFFFAOYSA-N 278.228 -0.178 5 20 CBBD CNc1nc(C(=O)N[C@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 455987944 DBOPTKKYYQKMDT-ZETCQYMHSA-N 294.271 -0.894 5 20 CBBD CO[C@@H]1C[C@H](C(=O)O)N(CCn2cc([N+](=O)[O-])cn2)C1 574697358 RACPAJKPNWTRFX-NXEZZACHSA-N 284.272 -0.035 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 592006806 WVJWJZYSZQHBJZ-BQBZGAKWSA-N 297.271 -0.673 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 595986093 NZSRXZDJHUAZMV-ZCFIWIBFSA-N 270.201 -0.757 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1 600240816 IDBVTLYHVYOPAU-ZJUUUORDSA-N 295.251 -0.639 5 20 CBBD NC(=O)COC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 731735070 LFUXQZGPYKLIGJ-UHFFFAOYSA-N 282.208 -0.185 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 798129796 YADZSFIAACZIJF-LURJTMIESA-N 273.270 -0.507 5 20 CBBD CN1CCN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC1 821628293 FISMARQLTDAYME-UHFFFAOYSA-N 290.287 -0.078 5 20 CBBD COC(=O)N(C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 855938489 BRLFROBNDCTLLC-UHFFFAOYSA-N 285.260 -0.394 5 20 CBBD O=C(NOCCN1CCCC1=O)c1cc([N+](=O)[O-])n[nH]1 856044518 LLNMMYHBSKPRQX-UHFFFAOYSA-N 283.244 -0.398 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cn1 1100705994 HBPMFNPRHXZTGH-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD CC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1 1254761168 KNJULWMJVZPFSV-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCS(=O)(=O)C2)c1[N+](=O)[O-] 1318292030 ISZOUZDVMGOVNU-LURJTMIESA-N 288.285 -0.457 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCCNCC1 1326612126 PDELTMBQFFWZEM-QMMMGPOBSA-N 268.277 -0.555 5 20 CBBD C[C@@](CO)(NCCn1cc([N+](=O)[O-])ccc1=O)C(=O)O 1592750291 PZURTTQONQZHDA-NSHDSACASA-N 285.256 -0.818 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]1C(=O)O 1608276857 NKOYUBLJLFGFBE-SSDOTTSWSA-N 266.213 -0.129 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N(CCO)CCO)n1 1610437421 CCAKSTIHZXEDSE-UHFFFAOYSA-N 285.256 -0.213 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1C(=O)O 88376114 MUNFYFWAFWSDDM-SECBINFHSA-N 283.240 -0.141 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1c1ncc([N+](=O)[O-])c(N)n1 131862756 MFTYYYZIPPOOFA-RNFRBKRXSA-N 269.261 -0.447 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 185940664 YIDWWUAYLZWQMB-VHSXEESVSA-N 298.299 -0.210 5 20 CBBD N[C@@H]1CC[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]12 248694102 YIWORVQUTBKBER-LPEHRKFASA-N 279.300 -0.013 5 20 CBBD CCS(=O)(=O)NCCNc1c([N+](=O)[O-])ncn1C 263777182 XVKYSJJSUBIJDP-UHFFFAOYSA-N 277.306 -0.321 5 20 CBBD CN1C(=O)C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 266076368 ANAHJJXRBLCXKE-BYPYZUCNSA-N 266.217 -0.864 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1(CO)CC1 285667058 ZKWFLLDQFRPBMZ-SNVBAGLBSA-N 270.289 -0.391 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CO)[C@@H]1CCCO1 344923214 PSCXYZWZEZVMPZ-ZJUUUORDSA-N 298.299 -0.244 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H](O)[C@H]1CCOC1 346418481 KQDLCWJWTLHCRS-OIBJUYFYSA-N 296.283 -0.102 5 20 CBBD NC[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 358139320 RDTAUQWMYSKMML-JTQLQIEISA-N 255.278 -0.549 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1CO 360857143 PWQRRTNFMOPMRO-IUCAKERBSA-N 268.273 -0.122 5 20 CBBD O=C(O)CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 362435486 IHIYFINAMZQAOF-UHFFFAOYSA-N 291.223 -0.010 5 20 CBBD CNc1nccc(C(=O)NCC(=O)NC2CC2)c1[N+](=O)[O-] 553210263 SQGWBWQJTKSEKE-UHFFFAOYSA-N 293.283 0.040 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CNCCCO1 568629596 JJPFJMYSSGSFTN-LLVKDONJSA-N 297.315 -0.324 5 20 CBBD Cc1cc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n(C)n1 583560378 INJBNQPMJKPDBQ-LBPRGKRZSA-N 294.315 -0.016 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCN1CC[C@H](O)C1 600809269 XXJRRXHFNDSYHZ-VIFPVBQESA-N 294.311 -0.027 5 20 CBBD Cc1nn(C)c(NC[C@H](O)CN(C)C)c1[N+](=O)[O-] 717391828 HKDFBXQALRBQKN-QMMMGPOBSA-N 257.294 -0.029 5 20 CBBD CCS(=O)(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 732605446 OUQVBPJQGQYRIC-UHFFFAOYSA-N 262.247 -0.743 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NOCCO 801953035 JCMPNEMGSUXYIF-UHFFFAOYSA-N 259.193 -0.030 5 20 CBBD O=[N+]([O-])c1cnc(NCc2cnn[nH]2)c(-c2nn[nH]n2)c1 823650775 ANRHCQBIOCUKFE-UHFFFAOYSA-N 288.231 -0.100 5 20 CBBD O=[N+]([O-])c1cnn(-c2ccc(-c3nn[nH]n3)nn2)c1 826500857 OXRDIVQCZBURBN-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD Cc1noc(CN2CCC(O)(C(N)=O)CC2)c1[N+](=O)[O-] 1118497163 PFQLVZXYYMFJHU-UHFFFAOYSA-N 284.272 -0.297 5 20 CBBD CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C1(CO)CC1 1261131060 YMWYBOPZDLMWBT-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD CCNC(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1334557353 IWROLOGEWHNLRI-UHFFFAOYSA-N 255.234 -0.508 5 20 CBBD O=C(O)[C@@H](CF)NS(=O)(=O)c1ncccc1[N+](=O)[O-] 1608532205 BLRXPFDXFHFLGX-RXMQYKEDSA-N 293.232 -0.309 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc([N+](=O)[O-])ccc1F 37373449 UDBMQNPJMLDRQB-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](O)C(N)=O)c1 227830720 OMFCDSZCEBVXLS-VIFPVBQESA-N 283.240 -0.361 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 228492574 JLPHLDZMZSTSDA-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CC(=O)N(C2CC2)C1 267864379 IIBCSCUGJKITGR-MRVPVSSYSA-N 293.283 -0.329 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)CO 268835912 LXAVIUFUIXLFIT-SSDOTTSWSA-N 256.262 -0.156 5 20 CBBD O=C(NC[C@@H](O)CO)Nc1ccncc1[N+](=O)[O-] 272739437 QRSHJCFULKHQQJ-ZCFIWIBFSA-N 256.218 -0.536 5 20 CBBD CN(CC1(O)CCCC1)C(=O)Cn1cnc([N+](=O)[O-])n1 330412055 UYKFYUDDUZQRFX-UHFFFAOYSA-N 283.288 -0.050 5 20 CBBD COCCCNC(=O)CN(C)Cc1c([N+](=O)[O-])ncn1C 355781352 BTTOOEILZVUKJH-UHFFFAOYSA-N 299.331 -0.087 5 20 CBBD CN1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C(=O)N1 357460154 QVKFKOCLVKPDGL-VIFPVBQESA-N 280.240 -0.625 5 20 CBBD CCC[C@@H](O)[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 412514771 FBDVKAJTBHLXDO-PSASIEDQSA-N 299.283 -0.053 5 20 CBBD CN(c1nccc(C(=O)O)c1[N+](=O)[O-])[C@@H]1COC[C@H]1O 517746943 HOZFVERQYANPRN-HTQZYQBOSA-N 283.240 -0.116 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CNC(=O)C1 541711535 VDQWFYLJQNVZSE-LURJTMIESA-N 264.241 -0.205 5 20 CBBD CNc1nccc(C(=O)N2CC[C@H](O)C2)c1[N+](=O)[O-] 553196943 LGSYTTMXCTYEHE-ZETCQYMHSA-N 266.257 0.238 5 20 CBBD CNc1nccc(C(=O)NCCOC)c1[N+](=O)[O-] 557427756 VKUXRBCSDWPZIV-UHFFFAOYSA-N 254.246 0.408 5 20 CBBD CCN1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 566628226 BLOCZTVZZHXPEY-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@H]([C@H](C)N)C2)c1[N+](=O)[O-] 592308918 PBTBEQLXPPPXTA-POYBYMJQSA-N 283.288 -0.185 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3CNC[C@@H]3C2)c1 610336110 KHAMQPCWBTWWGP-CKYFFXLPSA-N 281.316 -0.697 5 20 CBBD CCc1[nH]nc(C(=O)NCc2nn[nH]n2)c1[N+](=O)[O-] 618211703 SUPIFVJUYHMROM-UHFFFAOYSA-N 266.221 -0.677 5 20 CBBD O=[N+]([O-])c1ccnn1CN1CCCS(=O)(=O)CC1 742152879 YYUMWZNBXBVANU-UHFFFAOYSA-N 274.302 -0.131 5 20 CBBD C[C@H]1[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 806060403 DNRYVVYGJFODMS-JGVFFNPUSA-N 282.256 -0.046 5 20 CBBD O=C(NCCn1cnnn1)[C@@H](O)c1cccc([N+](=O)[O-])c1 845794276 QCRZALZRGOFDOT-JTQLQIEISA-N 292.255 -0.569 5 20 CBBD Cc1nn(C)c(C(=O)NOCCN(C)C)c1[N+](=O)[O-] 854947379 UBANFDSRRJUXNB-UHFFFAOYSA-N 271.277 -0.140 5 20 CBBD CN[C@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1118203543 SEHMEWGKDPTYCC-ZETCQYMHSA-N 253.262 -0.238 5 20 CBBD NCCOCC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 1326598309 JXTMPBXXLRDIBE-UHFFFAOYSA-N 297.315 -0.070 5 20 CBBD CC[C@@H](C(=O)O)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1350847558 PUOGBBVGWHOIDP-ZJUUUORDSA-N 286.288 -0.053 5 20 CBBD O=C(O)[C@@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCCO1 1594864048 WPGVPYGICRLIDG-NSHDSACASA-N 298.255 -0.459 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)Cn1nccc1[N+](=O)[O-] 128011054 HHKDNZDHMIPPJA-QMMMGPOBSA-N 281.272 -0.342 5 20 CBBD Nc1ccc(C(=O)N[C@@H]2CNC(=O)C2)cc1[N+](=O)[O-] 226711700 NZEJBMQXPXDMKF-ZETCQYMHSA-N 264.241 -0.205 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CCN1 269371633 MLBUEQPXBWSFIE-ZETCQYMHSA-N 285.691 -0.093 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)N(C)C 299522273 PLGMEXSZLFHOCA-VIFPVBQESA-N 282.300 -0.177 5 20 CBBD CNC(=O)CN(C)C(=O)c1c(N)cccc1[N+](=O)[O-] 354347989 JDHXBMFBFUXXQP-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD Cn1cnc(CCNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 359037132 JFCZHBJWCFUYKU-UHFFFAOYSA-N 291.271 -0.096 5 20 CBBD NC(=O)c1ccnc(N2CC(O)(C(F)F)C2)c1[N+](=O)[O-] 425281201 ZFQMGSGWJHMOJE-UHFFFAOYSA-N 288.210 -0.095 5 20 CBBD CC(=O)NCCNC(=O)NCCn1cc([N+](=O)[O-])cn1 490330683 ZFIIWEIVHIRNPQ-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1ccnc(N)c1[N+](=O)[O-] 563370516 VQZZAFQQKIYMQL-UHFFFAOYSA-N 293.283 -0.077 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)CC(N)=O)c1[N+](=O)[O-] 579372102 IUDDSDCTGIRAPP-LURJTMIESA-N 281.272 0.025 5 20 CBBD CCNC(=O)CN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 594242930 WWRSEGIGGQRBAL-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)C[C@@H]2C)c1[N+](=O)[O-] 610241206 AXIJDCZZDKSEEF-LURJTMIESA-N 281.272 -0.023 5 20 CBBD COC(=O)[C@@H](C)OC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748915064 BBTMCKNTSDNTCZ-SSDOTTSWSA-N 284.224 -0.139 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 762715346 BGOUPAFWIOOIOZ-ZDUSSCGKSA-N 294.311 -0.027 5 20 CBBD O=C(OCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1C[C@H]1[N+](=O)[O-] 840669614 FARKSQRHCVZWPM-WCTZXXKLSA-N 288.212 -0.597 5 20 CBBD Cc1nn(C)c(C(=O)N2CCCO[C@@H](CN)C2)c1[N+](=O)[O-] 1118227530 NNSUTSOAGKYDME-VIFPVBQESA-N 297.315 -0.173 5 20 CBBD CN1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 1118852500 MERQOYYQXCDZJQ-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NN1CC(=O)NC1=O 1320814099 LUDJEMNQGOMRKR-UHFFFAOYSA-N 293.239 -0.167 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CNC[C@H]2O)n1 1579642404 DOPWWAHNYGBWMH-LDYMZIIASA-N 280.284 -0.392 5 20 CBBD O=C(N[C@@H](C(=O)O)C1CC1)c1c[nH]nc1[N+](=O)[O-] 1601393653 ZHUGYLQCKUXXEX-ZCFIWIBFSA-N 254.202 -0.089 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCCO1 49121206 RBWWELIIOKVMIF-MRVPVSSYSA-N 269.261 -0.128 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)CC(N)=O 90517236 QJTWGAXGNYMLHS-UHFFFAOYSA-N 254.246 -0.826 5 20 CBBD CO[C@H](C)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 224205332 BATXTIORLAMSPX-PSASIEDQSA-N 258.278 -0.223 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2CCN(CC(=O)O)CC2)n1C 235963339 FXECPTQXLXBAJU-UHFFFAOYSA-N 283.288 -0.157 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@]1(O)CCSC1 270873423 MZVWSLJLWKHYTJ-SNVBAGLBSA-N 286.313 -0.225 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](O)[C@H](O)C1 289796184 YBLJGMAUXZOYFI-HTQZYQBOSA-N 256.262 -0.339 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@H]2C(N)=O)c1[N+](=O)[O-] 339892526 PLJRNBJBRUPBDF-LURJTMIESA-N 267.245 -0.284 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 447741545 NFXJRXRZJRAWRP-CPCISQLKSA-N 284.272 -0.402 5 20 CBBD CNC[C@H](C)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 595122810 VMKJRIKZLVOCIV-ZETCQYMHSA-N 274.302 -0.124 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@@H](O)C1 597409360 FNCQJJJACDPPNX-OTSSQURYSA-N 254.246 -0.179 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2CC[C@H]1C2 597710062 PXSGULMGWSTYGI-VIFPVBQESA-N 265.273 -0.292 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC1(CO)COC1 763642787 FIEXZBFEFHIWBE-UHFFFAOYSA-N 271.229 -0.657 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@H]21 816959327 BFEQIFZEWXIGFB-QMSLJYSESA-N 295.255 -0.936 5 20 CBBD CC(C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 826630887 YLFUVCVJYQYDNI-QMMMGPOBSA-N 272.261 -0.395 5 20 CBBD CCNC(=O)NC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672952 SUKCAKUWUZGZPE-FSDSQADBSA-N 273.245 -0.571 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCNC(=O)CC(N)=O 1093538286 GBFDFSBBBZDKKR-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C(N)=O)C1 1115995333 PHBUIJXBFXARLR-SSDOTTSWSA-N 266.257 -0.119 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCn2nnnc21 1117887461 GKHUYPZJBVHHFY-UHFFFAOYSA-N 292.259 -0.477 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1594724024 SCGDNCSNYRPYEC-SECBINFHSA-N 270.201 -0.709 5 20 CBBD Nc1ccc(N2C[C@@H](O)C[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 1601216195 YNBKXFLGZVKONV-RQJHMYQMSA-N 282.256 -0.156 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1C(=O)O 1603442222 BIYXGBQGQUJPHO-YUMQZZPRSA-N 297.271 -0.245 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H](CO)C(=O)O 19470790 VJSGCCJRVFZFFX-QMMMGPOBSA-N 268.225 -0.301 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H]2CO)c1 75716052 XSIBUVVPAZYNGT-MWLCHTKSSA-N 270.289 -0.391 5 20 CBBD O=C(O)C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 91293488 PVCNCHCLCZDLDM-VIFPVBQESA-N 298.255 -0.507 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 217729293 HCGWVOWOSBBDMS-JTQLQIEISA-N 282.252 -0.213 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)NC[C@@H]3C2)c1[N+](=O)[O-] 267760823 YVKULNOUFJZTSJ-MRVPVSSYSA-N 280.288 -0.149 5 20 CBBD CN(C[C@H](O)CO)C(=O)Nc1ccncc1[N+](=O)[O-] 276210287 ZVBBBYRHKRNXPY-ZETCQYMHSA-N 270.245 -0.193 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(=O)N(C2CC2)C1 344990451 PFQNXVZFPFEENT-UHFFFAOYSA-N 279.256 -0.267 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1 352991039 PJEJILRDVGQRGR-MRVPVSSYSA-N 253.214 -0.829 5 20 CBBD CO[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H](CN)C1 359210689 BJQGAFSNUKPFLG-ONGXEEELSA-N 297.315 -0.244 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H]2CNC[C@@H]2C1 359404066 IWZDZCZCNZPGGN-NXEZZACHSA-N 279.300 -0.222 5 20 CBBD COC(=O)C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 364879140 UGMGRGCCXKXQIZ-SSDOTTSWSA-N 297.271 -0.265 5 20 CBBD CC1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](CO)O1 420641887 ZSXOHMHSCIGSGG-ZETCQYMHSA-N 283.288 -0.057 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 576031287 MADGPOSHJSGSNS-LURJTMIESA-N 281.228 -0.805 5 20 CBBD Nc1nccc(C(=O)NCC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 594375584 DAZBPXNNPIWPDE-GFCCVEGCSA-N 296.283 -0.157 5 20 CBBD CC(CO)(CO)Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 596151390 JQAMIAPKAMFCCB-UHFFFAOYSA-N 269.257 -0.151 5 20 CBBD CN1CC[C@H](Cn2cc([N+](=O)[O-])c(C(=O)O)n2)C1=O 692727686 HNSBMABCMKHDRJ-ZCFIWIBFSA-N 268.229 -0.032 5 20 CBBD O=C(N[C@@H]1CCNC[C@@H]1O)c1cc([N+](=O)[O-])c[nH]1 710372245 BMDDVJIVKYZFLU-APPZFPTMSA-N 254.246 -0.625 5 20 CBBD COC(=O)[C@H](C)OC(=O)Cn1cc([N+](=O)[O-])cn1 759764983 GRIVCBZXOYPKSI-LURJTMIESA-N 257.202 -0.104 5 20 CBBD COCOCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 848171878 USAAUXNXGJVSPE-UHFFFAOYSA-N 299.283 -0.117 5 20 CBBD CN(CCCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cn1 1095719016 MFANEMJYDIMXAJ-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD CCn1ccnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932461 YVRAPIHZZMCVII-NXEZZACHSA-N 281.316 -0.226 5 20 CBBD COCC(=O)NCCCN(C)Cc1c([N+](=O)[O-])ncn1C 1230939979 LHWARNODZURTTM-UHFFFAOYSA-N 299.331 -0.087 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@@H]2CCNC2=O)c1[N+](=O)[O-] 1319984967 RYKARVSDNHACHO-SSDOTTSWSA-N 281.272 -0.403 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCS(=O)CC1 1323233062 FXIOVGJHSLWCKP-UHFFFAOYSA-N 272.286 -0.467 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCCn1cncn1 1331798052 YDUDWIUUSPHNNT-UHFFFAOYSA-N 279.260 -0.260 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2C(=O)OC[C@H]2C1 1335442038 VLRMIYVASOFWFA-SSDOTTSWSA-N 267.245 -0.031 5 20 CBBD CCCNC(=O)[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1337496017 NMWSHUFJNGIYAB-ZCFIWIBFSA-N 269.261 -0.038 5 20 CBBD COCCN1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC1 1519606305 MXIZEUGZTUEZOT-SNVBAGLBSA-N 298.347 -0.079 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)NCCc2cnn[nH]2)nc1 1578049283 UWNNALXVKOXTOV-UHFFFAOYSA-N 298.284 -0.371 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)C1(C(=O)O)CC1 1608159393 QMBHXZXEJABJTF-UHFFFAOYSA-N 297.223 -0.081 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)NC(CO)CO 87749935 JJXSUYRXFXPITG-UHFFFAOYSA-N 270.241 -0.557 5 20 CBBD C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])N1CCOCC1 159860524 DPYIWSBGTOCRFF-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228688336 CZUXIJKRFVIWII-GZMMTYOYSA-N 284.272 -0.553 5 20 CBBD CCN1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 273574249 YSPMKTLBMHNZQZ-LLVKDONJSA-N 297.315 -0.684 5 20 CBBD C[C@@H](O)C[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330386749 BGPUXRLZEFKYFV-RKDXNWHRSA-N 283.288 -0.052 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1 351492196 QJWMJVPPGOPTNJ-UHFFFAOYSA-N 253.262 -0.284 5 20 CBBD CN(C[C@H](O)CO)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 353957743 CISIWSCIYKSUGC-VIFPVBQESA-N 286.288 -0.662 5 20 CBBD CN1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1 356481752 PJNPFQCEOMGOTM-QMMMGPOBSA-N 283.288 -0.611 5 20 CBBD O=C(NC1(c2nn[nH]n2)CC1)c1cc([N+](=O)[O-])c[nH]1 430322752 RRUDRYZMJGSSRF-UHFFFAOYSA-N 263.217 -0.145 5 20 CBBD Cn1cnc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])n1 535783725 LZDOXGLKPAGOEJ-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2COC[C@H]2O)c1 592432688 LTMZGKGUGFHWOH-RAIGVLPGSA-N 298.295 -0.316 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)C(N)=O 756743448 KSALLXXIQQGWBL-SECBINFHSA-N 297.267 -0.167 5 20 CBBD CO[C@H]1C[C@@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)C1 809109538 VNEAUPVAHZGWJE-KNVOCYPGSA-N 256.218 -0.093 5 20 CBBD Cc1noc(COC(=O)C2CC(=O)NC(=O)C2)c1[N+](=O)[O-] 853895870 RODXCOMYVNCISR-UHFFFAOYSA-N 297.223 -0.013 5 20 CBBD CN(CC(=O)N1CCOCC1)c1c([N+](=O)[O-])cnn1C 891500305 AJUNCZSWKSWHRK-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD NC(=O)C(=O)N1CCC(Nc2ncccc2[N+](=O)[O-])CC1 1057411975 CERQCZRHEVRHFG-UHFFFAOYSA-N 293.283 -0.122 5 20 CBBD Cc1nn(C)c(N2CCN(C(N)=O)CC2)c1[N+](=O)[O-] 1320175864 WUMMKYNHDMHPNU-UHFFFAOYSA-N 268.277 -0.163 5 20 CBBD C[C@H](c1nnc(N2CCS(=O)(=O)CC2)n1C)[N+](=O)[O-] 1526643299 KXYKWJJMGURDDC-SSDOTTSWSA-N 289.317 -0.612 5 20 CBBD C[C@H](CO)Nc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1589881813 DZONPHSREFXIJV-RXMQYKEDSA-N 265.233 -0.037 5 20 CBBD CCOC(=O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75677961 KBZOXGMSSRENSW-SNVBAGLBSA-N 286.288 -0.353 5 20 CBBD COCCNC(=O)CNc1nc(C(=O)O)ccc1[N+](=O)[O-] 166835641 ZZSGWLNWCVWVCP-UHFFFAOYSA-N 298.255 -0.138 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1CCOC1 179269498 OQRBMCQJMRONHY-QMMMGPOBSA-N 269.261 -0.121 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 282106845 FGSKYYFQQGNMLX-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD Cc1cn(Cc2nc(=N)[nH]c(=N)[nH]2)nc1[N+](=O)[O-] 337943846 RCNMGRIYPKJQTO-UHFFFAOYSA-N 250.222 -0.842 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 339841301 PHESPAAIZFBOKM-SECBINFHSA-N 289.317 -0.846 5 20 CBBD NC(=O)C[C@@H](N)C(=O)NCCc1ccccc1[N+](=O)[O-] 353706487 FFVLSMQVVKWTDP-SECBINFHSA-N 280.284 -0.544 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 358366068 FMPOOMYEQXNSNL-SNVBAGLBSA-N 267.245 -0.345 5 20 CBBD COC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 362348278 GOUFDUNLWKEJBE-UHFFFAOYSA-N 255.186 -0.402 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1N 429180352 XRNFMRHYRZHQMX-KOLCDFICSA-N 294.311 -0.048 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])nn1C 494758132 PAFQMIZBRYSSQR-ZETCQYMHSA-N 281.272 -0.369 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN2C(=O)NC[C@H]2C1 531226954 QDIIYHJSEDZGNN-VIFPVBQESA-N 293.283 -0.217 5 20 CBBD Nc1nccc(C(=O)NC[C@H]2CC[C@@H](CO)O2)c1[N+](=O)[O-] 570460094 MZQUEDXJUOFYMA-SFYZADRCSA-N 296.283 -0.158 5 20 CBBD CO[C@H]1C[C@H](CC(=O)O)N(c2ncc([N+](=O)[O-])c(N)n2)C1 571288256 VPKFOJXHMZOWCS-RQJHMYQMSA-N 297.271 0.035 5 20 CBBD CN1CC2(CCN(C(=O)Cn3cnc([N+](=O)[O-])n3)C2)C1 597571414 IMAFMBXGZLCPTC-UHFFFAOYSA-N 280.288 -0.650 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@H]1CN2 602587405 GEGRSYARBVMAHY-YUMQZZPRSA-N 251.246 -0.636 5 20 CBBD O=C1NC[C@@H]2CN(c3ncc([N+](=O)[O-])cn3)CCN12 612401405 PYFZCFZAMJIXNK-MRVPVSSYSA-N 264.245 -0.401 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 612754642 QJWYQPFODOJONI-ZETCQYMHSA-N 298.251 -0.251 5 20 CBBD O=C(Cn1ccccc1=O)OCCn1cnc([N+](=O)[O-])n1 749081129 YQUQLGNEBXJGFK-UHFFFAOYSA-N 293.239 -0.409 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)C1CCC2(CC1)NC(=O)NC2=O 814041836 DPRUHWSSICXYIP-ZOTTZIKWSA-N 299.283 -0.037 5 20 CBBD O=C(CN1CCCCC1=O)OCCn1cnc([N+](=O)[O-])n1 815973066 XDGIOAOKDFARGQ-UHFFFAOYSA-N 297.271 -0.258 5 20 CBBD O=C(O)NCCCC(=O)OCCn1cnc([N+](=O)[O-])n1 833280163 NLMWVLDMLTYINQ-UHFFFAOYSA-N 287.232 -0.223 5 20 CBBD CCONC(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1261525815 PILHMDAKPGGDPE-UHFFFAOYSA-N 257.206 -0.885 5 20 CBBD CC(C)S(=O)(=O)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 1319124483 FUNKXOYKWMPTHG-UHFFFAOYSA-N 290.301 -0.012 5 20 CBBD CC1(C)CCN1C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323666443 DZKVIIYRZFHGNV-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD Cc1noc(CN2C[C@@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 1327535715 SBBCKWJCGPJVEJ-HTQZYQBOSA-N 257.246 -0.324 5 20 CBBD Cc1nn(C)c(C(=O)NC/C=C/CO)c1[N+](=O)[O-] 1328390689 GXRBPRCTXPCBQY-ONEGZZNKSA-N 254.246 -0.085 5 20 CBBD O=C1NC[C@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CCN12 1333706874 GEXQFDMZYIXTHT-ZETCQYMHSA-N 279.256 -0.091 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@@H]1C(=O)O 1608273571 RWWYFFAEMKICBX-GMSGAONNSA-N 295.251 -0.163 5 20 CBBD CN(CCNCc1ncnn1C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1753188174 LTYSDTXLWXULPG-RKDXNWHRSA-N 282.304 -0.972 5 20 CBBD COc1ccc(C(=O)N[C@@H](CO)C(=O)O)cc1[N+](=O)[O-] 19266899 WYSHPVKZNYPMQQ-ZETCQYMHSA-N 284.224 -0.221 5 20 CBBD NS(=O)(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 75499026 MBJFWTZDVSIBDZ-SSDOTTSWSA-N 287.301 -0.321 5 20 CBBD CN(C[C@@H](O)CN1CCOCC1)c1c([N+](=O)[O-])ncn1C 81015849 YUGTWXDJGVSVIE-SNVBAGLBSA-N 299.331 -0.542 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CN(C)CCO1 119053776 HVGQNISZXNUILD-UWVGGRQHSA-N 297.315 -0.373 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 138162405 NNIHJBCDURREIJ-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCNC1=O 341750092 KFCDDFVCNOHZGR-SNVBAGLBSA-N 280.284 -0.423 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H]1COC[C@@H]1O 342432510 KMDVCEAAFPFAID-IUCAKERBSA-N 283.240 -0.473 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCOCCO 351730344 NDDQHYXQZFRJTI-UHFFFAOYSA-N 272.261 -0.694 5 20 CBBD Cn1ccnc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1=O 444095843 IENXLNVLYXFDHT-UHFFFAOYSA-N 292.255 -0.086 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nncn1C 515079512 RMBUCERIVWWSGD-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1=O 559275667 JNCUBBLIFNPYBT-SSDOTTSWSA-N 292.251 -0.336 5 20 CBBD O=C(NC[C@@]1(O)CN2CCC1CC2)c1n[nH]cc1[N+](=O)[O-] 560508106 RKQMHXPOPXRJQO-GFCCVEGCSA-N 295.299 -0.496 5 20 CBBD O=c1c([N+](=O)[O-])cccn1CCN1CCNCC1 568996788 BIOUWVSTQRHPCB-UHFFFAOYSA-N 252.274 -0.338 5 20 CBBD C[C@@H](N)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 592475522 LWIYOCAHBALZFA-ZJUUUORDSA-N 269.305 -0.161 5 20 CBBD NC(=O)CN1CC2(CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 1035704771 XOLOEAIZUPRALK-NXEZZACHSA-N 296.327 -0.939 5 20 CBBD CC(C)(C)C(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1046389917 HHKGOXVJGCMTEU-RKDXNWHRSA-N 299.327 -0.613 5 20 CBBD CN(CCNc1ncccc1[N+](=O)[O-])C(=O)CC(N)=O 1101537341 YWRCNGHPFXKNLV-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD CN(C)CCOCCNC(=O)c1c([N+](=O)[O-])cnn1C 1320968011 WRHBKPWEUABRKB-UHFFFAOYSA-N 285.304 -0.364 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1[C@@H]2CNC[C@@H]21 1515553654 LNJWTNCNGMMAKX-GDGBQDQQSA-N 279.300 -0.224 5 20 CBBD CC(C)[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1588960515 BHDAZIZSHAAVNW-ZJUUUORDSA-N 286.288 -0.149 5 20 CBBD Nc1ccc(OCC(=O)NCC(=O)O)cc1[N+](=O)[O-] 1605654921 ZBPNILWPOLXWAI-UHFFFAOYSA-N 269.213 -0.243 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)NC(N)=O 19284642 PSVLWCXYYOGUFT-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD Cc1nn(C)c(N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 43703234 DPWLRHNCZAQWSY-SSDOTTSWSA-N 270.245 -0.073 5 20 CBBD O=C(Nc1nc[nH]n1)c1cc([N+](=O)[O-])c[nH]c1=O 63244288 MHNRQIYRTUBFDA-UHFFFAOYSA-N 250.174 -0.347 5 20 CBBD NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1O 178518185 KNQMKTZHLALDRK-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCO[C@H](C(N)=O)C1 192546557 IMJAZVXKGZBNHJ-QMMMGPOBSA-N 283.288 -0.190 5 20 CBBD CNC(=O)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 285347414 VQBUDPDRJBUZOJ-UHFFFAOYSA-N 292.295 -0.011 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2COC[C@H]2O)cc1 295373591 PYFVRDHRIWXNGS-NXEZZACHSA-N 288.281 -0.367 5 20 CBBD CN(C)CCO[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 339682422 IKQIZGPCYRDRJR-VIFPVBQESA-N 296.331 0.124 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCc2nn[nH]c2C1 343284945 IGTJHEJLPLKOFP-UHFFFAOYSA-N 263.217 -0.366 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1ccc([N+](=O)[O-])[nH]1 357255934 MQTARAQRCAFLBV-UHFFFAOYSA-N 271.273 -0.014 5 20 CBBD O=C(NCCCn1cc(CO)nn1)c1cc([N+](=O)[O-])c[nH]1 357366769 DBCRDEXBZGWGNR-UHFFFAOYSA-N 294.271 -0.173 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 516473105 NNYQCGGZDQFYRV-VXNVDRBHSA-N 283.240 -0.161 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CNCCN1C 574392020 JTZDWDYEYGEGKC-JTQLQIEISA-N 296.331 -0.880 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCOC1 594402761 RJWCMPFTQDHKQC-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCN1CC[C@@H](O)C1 599767356 WPIDQFXWWYPBGF-SECBINFHSA-N 295.299 -0.400 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H](CO)CC(F)F)c1 717712352 IYWCQJHRJMTPEM-IONNQARKSA-N 294.258 -0.242 5 20 CBBD NS(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nn[nH]n1 826394899 DEQLITALCRSFFH-UHFFFAOYSA-N 270.230 -0.578 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@H]1C(=O)O 833178622 HLIHFKKXPJGQIU-JGVFFNPUSA-N 268.229 -0.372 5 20 CBBD Cn1ncnc1CCOC(=O)Cn1ccc([N+](=O)[O-])n1 1348182286 ORMCCLARGOLVGQ-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 50469763 MDSCZJCKWZQHDU-ZETCQYMHSA-N 284.228 -0.897 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCNC(=O)[C@H]1C 104890754 QDJVIMQPSVYUAC-MRVPVSSYSA-N 295.299 -0.163 5 20 CBBD C[C@H](CN(C)c1ncc([N+](=O)[O-])c(N)n1)c1nnn[nH]1 132907848 HWDVAWYSSODCLB-RXMQYKEDSA-N 279.264 -0.280 5 20 CBBD CC(C)(C)[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 159638091 OHEBTZMIJZRMLF-ZETCQYMHSA-N 269.261 -0.052 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1 314818621 QDSXDJBGTYRAFC-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CC(C)(O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 330609489 NVKNGRVDMGBVPS-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD Cc1nn(C)c(C(=O)NCCN(C)C)c1[N+](=O)[O-] 330622839 DFIRBFZEAUSKPE-UHFFFAOYSA-N 255.278 -0.072 5 20 CBBD Nc1ncncc1CNC(=O)c1cc([N+](=O)[O-])cnc1O 339720768 JOVZRYXGFWMHSJ-UHFFFAOYSA-N 290.239 -0.002 5 20 CBBD NC(=O)[C@@H](CO)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 343264391 KNWCMVATMBRENZ-SECBINFHSA-N 294.267 -0.262 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 345904908 CLOUGNRYSTTXEC-VHSXEESVSA-N 295.299 -0.178 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 362062241 DEAHZCLODRREGV-LURJTMIESA-N 271.233 -0.794 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@@H]1OC 487042705 HDCUMNRUNBTKQY-UWVGGRQHSA-N 296.283 -0.061 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CNC(=O)C1 541711551 VDQWFYLJQNVZSE-ZCFIWIBFSA-N 264.241 -0.205 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CO)[C@@H](O)C1 547403079 ZQVMNHCSIPNJKP-KCJUWKMLSA-N 283.284 -0.251 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CCCC2=O)c1[N+](=O)[O-] 576235458 USWYCWJXOIAAAX-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD NS(=O)(=O)c1ccc(N2CC[C@H](O)C2)cc1[N+](=O)[O-] 589111767 OZNLDJGGIGTAAN-QMMMGPOBSA-N 287.297 -0.187 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](OCCO)C1 839730921 KJMLEFWMOLJKDP-OPRDCNLKSA-N 258.274 -0.349 5 20 CBBD Nc1nc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)ncc1[N+](=O)[O-] 849348244 GCBIAVKALFBVMZ-KCQQBQQISA-N 265.229 -0.266 5 20 CBBD CC(C)[C@@H](CO)ONC(=O)c1n[nH]cc1[N+](=O)[O-] 857286392 ZSSGATVBUDZHFH-SSDOTTSWSA-N 258.234 -0.004 5 20 CBBD NC(=O)CC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093538136 ARADMBOQGZGWLN-UHFFFAOYSA-N 267.245 -0.607 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H](O)CC(=O)O)n1 1607709887 RGYUQYFOMKRBSP-MRVPVSSYSA-N 283.240 -0.136 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)c1n[nH]cc1[N+](=O)[O-] 122479013 VDTRFTXDRNZQTQ-UHFFFAOYSA-N 269.261 -0.099 5 20 CBBD CCN1CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1=O 190537903 ZZQOSARLMSHTRX-UHFFFAOYSA-N 281.272 -0.101 5 20 CBBD NC(=O)[C@H](O)CNC(=O)CSc1ccc([N+](=O)[O-])cc1 228508566 OGSSEMPZDZMWQL-SECBINFHSA-N 299.308 -0.351 5 20 CBBD COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)[C@H](C)O 274547076 WXUBQUVXAPFRGW-IMTBSYHQSA-N 298.251 -0.047 5 20 CBBD Cc1nc(N[C@@H]2CC(=O)N(C)C2=O)ncc1[N+](=O)[O-] 296918414 AMRJDFBUOLEVLQ-ZCFIWIBFSA-N 265.229 -0.138 5 20 CBBD CCS(=O)(=O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 352899251 CBVGBGXOTQHARJ-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2c([N+](=O)[O-])cnn2C)O1 362165411 FGHMYELFNZXZQJ-YUMQZZPRSA-N 298.255 -0.013 5 20 CBBD CC1(C(N)=O)CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 569941825 WYXOIWDMKUJBPQ-UHFFFAOYSA-N 279.256 -0.481 5 20 CBBD CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](CN)C1 574400359 IILYQZYNURQACP-JGVFFNPUSA-N 283.288 -0.104 5 20 CBBD NC(=O)c1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)c[nH]1 610889688 RVSAWXCLXXEGLZ-UHFFFAOYSA-N 292.255 -0.352 5 20 CBBD C[C@@]1(C(N)=O)CCN(Cn2cc([N+](=O)[O-])cn2)C1 794702928 GLQSQUBOFIXLLN-SNVBAGLBSA-N 253.262 -0.054 5 20 CBBD Cn1nncc1COC(=O)c1c([N+](=O)[O-])cnn1C 809134165 WHOLWPNTGYSINX-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD O=C(O)CNC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 821533258 BJBMHNABTNRIKG-UHFFFAOYSA-N 289.631 -0.389 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1nc(C)ccc1[N+](=O)[O-] 1100705939 DJSKKERTRWDXIW-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD CCn1cc(CCNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126936837 UBOBCDKANFSWNU-VXGBXAGGSA-N 295.343 -0.184 5 20 CBBD O=C(NC[C@H]1COCCO1)c1n[nH]cc1[N+](=O)[O-] 1319837615 ZQUMSSDDIKKSLS-LURJTMIESA-N 256.218 -0.537 5 20 CBBD Cn1ccnc1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1322450658 XOCXFRHRBFFOPX-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(CO)CCOCC1 1325036699 IEGCSJDOWXKGFI-UHFFFAOYSA-N 298.299 -0.243 5 20 CBBD COC[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1599180278 IBZQJZGTBGPUBU-MRVPVSSYSA-N 287.228 -0.176 5 20 CBBD O=C(O)c1cc(C(=O)NC(CO)CO)cc([N+](=O)[O-])c1 1602244577 DNEHZOGSQGOXSQ-UHFFFAOYSA-N 284.224 -0.624 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 48316427 LMPZXCWKVCMOCK-SSDOTTSWSA-N 255.234 -0.566 5 20 CBBD CC(=O)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 48353472 QTQXIMYQFIOUEA-SECBINFHSA-N 269.261 -0.084 5 20 CBBD CNC(=O)[C@]1(C)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 281956867 KIGZIMVRFNPDBB-LLVKDONJSA-N 280.288 -0.071 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCCNC1=O 356146936 ITBMGRVCHNVNMV-ZETCQYMHSA-N 281.272 -0.273 5 20 CBBD C[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H](CO)O1 357711224 XQYXJFSGTRNNAL-YUMQZZPRSA-N 296.283 -0.325 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCCN(C)C1=O 359598695 NDUCJEGLBZKDSN-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@H]2CNC(=O)O2)c1 495778080 SHBAXJMHXRVNFR-SSDOTTSWSA-N 297.223 -0.349 5 20 CBBD CCO[C@@H]1C[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 515033903 AYHFWXBPTYZFRE-RNFRBKRXSA-N 255.234 -0.520 5 20 CBBD O=c1onc(-c2cccc([N+](=O)[O-])c2)n1C[C@@H](O)CO 519546355 VCJOKIBFZZYYAU-SECBINFHSA-N 281.224 -0.235 5 20 CBBD CCCc1nnnn1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 571478968 OXDCBXIRABCSKV-SECBINFHSA-N 281.276 -0.209 5 20 CBBD Nc1nccc(C(=O)N2CCN3CC[C@H]2C3)c1[N+](=O)[O-] 597709140 WCDRNCHDNFVPBG-QMMMGPOBSA-N 277.284 0.102 5 20 CBBD C/C(=C\Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O)C(=O)O 736122057 RXXWROZDRQFHLR-QHHAFSJGSA-N 281.224 -0.114 5 20 CBBD O=C(O)CNC(=O)COC(=O)Cc1ccccc1[N+](=O)[O-] 821531516 JKJDWOCRNOMNIZ-UHFFFAOYSA-N 296.235 -0.119 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnsn1 990338656 FIEZECBXPFJFBF-HTRCEHHLSA-N 297.296 -0.856 5 20 CBBD Cn1nncc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022064082 VGCTZQGIWWRBCS-JZSSXWJLSA-N 294.315 -0.783 5 20 CBBD CN1CC[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 1118909648 WSIKSDTYIRJPBS-SECBINFHSA-N 295.299 -0.224 5 20 CBBD COCCNCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1332180970 VAXRFNJIWPHPFM-UHFFFAOYSA-N 285.304 -0.397 5 20 CBBD COc1c(O)ccc(CNCC2(O)CNC2)c1[N+](=O)[O-] 1579136305 ILHQKCZWXVYVMQ-UHFFFAOYSA-N 283.284 -0.267 5 20 CBBD CC(=O)NCCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H](C)C(=O)O 1588507978 XSIQZWCSVQRFSX-FTLITQJKSA-N 287.272 -0.911 5 20 CBBD O=C(O)[C@@H]1[C@H]2CN(C(=O)c3cc([N+](=O)[O-])n[nH]3)C[C@H]21 1602206928 FQKQRBYETUUACV-FBMACHJBSA-N 266.213 -0.280 5 20 CBBD O=[N+]([O-])c1ccc(NC(CO)CO)cc1-c1nn[nH]n1 1607081982 IOSFOOPKBBAFAM-UHFFFAOYSA-N 280.244 -0.460 5 20 CBBD C[C@@H](CCO)CNC(=O)Cn1cc([N+](=O)[O-])cn1 97443007 JDLYLFUJZZNHDN-QMMMGPOBSA-N 256.262 -0.074 5 20 CBBD NC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1 265499223 HUDUVNDXAFDERS-MRVPVSSYSA-N 285.691 -0.093 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)CCO 268880855 VEJMVKXOYLZSBR-SSDOTTSWSA-N 256.262 -0.013 5 20 CBBD C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 278864016 SEVOKZFEEVOTGL-ZHAHWJHGSA-N 295.295 -0.041 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)N(C2CC2)C1 279078369 AEXNSMDGMFZVAO-UHFFFAOYSA-N 293.283 -0.110 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285494743 AERVKDFRDCWXMN-UHFFFAOYSA-N 270.249 -0.681 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)NC[C@@H]2C1 332230877 MANOANLSIXJBHJ-MRVPVSSYSA-N 294.271 -0.973 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)[C@H]1CCCO1 344923213 PSCXYZWZEZVMPZ-VHSXEESVSA-N 298.299 -0.244 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1COC[C@@H]1O 352795687 UAQZAFHYQQSVJK-BDAKNGLRSA-N 256.262 -0.517 5 20 CBBD CCN1C[C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 593826238 DTERLQUUIHSLRC-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD CCc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 618923614 JESYHGZOZTUXDN-JTQLQIEISA-N 281.268 -0.267 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(N2CCOCC2)C1 911643040 CWYWXVPJTSOYIO-UHFFFAOYSA-N 295.299 -0.515 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCNc1cnccn1 1116431848 LSLHKGONQIZQAV-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1118090539 LQRIYBBHAQYWCF-WPRPVWTQSA-N 295.303 -0.369 5 20 CBBD O=C(CCNCC[N+](=O)[O-])NCc1cccnc1 1120486998 ZAOLERGYDIPEOR-UHFFFAOYSA-N 252.274 -0.046 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[S@](C)=O 1318887043 NTQLJRONUQPNDV-IBGZPJMESA-N 288.329 -0.015 5 20 CBBD CNC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1329483832 NKRGYJCLPWZXFV-SNVBAGLBSA-N 294.311 -0.176 5 20 CBBD C[C@H](O)[C@H](O)CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1604378856 NYQTZLDMBLLBHC-QUBYGPBYSA-N 298.251 -0.236 5 20 CBBD O=C(O)c1cn(CCn2cc([N+](=O)[O-])cc(F)c2=O)nn1 1610859996 CYPJRLUYUHAXBH-UHFFFAOYSA-N 297.202 -0.115 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1 22216272 KAVPRMRVGHWEKH-MRVPVSSYSA-N 254.198 -0.230 5 20 CBBD CN(CC(N)=O)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 60642962 JPXJRAICGWMXRP-UHFFFAOYSA-N 295.251 -0.077 5 20 CBBD CNC(=O)[C@H](C)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 81580083 QQBJQCRHYZULCL-KOLCDFICSA-N 299.331 -0.534 5 20 CBBD COc1cc(C(=O)NCC(=O)NO)cc(OC)c1OC 225442687 FCQYBGQOFUEPPK-UHFFFAOYSA-N 284.268 -0.052 5 20 CBBD NC[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CCO1 274843617 XCCDJBAEGGTNKR-SECBINFHSA-N 280.284 -0.023 5 20 CBBD COC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCOC1 285500660 AGWGKKSNTBBLPQ-JTQLQIEISA-N 284.228 -0.620 5 20 CBBD CN(C)C(=O)[C@@H]1CSCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286577666 WITFVJUHAMQSID-ZETCQYMHSA-N 299.312 -0.079 5 20 CBBD CCS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])o1 298441937 RYPPMWDSPXHHOH-UHFFFAOYSA-N 291.285 -0.143 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 330695130 IZXBIKWLRZYKNA-JTQLQIEISA-N 296.331 -0.847 5 20 CBBD CNc1nc(C(=O)N[C@]2(CO)CCOC2)ccc1[N+](=O)[O-] 456014101 VZCGYBLMKVCARX-LBPRGKRZSA-N 296.283 -0.087 5 20 CBBD Cc1nn(C)c(C(=O)NC2CN(C(=O)O)C2)c1[N+](=O)[O-] 740244680 TVBSFRAJRGNFTF-UHFFFAOYSA-N 283.244 -0.271 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCc1nc(O)n[nH]1 774936730 XSICBGWJMHHNDT-UHFFFAOYSA-N 282.216 -0.252 5 20 CBBD CONC(=O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 798157605 NWBAHBHYUVRWAK-UHFFFAOYSA-N 289.269 -0.449 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1COC(=O)C1 820073675 IWRNIXOCSVSODM-ZETCQYMHSA-N 268.229 -0.469 5 20 CBBD CC(C)(O)CONC(=O)NCCn1cc([N+](=O)[O-])cn1 824454222 BEMRTJGCPHIAEA-UHFFFAOYSA-N 287.276 -0.207 5 20 CBBD CCN(CCC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 829701763 OEAVMCLETNBMCT-SNVBAGLBSA-N 286.288 -0.051 5 20 CBBD CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839714123 BSDZVKSVPKFIKL-HRDYMLBCSA-N 257.290 -0.072 5 20 CBBD CCONC(=O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 844599061 RJZDYNOQNJDLSI-UHFFFAOYSA-N 283.244 -0.399 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CCOCC1 990032433 OYWCQPDTKFNUOO-GHMZBOCLSA-N 297.311 -0.595 5 20 CBBD O=C(NCC1CN(C(=O)c2cc[nH]c2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001805617 PGZAOIOOIZOMJU-GHMZBOCLSA-N 292.295 -0.132 5 20 CBBD Cc1cc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1C 1157767472 NYASCVFPSTVWOU-VXGBXAGGSA-N 295.343 -0.010 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cnnn1C 1321485655 OAZFZOQVQQAKST-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCO[C@@H]([C@@H]2CCCO2)C1 1339667951 VEPBBBBGDJUWGM-VHSXEESVSA-N 297.315 -0.024 5 20 CBBD CCS(=O)(=O)C[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1341403153 AZLVJLKEPKDLMG-LURJTMIESA-N 290.301 -0.129 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])C1(CN)CCOCC1 1578392823 NPUNZYBMPSDOIL-UHFFFAOYSA-N 283.288 -0.102 5 20 CBBD C[C@](O)(CO)CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 1603690539 KSQWDXWDENMAQU-LLVKDONJSA-N 294.271 -0.070 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 1608602133 QAGSTWVTQDXFDJ-APPZFPTMSA-N 295.251 -0.103 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610733116 NAXQRHZPLVYDTE-NGJRWZKOSA-N 258.230 -0.912 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1 6121858 KMZRMOYSKWVZTI-UHFFFAOYSA-N 296.239 -0.211 5 20 CBBD CCN(CC)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 42650109 PEUMOAJDAXGWPY-UHFFFAOYSA-N 296.283 -0.276 5 20 CBBD CN1CC[C@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)C1=O 177916329 HLIRPJXQXWGINA-VIFPVBQESA-N 296.287 -0.679 5 20 CBBD C[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])N1CCOCC1 330542466 IUGGQZAAXDYWRJ-SECBINFHSA-N 297.315 -0.221 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)[C@H](C)O 347922684 QALSRZOZXYJMLV-XVKPBYJWSA-N 297.267 -0.050 5 20 CBBD COCC[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C(N)=O 357471390 OMBZXVBKFHSYKG-VIFPVBQESA-N 296.283 -0.004 5 20 CBBD CN1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 357545846 ZOIKUYCBBVQWOZ-QMMMGPOBSA-N 293.283 -0.244 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N[C@H](CO)C(=O)NC 361014689 OEHHRULGTGIZMS-SSDOTTSWSA-N 271.277 -0.362 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 586810174 CSIBDOVFQVMKMH-LURJTMIESA-N 267.245 -0.332 5 20 CBBD CCN1C[C@@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 593499304 QJNQRNYCQNCBCY-SSDOTTSWSA-N 280.288 -0.331 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(C(=O)O)CC1 598658801 MNCXYWVNWNXXFW-UHFFFAOYSA-N 295.251 -0.263 5 20 CBBD CCNC(=O)CN(C)CCn1cc([N+](=O)[O-])cn1 610447458 STBPPMHJIPVUEF-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCC(=O)N1CCC1 746972436 ZUFSEEAOCIKLDU-UHFFFAOYSA-N 282.256 -0.125 5 20 CBBD COC[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C(N)=O 760081265 HGHHFRCCMFQZLZ-VIFPVBQESA-N 296.283 -0.377 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 808171938 OPYYVJQUTTWHFU-VIFPVBQESA-N 282.300 -0.171 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC[C@@H](O)C1 823621149 WZKYKSADOULMBL-ZCFIWIBFSA-N 277.244 -0.259 5 20 CBBD CN(C[C@H]1CCCN(CC[N+](=O)[O-])C1)S(C)(=O)=O 930440682 DIYIRRBEGVZMKU-SNVBAGLBSA-N 279.362 -0.134 5 20 CBBD Cn1nnc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)n1 1094042743 ITTWEYBPNDCOGS-UHFFFAOYSA-N 292.259 -0.645 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1150015555 YTZGSLYLASTZKH-ZETCQYMHSA-N 253.218 -0.925 5 20 CBBD CO[C@]1(CNC(=O)c2c([N+](=O)[O-])cnn2C)CCOC1 1337981974 WOGKSTKMOOUUGU-NSHDSACASA-N 284.272 -0.136 5 20 CBBD CNC(=O)CN(C)c1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 1591208711 UAMMPPUFMLSJLP-UHFFFAOYSA-N 291.271 -0.043 5 20 CBBD COC[C@@]1(C(=O)O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1593963385 DKBUCXDRZXLZLX-SOCHQFKDSA-N 272.257 -0.399 5 20 CBBD COCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 6119934 BLRAARHYFXXSPF-UHFFFAOYSA-N 255.230 -0.481 5 20 CBBD O=C(O)C1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1 71172777 RDHMWIMFYRJYEM-UHFFFAOYSA-N 267.197 -0.560 5 20 CBBD C[C@H](O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 85989455 COPVZEAQFUHALB-WCBMZHEXSA-N 258.278 -0.487 5 20 CBBD CN(C)C[C@@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 133025776 LKLFNZVYFQUZRN-JTQLQIEISA-N 270.293 -0.309 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 227870661 PRPVXPJIPNVROS-MRVPVSSYSA-N 271.204 -0.690 5 20 CBBD CC1(C)[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 228861969 ZFBPEIJYJDYRFR-OUAUKWLOSA-N 284.316 -0.099 5 20 CBBD CC(C)CN(CC(N)=O)c1ncc([N+](=O)[O-])c(N)n1 269353338 SOAAXWZRLRKQDR-UHFFFAOYSA-N 268.277 -0.085 5 20 CBBD CCN(CCO)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 274483931 ARONVUORCPHAIA-UHFFFAOYSA-N 285.304 -0.778 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 285286087 AWQKUAGQWOQHRG-YFKPBYRVSA-N 256.218 -0.143 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCOC1 285500668 AGWGKKSNTBBLPQ-SNVBAGLBSA-N 284.228 -0.620 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)CO 305123998 CFOQFJLYJUSFSO-SSDOTTSWSA-N 256.262 -0.013 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@H]3C(=O)NC[C@H]32)c1[N+](=O)[O-] 337155572 UVJSDUTUASXKFH-HTQZYQBOSA-N 293.283 -0.023 5 20 CBBD CN1CCN(CCNC(=O)c2ccc([N+](=O)[O-])n2C)CC1 345376129 FGYKXBWLAUUHGL-UHFFFAOYSA-N 295.343 -0.090 5 20 CBBD CN1CCC(CCO)(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 354741620 YPGRWMLLIDXXIS-UHFFFAOYSA-N 297.315 -0.106 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1O 355989222 YTTRKYUJFPONCH-RXMQYKEDSA-N 268.229 -0.440 5 20 CBBD C[C@@H]1CNCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 432525457 HUBKPESWBGIUOQ-PSASIEDQSA-N 267.289 -0.095 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 558757541 IHLKGMIYYVVEPW-LURJTMIESA-N 269.261 -0.228 5 20 CBBD Cc1nn(CC(=O)Nc2c([N+](=O)[O-])cnn2C)c(=O)n1C 594004454 JFNKJZOXHDUWPL-UHFFFAOYSA-N 295.259 -0.829 5 20 CBBD CN1CC2(CCN(C(=O)Cn3ccc([N+](=O)[O-])n3)C2)C1 619251587 CGWMRVLVPCDNDZ-UHFFFAOYSA-N 279.300 -0.045 5 20 CBBD O=C1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCCN1 726778848 SJCICKACEDDBKW-UHFFFAOYSA-N 294.267 -0.895 5 20 CBBD NC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCCC1 733762435 OMGLFGKFBUPUII-UHFFFAOYSA-N 281.272 -0.294 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 763696851 LUEILBBEBJVAEL-SNVBAGLBSA-N 297.267 -0.803 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2cnsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020138806 BHKXQWGKWLPLCY-KHUVANEUSA-N 297.340 -0.060 5 20 CBBD NC(=O)C(=O)NCCCNc1ncccc1[N+](=O)[O-] 1094742083 MMYQZSYFQDYMFQ-UHFFFAOYSA-N 267.245 -0.607 5 20 CBBD O=C(N[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 1258436957 LKGZXOGWAXDRMV-YFKPBYRVSA-N 274.258 -0.765 5 20 CBBD C[C@H]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C(=O)O1 1261246002 XPMVHTBAQYLOEI-CRCLSJGQSA-N 254.202 -0.248 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCC1(O)CCOCC1 1324254250 PTVLCVRAUZPXDE-UHFFFAOYSA-N 298.299 -0.161 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCO[C@@H](CN)C1 1326451060 KWIAOWFNDYVMRE-QMMMGPOBSA-N 283.288 -0.482 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCn1cc(-c2nn[nH]n2)nn1 1592412850 LIVNSSQWYSKDRW-UHFFFAOYSA-N 290.247 -0.428 5 20 CBBD COC(=O)C1CC2(C1)CN(CC[N+](=O)[O-])C[C@@H]2C(=O)O 1593824646 QWEJLNQDWGGTLA-NBBOBHDQSA-N 286.284 -0.151 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H](O)C[C@H](C(=O)O)C1 1608158699 CQGBPKWPMPFROK-BQBZGAKWSA-N 298.255 -0.764 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCC[C@@H]1C(=O)O 1608380223 ITKGRMHSMHIELJ-NKWVEPMBSA-N 283.244 -0.444 5 20 CBBD COC(=O)CCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 23233957 GUBMXYMAQJEKCV-UHFFFAOYSA-N 283.240 -0.034 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@@H](O)C1 236079856 MVTUTSKVATXVEF-IUCAKERBSA-N 255.230 -0.889 5 20 CBBD C[C@@](O)(CNC(=O)CNc1ccccc1[N+](=O)[O-])C(=O)O 262556974 VEXMVWZIHSQNKG-GFCCVEGCSA-N 297.267 -0.042 5 20 CBBD CC(=O)N1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 301641350 GQWUDDSZGQWETK-SSDOTTSWSA-N 266.261 0.000 5 20 CBBD CN(CCOCCO)C(=O)c1n[nH]cc1[N+](=O)[O-] 337601288 JOVWHFUZFSIWHW-UHFFFAOYSA-N 258.234 -0.601 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)Cn1cnc([N+](=O)[O-])n1 357455040 IFWXCGFLYVNJOY-UHFFFAOYSA-N 284.276 -0.844 5 20 CBBD CCCc1[nH]nc(C(=O)NCC(=O)NCCO)c1[N+](=O)[O-] 432730885 RAUPNYUVKPVIKF-UHFFFAOYSA-N 299.287 -0.891 5 20 CBBD Cc1cccc(C(=O)N[C@H]2CN(C)NC2=O)c1[N+](=O)[O-] 539781945 UACYFJJZZLWOKQ-VIFPVBQESA-N 278.268 -0.022 5 20 CBBD COC(=O)[C@@H]1CNCCCN1CCn1cc([N+](=O)[O-])cn1 592985022 ZZVDNRKPXPQWIH-NSHDSACASA-N 297.315 -0.372 5 20 CBBD NS(=O)(=O)c1ccc(NCc2nn[nH]n2)c([N+](=O)[O-])c1 609496587 KHMKLLZMTNJUGN-UHFFFAOYSA-N 299.272 -0.633 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N1CC(O)(C(=O)O)C1 706441536 XWLXAAHSJNVNKN-UHFFFAOYSA-N 256.170 -0.541 5 20 CBBD CNC(=O)C1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCC1 751239766 ODOLYHFKESZMTQ-UHFFFAOYSA-N 296.287 -0.639 5 20 CBBD COC[C@@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C(N)=O 760066099 UJLOIBZLYUMJHX-MRVPVSSYSA-N 297.267 -0.167 5 20 CBBD CCc1[nH]nc(C(=O)O[C@@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 798653518 NDODVOOXHFUNQE-ZCFIWIBFSA-N 296.239 -0.158 5 20 CBBD C[C@@H]1CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 839619928 CCYFCKWEUMZCRY-OPRDCNLKSA-N 257.290 -0.512 5 20 CBBD COCC(=O)NC1CCN(Cn2cc([N+](=O)[O-])cn2)CC1 917460207 VVGCAEQTFJEYIV-UHFFFAOYSA-N 297.315 -0.024 5 20 CBBD O=C(Cn1nccn1)NCCNc1ccc([N+](=O)[O-])cn1 1093903074 MOOLLGPJXSZDMH-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD Cn1cnc(CNC(=O)CCn2cc([N+](=O)[O-])cn2)n1 1253990643 XUOLPFGKCQJHAD-UHFFFAOYSA-N 279.260 -0.374 5 20 CBBD O=C(NCCC(=O)N1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1256271811 XIRVRFOROKFHKW-UHFFFAOYSA-N 297.271 -0.703 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCCOC1 1323395054 JQPDFUAOHGSKFK-UHFFFAOYSA-N 267.241 -0.037 5 20 CBBD CS(=O)(=O)CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1336411499 FEGJUKUTIWNPES-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1NC[C@H]1COCO1 1607080833 QVJSHEFPMITFFI-ZETCQYMHSA-N 293.243 -0.045 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 1608675967 SLRSJKHGEBSWIY-ZCFIWIBFSA-N 284.224 -0.134 5 20 CBBD CN(CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1nncn1C 1751974173 ANIFDOGUWMJMKQ-NXEZZACHSA-N 296.331 -0.582 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H](CO)C(=O)O 19429321 SLUCIXDVIYYPLO-VIFPVBQESA-N 268.225 -0.301 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 44859395 BOGHFAOWEYHJMW-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD CCOC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 47296129 CVZLBTCQPQRUIQ-RKDXNWHRSA-N 271.273 -0.048 5 20 CBBD C[C@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 50162263 GRTZRNNOUAXSFF-SSDOTTSWSA-N 270.245 -0.030 5 20 CBBD CC1(C)[C@H](O)C[C@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 128544279 ZFBPEIJYJDYRFR-HBNTYKKESA-N 284.316 -0.099 5 20 CBBD C[C@H]1CO[C@H](CO)CN1c1ncc([N+](=O)[O-])c(N)n1 131862553 MFTYYYZIPPOOFA-BQBZGAKWSA-N 269.261 -0.447 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](C(=O)O)C1CC1 262139336 LSARGBRNOJIFOY-LLVKDONJSA-N 295.251 -0.264 5 20 CBBD CN(CC(C)(CO)CO)c1ncc([N+](=O)[O-])c(N)n1 269281218 LKPRUMDIRXPPRK-UHFFFAOYSA-N 271.277 -0.606 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNc1ncc([N+](=O)[O-])c(N)n1 279165665 UICIZHNWIALGLR-QUBYGPBYSA-N 269.261 -0.081 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[C@H]1O 286580534 QEMYBLCNIUGYTB-IJLUTSLNSA-N 284.316 -0.003 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 287174693 SJBWOYYHDBXJMI-LHLIQPBNSA-N 270.245 -0.412 5 20 CBBD COCC[C@H](CO)NC(=O)Cn1ccc([N+](=O)[O-])n1 336805442 ZJNIZWBKBREQQU-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD CC(C)c1[nH]nc(C(=O)NC[C@@](C)(O)CO)c1[N+](=O)[O-] 338632783 JMFWZMLENVQFKP-LLVKDONJSA-N 286.288 -0.086 5 20 CBBD COC(=O)c1cnc(NCCn2cc([N+](=O)[O-])cn2)nc1 342672093 KXTMASLBWYIBHZ-UHFFFAOYSA-N 292.255 0.480 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1CO 360853719 JVFSDVDUGJBCPW-DTWKUNHWSA-N 268.273 -0.122 5 20 CBBD O=C(NCCN1CCCOCC1)c1n[nH]cc1[N+](=O)[O-] 438689057 YGQGRAHRBKQUDH-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCOC1 446729362 PPIXFTGGSZDNHN-LLVKDONJSA-N 298.255 -0.312 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC(=O)N1 447754835 BPEZKQOOYNRAHL-SSDOTTSWSA-N 293.283 -0.030 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N 449701492 SPQWUHZJVIFOJP-VIFPVBQESA-N 293.327 -0.190 5 20 CBBD CNc1nc(C(=O)NCC(C)(CO)CO)ccc1[N+](=O)[O-] 521634259 KKPPWJINYVTHPM-UHFFFAOYSA-N 298.299 -0.248 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1C(=O)CNC1=O 609594404 YNLPZIJFTHKBKB-UHFFFAOYSA-N 295.255 -0.785 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 618935284 ACNURCZNRXMZIH-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD NC(=O)CCOC(=O)CCn1cc([N+](=O)[O-])cn1 759555582 WIKIABSHDQASHN-UHFFFAOYSA-N 256.218 -0.400 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)N1CCCC1=O 766961974 AGGKZFOASJOUJZ-UHFFFAOYSA-N 296.239 -0.366 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)CN1CCCC1 808218554 JDHMBGHSTUYSON-SNVBAGLBSA-N 297.315 -0.636 5 20 CBBD Nc1nccc(C(=O)NC[C@H]2COCO2)c1[N+](=O)[O-] 861976690 ARWGKWXYGUUULM-LURJTMIESA-N 268.229 -0.325 5 20 CBBD CCC(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001807460 OGKSTTKUSQVFAK-RKDXNWHRSA-N 255.274 -0.364 5 20 CBBD COC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)OC 1323544119 OVKMRVISBVUDIM-LURJTMIESA-N 286.244 -0.754 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCCC(=O)O 1594469266 FQWVXLSSAZQDBH-UHFFFAOYSA-N 256.218 -0.309 5 20 CBBD Nc1nccc(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c1[N+](=O)[O-] 1601221486 DLDVEDDFHJHPTL-JIGDXULJSA-N 292.251 -0.025 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1ncc[nH]1 70990848 RTXUVDOHYLRNLR-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 153451887 VTYKAMIYNDTRGW-GFCCVEGCSA-N 299.331 -0.390 5 20 CBBD CC(=O)NC[C@@H](C)OC(=O)Cn1ccc([N+](=O)[O-])n1 157291102 URCFQUKQTHDEDF-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD CNC(=O)CCN(C)CCn1ccc([N+](=O)[O-])n1 176228033 IGESQQGTXDUMCG-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD CC1(O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 177333264 RNDHWNXGSZMSRR-NSHDSACASA-N 284.316 -0.001 5 20 CBBD C[C@](O)(CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(=O)O 262691097 CIORPPUSOXOIPW-NSHDSACASA-N 284.224 -0.134 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342448820 UDRVJXSEXFSNKC-YUMQZZPRSA-N 284.272 -0.532 5 20 CBBD O=C1CCCC(=O)N1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 342457054 UBOGUSOAMVCVHO-SECBINFHSA-N 282.256 -0.309 5 20 CBBD CNC(=O)COc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 344622884 GSNWQDGTJQUIPF-UHFFFAOYSA-N 289.269 -0.633 5 20 CBBD NC(=O)N[C@H](CO)C(=O)Nc1cc([N+](=O)[O-])ccc1O 356320612 LHDGFYVPROWSQN-SSDOTTSWSA-N 284.228 -0.732 5 20 CBBD Cn1[nH]c(C2CCNCC2)nc1=NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 369151677 GNSNOARCIPBGHI-RKDXNWHRSA-N 294.315 -0.692 5 20 CBBD C[C@H]1CN(CCNc2ncc([N+](=O)[O-])cn2)CCO1 546189069 WTXAUIOMHZVZSR-VIFPVBQESA-N 267.289 0.517 5 20 CBBD C[C@H](O)CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H](C)CO 571742814 JLKZWECWWYKCJA-RQJHMYQMSA-N 272.261 -0.478 5 20 CBBD CO[C@](C)(CO)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 594590181 VYBWHWOIFXGRNF-NSHDSACASA-N 284.272 -0.102 5 20 CBBD O=C(N[C@H]1C[C@H](O)C1)c1cnc(O)c([N+](=O)[O-])c1 598528665 UUYUGUSYOOGGJK-LJGSYFOKSA-N 253.214 -0.052 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 600216864 GYJJCPRPUDPBJB-UWVGGRQHSA-N 268.225 -0.522 5 20 CBBD CCNC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 604530299 WYADFPYDKNFPDH-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD CC(C)C1(O)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 773895348 IFNCZYIZZOBFSI-NSHDSACASA-N 284.316 -0.145 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc(C(N)=O)cc1[N+](=O)[O-] 808047630 RIRLPXXXIBHBOU-SECBINFHSA-N 282.256 -0.788 5 20 CBBD O=C(Nn1c(O)nnc1O)c1cccc([N+](=O)[O-])c1 816731135 CLFALBXKHZJXLG-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1CC(C(=O)O)C1 864205106 FAIRVWIJFRFGKD-UHFFFAOYSA-N 269.217 -0.834 5 20 CBBD CNC(=O)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1 1101556235 GNYRCYRAGUBSIN-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@]2(O)CCO[C@@H]2C)c1[N+](=O)[O-] 1321428859 CIBLZHQVGMAAOW-PELKAZGASA-N 298.299 -0.094 5 20 CBBD NS(=O)(=O)CCCn1cc([N+](=O)[O-])ccc1=O 1322403821 JULPUHXNLUQPCX-UHFFFAOYSA-N 261.259 -0.565 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nc(=O)n(C)[nH]1 1342634499 GBZMSFHOOYOSPZ-UHFFFAOYSA-N 296.243 -0.735 5 20 CBBD Cn1ncnc1COC(=O)Cn1ccc([N+](=O)[O-])n1 1348704095 KVDXVFIBSRRGCQ-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD CON(C)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1350745068 YCNZFHRCMLLKEJ-UHFFFAOYSA-N 257.250 -0.449 5 20 CBBD O=[N+]([O-])c1cnn(-c2cc(-c3nn[nH]n3)cnn2)c1 1607085755 MQINODGEYMRVSL-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD CN(CC(N)=O)c1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1609272887 FWRNRHDTTUTGIQ-UHFFFAOYSA-N 277.244 -0.304 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[C@@H](O)C1 35187305 IRLJPFPVPGAKCW-MRVPVSSYSA-N 267.241 -0.120 5 20 CBBD CC(C)N(CCn1cc([N+](=O)[O-])cn1)CC(N)=O 172717199 DYHCODQGOYXZDT-UHFFFAOYSA-N 255.278 -0.013 5 20 CBBD NC(=O)C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 176189960 FVGRSBJVWBHDGL-UHFFFAOYSA-N 267.289 -0.011 5 20 CBBD CNS(=O)(=O)CCNc1ncccc1[N+](=O)[O-] 221041408 LSKSCPUDAXGACC-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD COC(=O)[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H](C)O 277929590 ATLATQXXYNNESQ-YLWLKBPMSA-N 299.239 -0.652 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCNC(=O)C1 302616066 CYWGOJGOLOMYTB-UHFFFAOYSA-N 299.308 -0.066 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1COC[C@H]1O 342394705 DEUNZKAURNTFID-NKWVEPMBSA-N 256.218 -0.850 5 20 CBBD Cn1ccnc1CNC(=O)c1cc([N+](=O)[O-])nn1C 356462412 QRCKCQOHQHUJJQ-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD CN(C)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548712805 XNQIZCPEUIOGOL-UHFFFAOYSA-N 253.262 -0.137 5 20 CBBD CNc1nccc(C(=O)N(C)Cc2nc[nH]n2)c1[N+](=O)[O-] 553577420 BABMZKOSKJFDIZ-UHFFFAOYSA-N 291.271 0.422 5 20 CBBD COC[C@@]1(C(=O)O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 565041182 LQQCSADINWETEU-LLVKDONJSA-N 297.271 -0.106 5 20 CBBD Cn1cnc(NCCn2cc([N+](=O)[O-])cn2)cc1=O 566485503 LTNFDEVTQSEQGD-UHFFFAOYSA-N 264.245 -0.003 5 20 CBBD C[C@H](CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600652196 NYUVDOPAGQYTGT-RXMQYKEDSA-N 292.273 -0.673 5 20 CBBD COC[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])C(N)=O 760062490 KOJYGEOOHKYFFE-QMMMGPOBSA-N 297.267 -0.410 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCc1nc(=O)n(C)[nH]1 765422083 SJNUBIKJYLQKNL-UHFFFAOYSA-N 281.228 -0.288 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCCN1CCOCC1=O 785290764 ACAQMYWQUDODMR-UHFFFAOYSA-N 297.267 -0.051 5 20 CBBD Cc1cc(C(=O)NC[C@H](O)C(N)=O)c(N)c([N+](=O)[O-])c1 788206458 AHUGCGYDCSNPSL-QMMMGPOBSA-N 282.256 -0.939 5 20 CBBD O=C1CCC[C@@H](CC(=O)OCCn2cnc([N+](=O)[O-])n2)N1 808990086 BCABIZJLBOTNCJ-QMMMGPOBSA-N 297.271 -0.212 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@]1(C)CCOC1=O 813297467 MGGDBTWGAZRHIG-NSHDSACASA-N 282.256 -0.078 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNOC[C@@H]2CCOC2)c1 819255684 CWSOKBDHWHPNSU-KOLCDFICSA-N 286.288 -0.290 5 20 CBBD C[C@@H](CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 827443079 YDRBSUDJFFMMPH-WCBMZHEXSA-N 286.288 -0.195 5 20 CBBD COC(=O)c1cnn(CC(=O)O[C@H](C)C[N+](=O)[O-])c1 860789117 YXRWGTGFURCJIM-SSDOTTSWSA-N 271.229 -0.122 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NN1CCOC1=O 862698121 GQEJJCOJKKOYBX-UHFFFAOYSA-N 255.190 -0.725 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1ccc([N+](=O)[O-])cc1 862739512 OQHJDNHCMBBTCB-UHFFFAOYSA-N 299.308 -0.030 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 863624600 JIDPNOGLXMPETM-ZETCQYMHSA-N 285.260 -0.684 5 20 CBBD Cn1nccc1CCN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292790 VWGXEOZHCQLHPG-VXGBXAGGSA-N 293.327 -0.572 5 20 CBBD Cc1nc2n(n1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1116415422 UUTAJIMMDXYKHE-ZETCQYMHSA-N 291.271 -0.037 5 20 CBBD CN(C)CC1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1118709682 MVFZIZKTBPWKDC-UHFFFAOYSA-N 253.262 -0.049 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(CNCCO)CC1 1205230908 YAEQPWMILMLRKH-GHMZBOCLSA-N 271.317 -0.528 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(=O)O 1598333663 LJRFFAZMUZMENH-SECBINFHSA-N 297.267 -0.164 5 20 CBBD O=C(O)CNC(=O)[C@H]1CCCN1c1ncc([N+](=O)[O-])cn1 1608752401 QCDWUOWRFBGJOQ-MRVPVSSYSA-N 295.255 -0.446 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1COCCO1 48809561 OFGHNVVVGCWMPY-MRVPVSSYSA-N 270.245 -0.677 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@]1(C(=O)O)CCOC1 85850435 KKFKRBBPCAFNPJ-JTQLQIEISA-N 284.228 -0.849 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 110516893 CHNUMJTYRFLHEH-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD C[C@H](CN)CNC(=O)CCn1cc([N+](=O)[O-])cn1 237528639 BAJWLSRVNOSSKQ-MRVPVSSYSA-N 255.278 -0.108 5 20 CBBD Cc1nn(C)c(NCC(=O)N2CCOCC2)c1[N+](=O)[O-] 271876417 LMFOVEMMAIADSA-UHFFFAOYSA-N 283.288 -0.093 5 20 CBBD CNC(=O)C1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 274254308 ICNRYBYMBVZYAE-UHFFFAOYSA-N 252.234 -0.851 5 20 CBBD CN1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 330855347 NHEHHESOXCEHRL-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD Cn1nnc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])n1 362969345 LBMYIBSFOWFNCB-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1c([N+](=O)[O-])ncn1C 489998350 NPKBVABFNCEDAD-ZETCQYMHSA-N 253.262 -0.005 5 20 CBBD Cn1nnc(Cn2cc([N+](=O)[O-])cc(F)c2=O)n1 578069749 VLHGLPZRHORTSF-UHFFFAOYSA-N 254.181 -0.533 5 20 CBBD C[C@@H](N)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 592547236 UKGSARGPBAHBNE-SSDOTTSWSA-N 255.278 -0.010 5 20 CBBD CCN1C[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 593826163 ULKSNQRSMSFAFO-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD NCCN(Cc1ccccc1[N+](=O)[O-])C[C@H](O)CO 595902182 LCWZQDZSJJJNSP-NSHDSACASA-N 269.301 -0.291 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2C[C@H]1CN2 602590751 ZISWGVNHPYTNHY-WPRPVWTQSA-N 278.268 -0.671 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCCN1CCNC1=O 726389311 OYQDPHWJNVRCNO-UHFFFAOYSA-N 297.271 -0.332 5 20 CBBD O=C(O)NCCOC(=O)Cn1cc([N+](=O)[O-])cn1 739974347 YKUZKYCKBZTJQY-UHFFFAOYSA-N 258.190 -0.398 5 20 CBBD COC(=O)[C@@H]1CC[C@H](C(=O)OC)N(CC[N+](=O)[O-])C1 931176462 LDUFTEUWSGPIFX-RKDXNWHRSA-N 274.273 -0.310 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@@H]2CCNC2=O)c1=O 1118322937 WVGFZPXUHNMGJT-ZETCQYMHSA-N 294.267 -0.618 5 20 CBBD COc1cccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932107 IWLNBDPJIITKCO-GHMZBOCLSA-N 294.311 -0.039 5 20 CBBD CN(C)C(=O)CCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1320699148 BCYWPQWVSYAXSI-UHFFFAOYSA-N 296.283 -0.276 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCO1 1325151930 ZAQKTXJQKXGIRP-SSDOTTSWSA-N 297.271 -0.787 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CNCCCO1 1328331448 CIUGVDQBHWNWLS-MRVPVSSYSA-N 283.288 -0.563 5 20 CBBD CN(CC1=CCCOC1)C(=O)Cn1cnc([N+](=O)[O-])n1 1328811273 LNRFRZPDVVGYOK-UHFFFAOYSA-N 281.272 -0.009 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@@H]2[C@H](C1)C2(F)F 1329611837 CUUOVVXVMXKIDK-OLQVQODUSA-N 273.199 -0.090 5 20 CBBD CN(C)CC1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1347795989 VNEWUHFKPUTSIJ-UHFFFAOYSA-N 253.262 -0.049 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CCF)C(=O)O 1601386631 FQDYAYYGAWNWGU-LURJTMIESA-N 274.208 -0.280 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CF)C(=O)O 1608159391 QKEHSKHZWMRQDC-SCSAIBSYSA-N 260.181 -0.519 5 20 CBBD O=C(O)C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1610751609 CUYWLZLCCDPKKN-ZETCQYMHSA-N 283.244 -0.444 5 20 CBBD CCOC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 44569946 NFHMZLYBTVKTKN-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CN(C)C(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 49097823 WVSSSLFZQZDMRI-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD NS(=O)(=O)CCNC(=O)c1csc([N+](=O)[O-])c1 56863211 XVUDOBXLGVNBFC-UHFFFAOYSA-N 279.299 -0.325 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCC(N)=O)ccc1[N+](=O)[O-] 263776193 XLEUGCNTZPQHKB-UHFFFAOYSA-N 294.267 -0.765 5 20 CBBD COCCN(CC(=O)N(C)C)c1c([N+](=O)[O-])ncn1C 267012428 GZLBWWKRCXKEEO-UHFFFAOYSA-N 285.304 -0.131 5 20 CBBD Cc1ccc(NC(=O)C(=O)N(C)CC(N)=O)cc1[N+](=O)[O-] 298968668 LFNSBVPZTWXUOP-UHFFFAOYSA-N 294.267 -0.215 5 20 CBBD CC(C)(CNC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 299148747 WTOBDJJRDKDBGX-UHFFFAOYSA-N 283.288 -0.191 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 339310428 JQLAXOMOKFCHIZ-NSHDSACASA-N 284.272 -0.239 5 20 CBBD C[C@@]1(C(=O)O)CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 347517660 MJYBXJJOVNUTQF-SNVBAGLBSA-N 283.244 -0.491 5 20 CBBD COC(=O)Cc1nc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n[nH]1 353084374 JMSNRNVRRDMTJN-UHFFFAOYSA-N 295.215 -0.596 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])nn2C)CCOC1 359477470 BAEGIPQADJFSCN-LLVKDONJSA-N 298.255 -0.610 5 20 CBBD COC(=O)N[C@@H](C)C(=O)OCCn1cnc([N+](=O)[O-])n1 494015281 SKMKLBMTGGJNQF-LURJTMIESA-N 287.232 -0.526 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 555558435 OUQVSFRBJWHVQS-ZETCQYMHSA-N 266.213 -0.590 5 20 CBBD CC1(C)NCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 565711009 BTFDFDHDIKHAFU-ZETCQYMHSA-N 268.277 -0.557 5 20 CBBD Nc1ccc(NCCN2CC[C@@H](O)C2)nc1[N+](=O)[O-] 599176026 ORPFGUQNKZXXHQ-MRVPVSSYSA-N 267.289 0.051 5 20 CBBD O=Cc1ccc(OCC(=O)Nc2nn[nH]n2)c([N+](=O)[O-])c1 736155677 CYSXOBZEOGHNPM-UHFFFAOYSA-N 292.211 -0.062 5 20 CBBD C=CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1N 759844518 NNESSOBPKQALMU-UHFFFAOYSA-N 279.256 -0.396 5 20 CBBD COC[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 780677405 VRXXRFNXEFWLAE-SECBINFHSA-N 283.240 -0.470 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN(c2ncc(F)cn2)CC1 839724740 CGEJZPODFUPJMR-NXEZZACHSA-N 295.274 -0.071 5 20 CBBD Cc1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1C 1030292712 TZPCJTUBHKJESP-VXGBXAGGSA-N 293.327 -0.306 5 20 CBBD O=[N+]([O-])c1cn(Cc2ncccn2)nc1-c1nn[nH]n1 1593486013 IRZDPIIEENSYDN-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD CN(CCNC(=O)c1nn(C)cc1[N+](=O)[O-])CC(=O)O 1598495448 KWPIGYJRUQFQKE-UHFFFAOYSA-N 285.260 -0.926 5 20 CBBD Cc1[nH]nc(C(=O)N2CCOC[C@@H]2CC(=O)O)c1[N+](=O)[O-] 1599968216 LXUQRPRAQOGFHV-ZETCQYMHSA-N 298.255 -0.058 5 20 CBBD O=C(O)CN1CCC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1606240457 LDQMCBLNOJNIDG-RKDXNWHRSA-N 271.273 -0.683 5 20 CBBD COC[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 10452400 CLCGXPBDSPXASL-QMMMGPOBSA-N 269.257 -0.092 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@@H](CO)C1 168346929 IABTUTSCAFDUTE-SECBINFHSA-N 270.245 -0.989 5 20 CBBD CCN(C)C(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 278042744 LCOPUGRFUPAKNX-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD C[C@@H]1[C@H](N(C)CCO)CCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 294780151 YZUVVTPGFMXRGO-PSASIEDQSA-N 297.315 -0.155 5 20 CBBD COC(=O)C1(O)CCN(CCn2ccc([N+](=O)[O-])n2)CC1 354841059 UPJYFDRJVQURLK-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD CO[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1OC 357687600 HHUDFXXPNMNNFR-IUCAKERBSA-N 296.283 -0.061 5 20 CBBD CC(C)[C@](C)(CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 429262545 JHAQUTAFRZQIRS-JTQLQIEISA-N 270.293 -0.324 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 436740741 RFPZMLCNYBIMGR-SECBINFHSA-N 298.251 -0.046 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 548057708 OVWHIEYREPHGTB-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CC(=O)NC1=O 563742467 VDSUVSNARSGNAJ-MRVPVSSYSA-N 294.267 -0.190 5 20 CBBD CC(=O)NCCN(C)CCn1cc([N+](=O)[O-])ccc1=O 575178617 KZKLTZNCTLSABC-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD C[C@H](N)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 592985012 ZXYQPJFOASHJDQ-GXSJLCMTSA-N 269.305 -0.161 5 20 CBBD C[S@](=O)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 737172159 GYYOQEAVWSBUNW-FQEVSTJZSA-N 297.300 -0.040 5 20 CBBD O=C(NCC1OCCCO1)c1cc([N+](=O)[O-])n[nH]1 832772623 SYMPYGPNBQLKTP-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD CN(C)C(=O)N[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 840475037 RQIVFANPEVQLCJ-OPRDCNLKSA-N 284.316 -0.086 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](N2CC[C@@H](O)C2)C1 861720314 XVDNSIFNMFJXHP-GWOFURMSSA-N 269.301 -0.681 5 20 CBBD O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 862583820 PKNLXLNYLHIQDA-GARJFASQSA-N 282.252 -0.808 5 20 CBBD COCC(=O)N(CCO)CCNc1ncccc1[N+](=O)[O-] 1111420263 QZHBQAMTGVQWLE-UHFFFAOYSA-N 298.299 -0.131 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1339633637 MYJZRAYDFCHMRU-MRVPVSSYSA-N 297.267 -0.224 5 20 CBBD NS(=O)(=O)c1cccc(N2CC3(CNC3)C2)c1[N+](=O)[O-] 1580364176 JRAZTMMPQXHTJR-UHFFFAOYSA-N 298.324 -0.348 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC(=O)O)c1=O 1593874549 HAYBWYCXYYXMMV-UHFFFAOYSA-N 256.170 -0.372 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H](CCF)C(=O)O)n1 1608122813 WCVDXTGYHCWCEC-RXMQYKEDSA-N 274.208 -0.129 5 20 CBBD CCOC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 37564540 MBXCDUZFOAIFIB-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD O=C1CCCC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 194369610 RQHYKWZGZUQQNT-JTQLQIEISA-N 295.299 -0.034 5 20 CBBD C[C@@H](C(=O)NC[C@H](O)C(N)=O)c1cccc([N+](=O)[O-])c1 228493143 CSRSYQQTVLCPDU-XCBNKYQSSA-N 281.268 -0.339 5 20 CBBD CC(C)[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 264354833 DONCMIVFKRYEBW-JTQLQIEISA-N 283.288 -0.193 5 20 CBBD CC(C)[C@@H](N)CNC(=O)Cn1ccc([N+](=O)[O-])n1 269294430 VPBAYGCUKJHEPY-QMMMGPOBSA-N 255.278 -0.109 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 274379152 FVXVPSDHZIULEG-JGVFFNPUSA-N 284.272 -0.070 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 282142473 JLCZQRJKISCUCL-IMTBSYHQSA-N 294.267 -0.050 5 20 CBBD Cn1nncc1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 345929294 OIMCHQOCXRIXEF-UHFFFAOYSA-N 293.287 -0.029 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-] 354008416 DDRSHXDEKFZAJC-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)C1CCOCC1 360662716 YCPAEWBMOXSGLI-NSHDSACASA-N 298.299 -0.305 5 20 CBBD COC(=O)[C@@](C)(O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 361674620 RGWJSNMLHSNFLP-NSHDSACASA-N 298.255 -0.575 5 20 CBBD COCCNC(=O)CNc1c(C(N)=O)cccc1[N+](=O)[O-] 420581779 IHFXCLJJPSQXHK-UHFFFAOYSA-N 296.283 -0.132 5 20 CBBD O=C(NC[C@@H](O)COCC1CC1)c1c[nH]nc1[N+](=O)[O-] 554879271 QBGLGHJXTQKHDK-MRVPVSSYSA-N 284.272 -0.165 5 20 CBBD CNC(=O)NC(=O)CSc1ncc([N+](=O)[O-])c(N)n1 583883275 MFDIHKNLEWGTQJ-UHFFFAOYSA-N 286.273 -0.485 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 594330626 FWBYSKLSUYKGAT-HTQZYQBOSA-N 296.283 -0.401 5 20 CBBD Cn1cc(C[C@H](CO)Nc2ncc([N+](=O)[O-])c(N)n2)cn1 596277394 KOQULINCCNZSBP-MRVPVSSYSA-N 293.287 -0.284 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 597655614 YZSXSDFHDZNMME-QMMMGPOBSA-N 283.284 -0.047 5 20 CBBD CC(C)(C(=O)NCCn1cnnc1)n1cc([N+](=O)[O-])cn1 597714747 IVRYWIYSSMNEDJ-UHFFFAOYSA-N 293.287 -0.066 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cn1 617711178 HZIHRLHDFCHZMB-VIFPVBQESA-N 281.224 -0.085 5 20 CBBD CC(C)NC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748917984 SVUOSEPSYZLGKK-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD O=[N+]([O-])c1cc(S(=O)(=O)N(CCO)CCO)cs1 768884919 ZRORNQOONOYNII-UHFFFAOYSA-N 296.326 -0.368 5 20 CBBD CC(C)(O)CONC(=O)Cn1ccc([N+](=O)[O-])n1 791263937 OTQDJNDJJPTART-UHFFFAOYSA-N 258.234 -0.390 5 20 CBBD C[C@@H](COC(=O)c1cn(CC(=O)N(C)C)nn1)[N+](=O)[O-] 813103416 QCKKRJHXPFJTHO-ZETCQYMHSA-N 285.260 -0.812 5 20 CBBD CCS(=O)(=O)CCNCCn1cc([N+](=O)[O-])cn1 819175992 FUDCISVUVSCGRS-UHFFFAOYSA-N 276.318 -0.184 5 20 CBBD CC1(C)OCC(CO)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CO1 834509524 CCTHXCLLAFYVNW-HTQZYQBOSA-N 274.273 -0.718 5 20 CBBD COC[C@@](C)(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)OC 840393788 ZEXXOLKWGNKNQF-BRDIYROLSA-N 260.246 -0.654 5 20 CBBD CC(C)(CN1CCOCC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840522193 JMIOJMSHDLKJNM-NXEZZACHSA-N 271.317 -0.121 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2csnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022063388 ADEKSCFIUWLPMS-BKFJMODKSA-N 297.340 -0.060 5 20 CBBD CCC(=O)N(CCO)CCNc1ncc([N+](=O)[O-])c(N)n1 1111422185 ICAIIKXSRGCPFZ-UHFFFAOYSA-N 298.303 -0.390 5 20 CBBD CNC(=O)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1115931916 IMMZYKOEYNPPMO-UHFFFAOYSA-N 255.234 -0.508 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(NC(N)=O)CC1 1318979364 GZYOOSAZVXNXOB-UHFFFAOYSA-N 268.277 -0.035 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NCC1(CO)COC1 1319364832 CCZLLJODXZBCER-UHFFFAOYSA-N 299.287 -0.901 5 20 CBBD O=C(CNC(=O)c1n[nH]cc1[N+](=O)[O-])NCC(F)F 1326894360 IIUVIJWRVFDKRR-UHFFFAOYSA-N 277.187 -0.571 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H](O)C2CC2)c1 71304736 LULOMGOMDYMRDL-WDEREUQCSA-N 270.289 -0.487 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cccc([N+](=O)[O-])c1 90261720 GZFQMEXOKYUHSW-QMMMGPOBSA-N 254.198 -0.230 5 20 CBBD Cc1cc(C(=O)NCCS(N)(=O)=O)cc([N+](=O)[O-])c1 123119286 GUDGSMYBOWMWJW-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CCS(=O)(=O)C1 157414296 SZGJBSRJYISAET-VIFPVBQESA-N 288.329 -0.090 5 20 CBBD COC[C@@H](C)OC[C@H](O)Cn1cnc([N+](=O)[O-])n1 234894992 NQSUJSYARXDDLP-HTQZYQBOSA-N 260.250 -0.401 5 20 CBBD COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(N)=O 343294380 YBUJTDPYEJTCKF-ZETCQYMHSA-N 284.272 -0.447 5 20 CBBD CC(=O)NCCCNC(=O)c1cc([N+](=O)[O-])cnc1N 349876027 PXRQJWRFOHFZGY-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD CC(C)(CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 354479583 OIQCIFJYBGFCQN-UHFFFAOYSA-N 296.283 -0.616 5 20 CBBD O=C(NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1cc[nH]n1 355954626 KWOBBWSTKHCJBN-UHFFFAOYSA-N 292.255 -0.194 5 20 CBBD CN(C)C(=O)CCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357167482 CRNMHTGPXKVAEV-UHFFFAOYSA-N 295.299 0.369 5 20 CBBD COC(=O)CN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 357768501 ZBEIRSRWHBAIRI-UHFFFAOYSA-N 270.245 -0.118 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@]12CCOC2=O 364449549 VESWVXVPZKFKQD-XLDPMVHQSA-N 254.242 -0.040 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])n1C 394067535 JPZHSPONKFTMAS-SECBINFHSA-N 281.316 -0.433 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cnc[nH]1 493209097 IAJWBNHNEKYBAO-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OC[C@H]1CNC(=O)O1 495649193 GDSMJRRHZRGHAQ-SSDOTTSWSA-N 270.201 -0.557 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2OCCN[C@@H]2C1 572167427 FKQVVJJNULWEMU-MWLCHTKSSA-N 281.316 -0.109 5 20 CBBD Cc1nn(C)c(N2C[C@@H](CO)[C@H](CO)C2)c1[N+](=O)[O-] 705349172 FJXWPJOCRPQHND-IUCAKERBSA-N 270.289 -0.326 5 20 CBBD CC[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 727001199 AUQLNMBJIKTNAY-QMMMGPOBSA-N 270.245 -0.012 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCCOCCO 740237673 RCRJBDOYJZUOSZ-UHFFFAOYSA-N 286.240 -0.691 5 20 CBBD CS(=O)(=O)CC(=O)OCCn1ccc([N+](=O)[O-])n1 748123805 RXGKGAXCIBFBQE-UHFFFAOYSA-N 277.258 -0.621 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)O[C@H]1CCNC1=O 770004048 IAKLKKQFSLDNSQ-QMMMGPOBSA-N 268.229 -0.387 5 20 CBBD COCC(=O)COC(=O)CCn1cc([N+](=O)[O-])cn1 795472439 HXGJHKGETHGSNI-UHFFFAOYSA-N 271.229 -0.060 5 20 CBBD C[C@H]1C(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1148126773 YXKMDJLAIKPKLU-LURJTMIESA-N 279.256 -0.587 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCN1CCCC1 1322847100 VBDRYDQNYIQAFX-UHFFFAOYSA-N 294.311 -0.032 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1N1CC(CO)C1 1607081036 YPJAEONVMKEYNG-UHFFFAOYSA-N 277.244 -0.402 5 20 CBBD O=C1CN(NC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1 29018433 ZGXASUJJQBUXFX-UHFFFAOYSA-N 264.197 -0.209 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)COc1ccccc1[N+](=O)[O-] 35160325 NCOKDAWKYUACDA-MRVPVSSYSA-N 298.251 -0.376 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)Cn1nccc1[N+](=O)[O-] 48705934 UVSVCFCBTDVTSE-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD C[C@H](Cn1cccn1)NC(=O)Cn1cnc([N+](=O)[O-])n1 48777505 FIAOAXSBXCGCEW-MRVPVSSYSA-N 279.260 -0.412 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(N)=O 160102128 AVQMQZTXVCXPLG-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD CC(C)N1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 172119494 NSZZQFDDFGXARI-SNVBAGLBSA-N 295.299 -0.083 5 20 CBBD CNC(=O)N1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 267219014 NVTCQHRMMICFJX-UHFFFAOYSA-N 296.287 -0.725 5 20 CBBD COC(=O)[C@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1 268011881 QGMBVIJNYLZWLC-NSHDSACASA-N 298.255 -0.760 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])s1 269564248 ZWWCTQBQAYDAOM-UHFFFAOYSA-N 273.270 -0.112 5 20 CBBD CCCNC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274924751 YNUCMBXWGUPFPS-UHFFFAOYSA-N 282.256 -0.049 5 20 CBBD CC(CO)(CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 274934206 ODKBFMJVVDRTFL-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1Cc1c([N+](=O)[O-])ncn1C 331283692 FEOUQRRENGVPIH-NXEZZACHSA-N 298.299 -0.173 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)NC[C@H]2C1 332259284 URBMZYPWZMEEAY-QMMMGPOBSA-N 294.271 -0.973 5 20 CBBD COC(=O)NCC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 494073214 WVHKMEVOOFDJTP-UHFFFAOYSA-N 299.239 -0.344 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CNCCO1 519763313 GCDJATABUJCCQA-SNVBAGLBSA-N 283.288 -0.714 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 561316215 OCBCIJPVGCREIP-MRVPVSSYSA-N 293.283 -0.008 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1[C@H]2CC[C@H]1CNC2 595990641 AHCATKOWDNYRRV-YUMQZZPRSA-N 265.273 -0.095 5 20 CBBD Cc1c([N+](=O)[O-])cc(C(=O)NOCC(N)=O)cc1[N+](=O)[O-] 772948063 DREQRVOGQXUPMY-UHFFFAOYSA-N 298.211 -0.042 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc(N)cc1[N+](=O)[O-] 808047169 HDWIMIDLMAGILD-VIFPVBQESA-N 254.246 -0.304 5 20 CBBD COCCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839663936 VTDSXMZFVIOSQY-GMTAPVOTSA-N 271.317 -0.121 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC(N2CCOCC2)C1 894370619 ZHXLKMDFLKXZSW-UHFFFAOYSA-N 267.289 -0.151 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CCN(CCO)CC2)C1 1040699782 FWHRAJVBAUTXSM-VXGBXAGGSA-N 297.355 -0.042 5 20 CBBD NC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 1055999501 RSIGZIDKPNVIDL-UHFFFAOYSA-N 278.268 -0.271 5 20 CBBD CC(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)[C@@H](C)C1 1121297533 BQLSYKDIHFNOHW-QMMMGPOBSA-N 282.304 -0.351 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N=c1nc[nH]n1C 1319153429 SFCCAPQJVSLEQL-UHFFFAOYSA-N 265.233 -0.711 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 1320788157 NMWRZXRHYBCIKW-SSDOTTSWSA-N 272.213 -0.158 5 20 CBBD Cc1nnc(CN(C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 1347140730 YTWQXQKLMKXQLR-JTQLQIEISA-N 296.287 -0.024 5 20 CBBD O=C(O)CCN1CC[C@H](OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 1608724373 MFLJJBDEFSBNKX-PRJMDXOYSA-N 286.240 -0.730 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])s1 35160522 IWUFYUWQPZQVNW-YFKPBYRVSA-N 274.254 -0.080 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CCO1 50955624 BCSHJEMFGABQBO-MRVPVSSYSA-N 252.230 -0.320 5 20 CBBD CN1CCO[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)C[C@@H]21 120925855 HOZBFMHIENUTSA-RYUDHWBXSA-N 281.316 -0.194 5 20 CBBD C[C@H]1CNCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 125768280 TVLCSNSNACEFLJ-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CNc1ccc(C(=O)NCCOCC(N)=O)cc1[N+](=O)[O-] 227047321 UQGFVELINUPNDS-UHFFFAOYSA-N 296.283 -0.132 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1C[C@H](O)C[C@H]1C(=O)O 253085982 AEVGTPHDUMOOFD-BDAKNGLRSA-N 284.272 -0.380 5 20 CBBD C[C@@]1(CN)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 262137120 WYPJTVRZZLUKJT-NSHDSACASA-N 267.289 -0.011 5 20 CBBD O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)NCCO 268389303 FLQJNPJPZQRMNR-UHFFFAOYSA-N 282.256 -0.175 5 20 CBBD CC(C)(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 285284248 FWHNTRJTCBSXOG-ZETCQYMHSA-N 269.261 -0.052 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285974818 ONLDUQFBKSVCSH-NSHDSACASA-N 281.272 -0.084 5 20 CBBD COCCN1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 289126572 UUSNZVFTRJMKLW-UHFFFAOYSA-N 283.244 -0.794 5 20 CBBD O=C(CO)N1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 330719042 AYKIMVUDYHXLQQ-UHFFFAOYSA-N 283.240 -0.536 5 20 CBBD C[C@@H]1[C@H](CO)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 427831250 XAOIXYVSYLCOBJ-ZJUUUORDSA-N 295.295 -0.014 5 20 CBBD O=[N+]([O-])c1cn(CCN2CCCS2(=O)=O)cn1 448102631 LSNFVSIMLSKTAE-UHFFFAOYSA-N 260.275 -0.173 5 20 CBBD CNC(=O)C1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 559022205 GYRMGWWUXYLMNG-UHFFFAOYSA-N 253.218 -0.864 5 20 CBBD COC(=O)c1cc(NC(=O)C2(O)CNC2)cc([N+](=O)[O-])c1 595928369 CDOLRYVRTHLJRA-UHFFFAOYSA-N 295.251 -0.346 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1=O 770455538 PRQTVONAQPOFPT-UHFFFAOYSA-N 293.239 -0.284 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CC(C)(C)OC1=O 817069933 LFXPBZIIIPJHIN-SSDOTTSWSA-N 297.271 -0.261 5 20 CBBD COC(=O)c1nc[nH]c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 847023936 FWABGIISEOWCNI-RFZPGFLSSA-N 254.202 -0.200 5 20 CBBD C[C@H](COC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)[N+](=O)[O-] 860777204 MJLNUQQKQOPFSK-BDAKNGLRSA-N 294.329 -0.134 5 20 CBBD C[C@H]1COC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 928893097 KIZUOEDDEOCMOD-YUMQZZPRSA-N 254.246 -0.058 5 20 CBBD CN1CCC[C@@H](N2CCN(CC[N+](=O)[O-])CC2)C1 929982364 SSJMNWUQGNCSCK-GFCCVEGCSA-N 256.350 -0.025 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCCNC(=O)C(N)=O 1094742402 WUJRBZYJDMECHD-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD CN(C)CC[C@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 1118336959 IDWOWXFNVVOSSA-JTQLQIEISA-N 284.320 -0.814 5 20 CBBD NC(=O)NCC(=O)NCCNCc1ccccc1[N+](=O)[O-] 1123235124 HUAAEWBBTHQAJD-UHFFFAOYSA-N 295.299 -0.531 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 1339096618 XCLSQCGRRKAAEV-DTWKUNHWSA-N 298.299 -0.548 5 20 CBBD Cc1nn(C)c(C(=O)OCc2nc(=O)n(C)[nH]2)c1[N+](=O)[O-] 1342638925 XDEDVWSCYROOBF-UHFFFAOYSA-N 296.243 -0.584 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1344728114 PNFYRRJGSOWLFY-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD O=C1CCC(=O)N1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1347177921 KOVAKBCBTRVPLZ-QMMMGPOBSA-N 268.229 -0.699 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CCO[C@@H](C)C1 1355638022 BCEVGIUDDOBVQH-VIFPVBQESA-N 285.304 -0.074 5 20 CBBD C[C@@H](c1nnc(N2CCC[C@@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1525462176 KDERNKMTYXBVAV-JGVFFNPUSA-N 282.304 -0.146 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1COC[C@@H]1O 1593469885 BGPBOZJJGRRDAB-SCZZXKLOSA-N 292.255 -0.054 5 20 CBBD O=C(O)C1(NS(=O)(=O)c2ccc([N+](=O)[O-])cn2)CC1 1601723495 ALSUSMBEXVLOPK-UHFFFAOYSA-N 287.253 -0.115 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CCO1 50845414 SOMKOMJKJDKFJC-SSDOTTSWSA-N 285.281 -0.017 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@]1(CO)CCOC1 182935800 ZDOUYMZKXBVJRZ-JTQLQIEISA-N 270.245 -0.941 5 20 CBBD CCN(CCO)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 183975336 ZKERYOAUOLDIMS-UHFFFAOYSA-N 271.277 -0.638 5 20 CBBD CNS(=O)(=O)CCNc1ncc([N+](=O)[O-])cn1 221045321 DBUPPISGQOMIHH-UHFFFAOYSA-N 261.263 -0.654 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 227840184 HZUZZZXMOMQAQC-QMMMGPOBSA-N 268.229 -0.438 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)CN 262548777 PDSFNFFJBLYISL-UHFFFAOYSA-N 255.278 -0.047 5 20 CBBD CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 285465495 NHUYBCKNDKHGGD-ZETCQYMHSA-N 255.234 -0.442 5 20 CBBD Nc1ccc(N2C[C@@H](CO)[C@@H](O)C2)nc1[N+](=O)[O-] 316220149 AWHBWIIXPMIDDZ-XPUUQOCRSA-N 254.246 -0.639 5 20 CBBD O=C(NC[C@@H]1CC[C@@H](CO)O1)c1cc([N+](=O)[O-])n[nH]1 349696850 RAZRBQDYXPOKHM-BQBZGAKWSA-N 270.245 -0.412 5 20 CBBD C[C@H](NC(=O)C(=O)NC1CNC1)c1ccccc1[N+](=O)[O-] 565706572 KJBPWBJHZYLPGY-QMMMGPOBSA-N 292.295 -0.140 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@]2(O)CCOC2)n1 566800126 USQVMDISMNKJDB-GFCCVEGCSA-N 297.267 0.560 5 20 CBBD CCn1ncn(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)c1=O 816738916 QKIZMSVGAAIHLP-UHFFFAOYSA-N 294.227 -0.543 5 20 CBBD NC(=O)[C@]1(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCOC1 847052794 GHNBIEDINLSPDI-YPMHNXCESA-N 295.295 -0.138 5 20 CBBD Cc1ncc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)[nH]1 990493250 QIUQTSPJWKHPHK-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD CC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062370298 YIVINCUKKPGQBW-RKDXNWHRSA-N 255.274 -0.173 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ncccc1[N+](=O)[O-] 1100706223 UYYBDTMLOLAZQB-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD CO[C@@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1331262592 GFWDCKAGVRRDEY-QMMMGPOBSA-N 269.257 -0.092 5 20 CBBD CN(C)S(=O)(=O)C[C@@H](NCC[N+](=O)[O-])C(F)(F)F 1336819532 NWKKLZCAGWGLCV-ZCFIWIBFSA-N 293.267 -0.325 5 20 CBBD Cc1nn(C)c(C(=O)N2CCCNC(=O)C2)c1[N+](=O)[O-] 1352960986 VHCVFRTUMOKHOL-UHFFFAOYSA-N 281.272 -0.401 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1[C@H]2CNC[C@H]21 1580578466 FPZCRQYSGVDACK-URLYPYJESA-N 292.295 -0.662 5 20 CBBD O=C1NCCC[C@@H]1n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1593408895 PYRNTXRGNMBUTG-YFKPBYRVSA-N 278.232 -0.578 5 20 CBBD Cc1cc(C(=O)N2CC(O)(C(=O)O)C2)c(N)c([N+](=O)[O-])c1 1600080328 DXKCBODCPAHSGX-UHFFFAOYSA-N 295.251 -0.243 5 20 CBBD O=C(O)c1ncn(CCn2cc([N+](=O)[O-])cn2)n1 1602580264 PMMXBECMFRJHHL-UHFFFAOYSA-N 252.190 -0.219 5 20 CBBD COc1cc([N+](=O)[O-])cn(C[C@H](O)CC(=O)O)c1=O 1607191565 NXIVXBHLKDZUPK-SSDOTTSWSA-N 272.213 -0.399 5 20 CBBD C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)C(=O)O 1609794354 FCYVNPPFGQXDGD-RXMQYKEDSA-N 271.185 -0.623 5 20 CBBD NCC(=O)NCC(=O)NCc1ccc([N+](=O)[O-])cc1 37668477 ZPMAHUOYCSUHNR-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@H](C(=O)O)C1 62132933 VYJFEKRGWTUWJR-LURJTMIESA-N 280.240 0.000 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCS(=O)CC2)n1 176230744 BJNJBABMFPFZLV-UHFFFAOYSA-N 258.303 -0.144 5 20 CBBD CN1CCOC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 330585143 SDANWPHOUODGKM-JTQLQIEISA-N 283.288 -0.762 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)c1nn[nH]n1 352473664 WTSXCYBYHXVHJD-ZETCQYMHSA-N 294.275 -0.434 5 20 CBBD CSCC[C@@H](N)C(=O)NCCn1cc([N+](=O)[O-])cn1 353768020 ORNYQACVXIWCKQ-SECBINFHSA-N 287.345 -0.012 5 20 CBBD O=[N+]([O-])c1cnc(NCCS(=O)(=O)NC2CC2)s1 443512392 WDCABMBGUOVDRS-UHFFFAOYSA-N 292.342 0.545 5 20 CBBD COC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 546090386 FUPYQFRRHMUTNS-LLVKDONJSA-N 284.272 -0.301 5 20 CBBD CC(CO)(CO)CNC(=O)c1cccc([N+](=O)[O-])c1N 576140134 BDIHAIWAGOYLSQ-UHFFFAOYSA-N 283.284 -0.102 5 20 CBBD NS(=O)(=O)c1cccc(NCc2nn[nH]n2)c1[N+](=O)[O-] 612657282 HFAZWHWNNAQUSP-UHFFFAOYSA-N 299.272 -0.633 5 20 CBBD Cn1cc(C(=O)C(=O)OCCn2cc([N+](=O)[O-])cn2)cn1 748118006 DULVOAUUCCABHA-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 779540473 HTIMPDQGVVYNAM-UHFFFAOYSA-N 267.201 -0.538 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 782596665 SNSRXRMZBFWODO-GXSJLCMTSA-N 297.315 -0.685 5 20 CBBD Cc1[nH]nc(C(=O)N2CCn3cnnc3C2)c1[N+](=O)[O-] 1318326913 KRNCXYNTCZKWIM-UHFFFAOYSA-N 277.244 -0.126 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H]3CNC[C@@H]3C2)c1[N+](=O)[O-] 1326122245 WDJKFLIWKFMHOX-DTORHVGOSA-N 279.300 -0.072 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@H]1CCCS1(=O)=O 1326763049 KFPDMUVGEQTJDO-SSDOTTSWSA-N 288.285 -0.156 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CCC(N)CC1 1328462319 MRLPPQMKTRXLTD-UHFFFAOYSA-N 282.304 -0.085 5 20 CBBD O=C(O)[C@@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 1594881732 CMRAEAKOSDZCTA-SNVBAGLBSA-N 270.245 -0.375 5 20 CBBD O=C(O)[C@@H]1[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1(F)F 1602203718 WINGPDSQSBXXIF-MOJAZDJTSA-N 264.184 -0.266 5 20 CBBD C[C@](NCC(N)=O)(C(=O)O)c1cccc([N+](=O)[O-])c1 1604332970 NDNUADDSIPLAQL-LLVKDONJSA-N 267.241 -0.031 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 50858615 XAEYNTKXHGCVFS-ZETCQYMHSA-N 269.213 -0.486 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCC[C@H]1C(N)=O 68422131 LNYRZNPKQFRPEH-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])NC[C@H](O)C(=O)O 90260688 TUYXYQSPXDSNKL-QMMMGPOBSA-N 284.224 -0.465 5 20 CBBD NC(=O)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 272365374 SUQYDWFIEHMHHG-UHFFFAOYSA-N 281.224 -0.071 5 20 CBBD CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1CCNC1=O 281759003 IHKFRRLJOSJMBC-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD CN(C)S(=O)(=O)CCNc1ncc([N+](=O)[O-])c(N)n1 290804717 PPDVRDAMNDMFRR-UHFFFAOYSA-N 290.305 -0.730 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1cc([N+](=O)[O-])cnc1N 349828629 GXLUNPMHUBLLFK-UHFFFAOYSA-N 293.283 -0.077 5 20 CBBD CN(C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@@H]1O 354554450 SVZWYOKBZJXXBX-ZJUUUORDSA-N 299.287 -0.808 5 20 CBBD NC(=O)c1ccc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 549204767 REZRFZNJUPJHCS-UHFFFAOYSA-N 290.239 -0.258 5 20 CBBD N[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 567830700 QRMPTCSSBZJUAK-LURJTMIESA-N 252.230 -0.131 5 20 CBBD COC[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])C(N)=O 760062488 KOJYGEOOHKYFFE-MRVPVSSYSA-N 297.267 -0.410 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)OCC(=O)NCC(=O)O 821190224 OMZBYZBOUNHSPC-UHFFFAOYSA-N 297.223 -0.344 5 20 CBBD O=C(NCc1cc(=O)n2ccccc2n1)[C@@H]1C[C@H]1[N+](=O)[O-] 844970526 QVVSXFMVJQIMCS-NXEZZACHSA-N 288.263 -0.024 5 20 CBBD CCc1[nH]nc(C(=O)NN2CCOC2=O)c1[N+](=O)[O-] 862699431 IWPXBOAXIHLMAM-UHFFFAOYSA-N 269.217 -0.023 5 20 CBBD O=[N+]([O-])c1cnc(N2C[C@@H](CO)[C@@H](O)C2)c(F)c1 894162240 PLTPOIXYGFUOLR-RCOVLWMOSA-N 257.221 -0.082 5 20 CBBD Cc1nonc1CN1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042705428 QEZDFVXOPLVNRC-MWLCHTKSSA-N 295.299 -0.314 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2F)C1 1059804109 VPDOEFHJNAOASR-OLQVQODUSA-N 297.246 -0.327 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@H]2CCOC2=O)c1=O 1319028659 HFZVPKAPPBZZJP-ZETCQYMHSA-N 295.251 -0.191 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC[C@@H](CO)C1 1321039466 JDVDNIKZUXBNGC-MRVPVSSYSA-N 287.297 -0.007 5 20 CBBD NC(=O)C[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 1323484499 WVVKSTYULYNABC-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD NC(=O)N1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 1328355632 IVGNYUIAOFYAMA-SSDOTTSWSA-N 282.260 -0.940 5 20 CBBD Cn1ccc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n1 1592580375 DMPMHEPYADURQA-UHFFFAOYSA-N 275.232 -0.247 5 20 CBBD C[C@@H](COC(=O)c1cnc(C(=O)O)cn1)[N+](=O)[O-] 1592772000 LBGHVSXMEQQPAO-YFKPBYRVSA-N 255.186 -0.003 5 20 CBBD O=C(O)CCNC(=O)COC(=O)c1ccc([N+](=O)[O-])o1 1602021358 FZNYQKAJHUWWKI-UHFFFAOYSA-N 286.196 -0.065 5 20 CBBD O=C(O)[C@@H](F)CNS(=O)(=O)c1ncccc1[N+](=O)[O-] 1608800989 CGASHCQBZRECDV-YFKPBYRVSA-N 293.232 -0.309 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H]2COCCO2)c1 38061310 FPJPITMCHCIKGL-GHMZBOCLSA-N 286.288 -0.843 5 20 CBBD COCCNCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 262090875 GVUKXKJIVDQSBT-UHFFFAOYSA-N 285.304 -0.548 5 20 CBBD COC[C@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 282879580 QZBRUHLYMFFJBY-SSDOTTSWSA-N 270.245 -0.492 5 20 CBBD C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)NCCF 283511503 MKJWGXXEXWBPJS-RXMQYKEDSA-N 272.240 -0.147 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCOC[C@@]12CCOC2 286131222 YKFGUNZZGZQFLN-NSHDSACASA-N 282.256 -0.051 5 20 CBBD CCn1cc(S(=O)(=O)NCCCCO)c([N+](=O)[O-])n1 341533276 DGMGULYAUOOUNZ-UHFFFAOYSA-N 292.317 -0.138 5 20 CBBD COCC[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 342818650 XUFWCORTROWLOW-YFKPBYRVSA-N 270.249 -0.731 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)CN 347706241 WROQFNJLLLPGHL-ZETCQYMHSA-N 255.278 -0.047 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356726207 LCMGMGFLRVKFNC-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD COC[C@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 357692040 BYDCHSRAOCTYHY-ZETCQYMHSA-N 269.257 -0.086 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 436739216 NWVMXKPSEPMZDK-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD Cn1nnnc1CNC(=O)c1ccc([N+](=O)[O-])cc1O 436994509 DGGMXBYGERTSBQ-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CNc1ccc(C(=O)NC[C@H](O)C(=O)OC)cc1[N+](=O)[O-] 534283372 FYLOVNAPGTWDRO-JTQLQIEISA-N 297.267 -0.100 5 20 CBBD COCCN1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 562762291 HBZBDEVGYOGXRG-UHFFFAOYSA-N 283.244 -0.794 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)[C@@H](N)C[C@H]3C2)c1[N+](=O)[O-] 577887147 GKIIIQGYLOHIGA-IUCAKERBSA-N 294.315 -0.615 5 20 CBBD COC(=O)c1cnc(N2C[C@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 598630580 ZPWFRCLWVMZDEF-SCZZXKLOSA-N 297.267 -0.434 5 20 CBBD CC1(C)COC(=O)[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 808105252 ALIFDBMCURYQTA-SECBINFHSA-N 282.256 -0.141 5 20 CBBD CN(CC(=O)O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 820562901 YUJHAPQTNYEFIM-UHFFFAOYSA-N 269.213 -0.701 5 20 CBBD O=C(O)NCCCC(=O)NCCn1cc([N+](=O)[O-])cn1 832609038 ORIYTQVCGMCLPN-UHFFFAOYSA-N 285.260 -0.045 5 20 CBBD CC(C)(NS(C)(=O)=O)C(=O)OCCC[N+](=O)[O-] 860918118 XUFPGSOHMMTNKT-UHFFFAOYSA-N 268.291 -0.476 5 20 CBBD COCCC(=O)NCCCNc1ncc([N+](=O)[O-])c(N)n1 1094274850 CLQKTVAVXFFIFB-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD NC(=O)CN1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1160097334 GLMFKGVJZOFTEW-GHMZBOCLSA-N 296.327 -0.725 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CC(CO)C1 1608376789 GGMABMAJGBJSQZ-UHFFFAOYSA-N 298.255 -0.867 5 20 CBBD O=C(O)CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 50469694 FHYJQQUEFFZAJF-UHFFFAOYSA-N 297.271 -0.980 5 20 CBBD CC(C)[C@@H](CO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 92394801 XTQCMHIDUSYWPG-GHMZBOCLSA-N 272.305 -0.241 5 20 CBBD CC(=O)N[C@H]1CCCN(C(=O)Cn2nccc2[N+](=O)[O-])C1 119701367 KMUZFDZZAWVYCH-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O 217315897 XPKZCOQBDXSFNO-SSDOTTSWSA-N 293.235 -0.213 5 20 CBBD C[C@H]1C[C@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 261924169 ZZKIMBQMYTWOOI-DTWKUNHWSA-N 267.289 -0.013 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)[C@H](C)O 274802240 SOVQBBPNVOTBNL-QUBYGPBYSA-N 298.251 -0.047 5 20 CBBD CC(C)NC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274864602 BUKVVMADIMHATQ-UHFFFAOYSA-N 282.256 -0.050 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](C)C1 276589095 KGUNEVQMAZJSPD-IUCAKERBSA-N 297.315 -0.155 5 20 CBBD CN1C(=O)C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 290826769 UBNVEXGCEBAUIU-LURJTMIESA-N 293.239 -0.742 5 20 CBBD COCCOCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299479189 DWIUVLZSILBTMP-UHFFFAOYSA-N 299.283 -0.464 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])NCCn1ncnn1 338964011 VXTVSTVDJOSUKA-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD COC(=O)C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)OC 347640890 BFJQFJSBOPBNKL-MRVPVSSYSA-N 299.239 -0.243 5 20 CBBD COC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC 351791411 YXICTUREVUMDMA-MRVPVSSYSA-N 286.244 -0.905 5 20 CBBD CNC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 355654178 ITXZTSWDCZUURG-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD Cn1nnnc1Cn1cnc2ccc([N+](=O)[O-])cc2c1=O 356922953 PSTWKNIMYVBVCY-UHFFFAOYSA-N 287.239 -0.124 5 20 CBBD C[C@H]1CNCCN1S(=O)(=O)c1cccnc1[N+](=O)[O-] 574572446 UPYRSMZLBWGHGI-QMMMGPOBSA-N 286.313 -0.028 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592368898 MGISLVNWVBPMLA-LURJTMIESA-N 270.201 -0.757 5 20 CBBD CC(C)(CNC(=O)c1c[nH]nc1[N+](=O)[O-])OCCO 600827930 YIWADDZUNGTVRD-UHFFFAOYSA-N 272.261 -0.165 5 20 CBBD CCS(=O)(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 727718322 IAHLMWDQKLHUMQ-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD CCN(CC(=O)NC)c1ncc([N+](=O)[O-])c(N)n1 747621687 YNZGQMJCDJYTMD-UHFFFAOYSA-N 254.250 -0.461 5 20 CBBD O=C(CNC(=O)C1CC1)OCCn1cc([N+](=O)[O-])cn1 748118420 NPDUBVHMVHXRGV-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD O=C1C[C@@H](N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)C(=O)N1 840300713 LZSSZGLCSCEOLQ-BWZBUEFSSA-N 267.241 -0.942 5 20 CBBD CCONC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 846493083 MTIBWABRZLKRHR-UHFFFAOYSA-N 284.228 -0.507 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 863709204 JUSWKTWRFCPZFK-ZCFIWIBFSA-N 297.271 -0.290 5 20 CBBD O=C(NC1CN(C(=O)c2ccco2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991281343 SEIKXUKADOSENW-RKDXNWHRSA-N 279.252 -0.115 5 20 CBBD O=[N+]([O-])c1cn(CCn2cncn2)nc1-c1nn[nH]n1 1593486697 HWNIYLKQQZLUJC-UHFFFAOYSA-N 276.220 -0.737 5 20 CBBD N[C@H](Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1)C(=O)O 1608248578 KUSYLZLGHCBOHP-MRVPVSSYSA-N 278.228 -0.475 5 20 CBBD Cc1cc(=O)n(Cc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-] 91588240 QWXMJAGIFNSVFG-UHFFFAOYSA-N 251.202 -0.475 5 20 CBBD CN(C)C[C@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 133025573 LKLFNZVYFQUZRN-SNVBAGLBSA-N 270.293 -0.309 5 20 CBBD COC(=O)[C@H](O)CNC(=O)COc1cccc([N+](=O)[O-])c1 217700008 YWKZHCFBQPLTKE-SNVBAGLBSA-N 298.251 -0.376 5 20 CBBD COc1c(C(=O)NC[C@H](O)C(N)=O)cccc1[N+](=O)[O-] 228486659 TWWWFXNFBBZJNH-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD CN(C)CCOCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230723970 UWTNDQUOFQDBBQ-UHFFFAOYSA-N 297.315 -0.120 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)CC(C)(CO)CO 270344613 PXWMPUWBJFISEF-UHFFFAOYSA-N 272.305 -0.286 5 20 CBBD COCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285557607 VBYOUGKCJRHGPZ-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD C[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)N(C)C 357858376 AHUJTLOMLQGLAD-ZETCQYMHSA-N 256.266 -0.747 5 20 CBBD CCc1nncn1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 530583538 OJELVYOEZFTIGK-UHFFFAOYSA-N 293.287 -0.238 5 20 CBBD CNc1nccc(C(=O)NCC(C)(CO)CO)c1[N+](=O)[O-] 569707864 LIHLSIPDNDMPQC-UHFFFAOYSA-N 298.299 -0.248 5 20 CBBD O=C(CCNC[C@@H](O)CO)Nc1ccccc1[N+](=O)[O-] 572556990 DCBRSFUGXMQFQN-SECBINFHSA-N 283.284 -0.134 5 20 CBBD CCN(C)C(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 573224206 WEJFRAMZFBBMJX-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1 578521157 NBKPCFJHBGUMOV-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD CNc1nccc(C(=O)NCCOCCO)c1[N+](=O)[O-] 580446623 QYPKYEUHQNZGBB-UHFFFAOYSA-N 284.272 -0.230 5 20 CBBD CNc1nccc(C(=O)N2CCN3CC[C@H]2C3)c1[N+](=O)[O-] 597708391 LMXYVSJVMDFALB-VIFPVBQESA-N 291.311 0.562 5 20 CBBD NC(=O)[C@@H]1CN(c2cccnc2[N+](=O)[O-])CCO1 604520331 MYLPSKFWDLEGRN-QMMMGPOBSA-N 252.230 -0.320 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCN(C)C(=O)C2)c1[N+](=O)[O-] 619444583 DMHDOAAIIWTZRD-ZETCQYMHSA-N 281.272 -0.023 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCCNC1=O 619867969 OVOSYOUGXZGNOP-MRVPVSSYSA-N 281.272 -0.566 5 20 CBBD O=C(NOCCO)c1cc2c(cc1[N+](=O)[O-])OCO2 787286113 ADRUVXYLWJGUBF-UHFFFAOYSA-N 270.197 -0.023 5 20 CBBD Cc1ncc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1030294129 XSJWKBQGCUUAJM-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD C[C@@H](O)C1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1118791425 AXICGQHXGFNMQZ-ZCFIWIBFSA-N 255.234 -0.784 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc(F)ccc1[N+](=O)[O-] 1258029195 LPCNNKGAGZVEPR-ZETCQYMHSA-N 271.204 -0.690 5 20 CBBD COC[C@](C)(O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1318790756 MOAWIWLBZCGUCH-SNVBAGLBSA-N 272.261 -0.246 5 20 CBBD CNC(=O)Cc1noc(Cn2cc([N+](=O)[O-])c(C)n2)n1 1325131813 IFXTYHCDLLBYAO-UHFFFAOYSA-N 280.244 -0.180 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1327085496 RGOPERMPAWIYDQ-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD C[C@](NC[C@H](O)CO)(C(=O)O)c1cccc([N+](=O)[O-])c1 1593285409 DPKNWPABDZOZMK-CMPLNLGQSA-N 284.268 -0.163 5 20 CBBD O=C(NC1(C(=O)O)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1594724505 DYABZTWGFNPWMX-UHFFFAOYSA-N 284.228 -0.319 5 20 CBBD CN(CCNC(=O)CCn1cc([N+](=O)[O-])cn1)CC(=O)O 1598490872 PGQHADHSAHBNQT-UHFFFAOYSA-N 299.287 -0.686 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2C[C@H]2C(=O)O)n1 1608122488 FKYYWRLSZMPLKC-PHDIDXHHSA-N 268.229 -0.221 5 20 CBBD COC(=O)c1cc(C(=O)N[C@H](C)C(N)=O)cc([N+](=O)[O-])c1 53324707 FOJSEXJVQPDFCV-ZCFIWIBFSA-N 295.251 -0.015 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CC1 238081427 JKGIUXMEPAGZIE-UHFFFAOYSA-N 268.229 -0.085 5 20 CBBD C[C@H](O)CN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@@H](C)CO 289216876 VQMUYDFBALSWMC-BQBZGAKWSA-N 272.261 -0.478 5 20 CBBD CCCc1[nH]nc(C(=O)NCCn2ncnn2)c1[N+](=O)[O-] 353023403 ZRPBDYLNVWZLRF-UHFFFAOYSA-N 294.275 -0.313 5 20 CBBD CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])nn1C 356497259 MRBAISNDEFESCC-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD CN1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 357545845 ZOIKUYCBBVQWOZ-MRVPVSSYSA-N 293.283 -0.244 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1cc(O)cc([N+](=O)[O-])c1 357593291 BIGIHKZNLJOTHD-SNVBAGLBSA-N 270.241 -0.274 5 20 CBBD CCc1[nH]nc(C(=O)NC2CN(C(C)=O)C2)c1[N+](=O)[O-] 359272038 HZVJUZGXINHFSC-UHFFFAOYSA-N 281.272 -0.159 5 20 CBBD O=C1CC[C@@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C(=O)N1 360409965 ZQPSKKGUQUZVCG-SSDOTTSWSA-N 293.239 -0.662 5 20 CBBD CNC[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 429521314 ZHFKLQSVWBKNSR-QMMMGPOBSA-N 268.277 -0.603 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[C@@H](c2nn[nH]n2)C1 552378320 WKUPBAIPDIWRMS-ZCFIWIBFSA-N 292.259 -0.149 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN([C@H]3COC[C@H]3O)CC2)cn1 564668667 ISJDTDANNNCHKG-NWDGAFQWSA-N 294.311 -0.129 5 20 CBBD O=[N+]([O-])c1ccc2nc(CNC(CO)CO)[nH]c2c1 572300499 CSRYSVIWBSXDSK-UHFFFAOYSA-N 266.257 -0.086 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CN(C)CCO1 586799498 KKQNCYACKQSVNC-IONNQARKSA-N 283.288 -0.233 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 816286237 DQOQWZLVZGELJG-UHFFFAOYSA-N 294.275 -0.142 5 20 CBBD O=C(NN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 841002488 VGYNQYDEZSJBTR-RKDXNWHRSA-N 275.220 -0.021 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1COCO1 861969338 QBCZWNXDYAYMTD-QMMMGPOBSA-N 270.245 -0.411 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@]1(O)CCSC1 1319645185 FNVCOCFDBUURLN-SNVBAGLBSA-N 286.313 -0.074 5 20 CBBD CC(=O)NCCc1noc(Cn2ccc([N+](=O)[O-])n2)n1 1320216958 DHYDTGAOTNCXLB-UHFFFAOYSA-N 280.244 -0.099 5 20 CBBD O=[N+]([O-])c1cnn(-c2nnccc2-c2nn[nH]n2)c1 1582804456 DGIUWZZXDVGSGK-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1601763468 IBECQUXTADMSRJ-RITPCOANSA-N 284.228 -0.775 5 20 CBBD O=C(NC[C@]1(C(=O)O)CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1608428487 SSJYSTJZAFVVMT-BRDIYROLSA-N 258.230 -0.741 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 1610735128 DYPKJBGOTXZVHZ-SCZZXKLOSA-N 284.272 -0.441 5 20 CBBD C[C@@H](N)C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40835088 CGMNCMIMVIVJOF-SECBINFHSA-N 279.300 -0.014 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1N 50692835 YUDGCMFMESEMIW-UHFFFAOYSA-N 287.297 -0.049 5 20 CBBD CCCN(C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152837405 JSPKLDUTEQLLNN-UHFFFAOYSA-N 291.333 -0.033 5 20 CBBD COCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266527523 DNZQKZJHWMTKFK-SNVBAGLBSA-N 258.278 -0.270 5 20 CBBD COC[C@@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 340550227 LOBCITYLNORBHD-SECBINFHSA-N 286.288 -0.387 5 20 CBBD Cc1cc(OCC(=O)N[C@H](CO)C(N)=O)ccc1[N+](=O)[O-] 341739286 POSSWDGEDIFKID-SECBINFHSA-N 297.267 -0.756 5 20 CBBD CN(C)c1noc(CNc2ncc([N+](=O)[O-])c(N)n2)n1 356112678 PJECHNBBYROEFJ-UHFFFAOYSA-N 280.248 0.028 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H]3CNC[C@@H]3C2)c1[N+](=O)[O-] 359416993 QXMHYJNZJGKUEB-HTQZYQBOSA-N 265.273 -0.082 5 20 CBBD CC(C)[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 592543532 FRUGVSHZTRVSHV-SECBINFHSA-N 282.304 -0.357 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCc2ncccn2)c1 702361681 CVYPFOLWHVULCO-SNVBAGLBSA-N 278.272 -0.268 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1C 763710008 PNUWUJHIFAJYOG-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD COc1c(C(=O)NN2CC(=O)NC2=O)cccc1[N+](=O)[O-] 793085391 NXLIRRISPXYTCW-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD CNS(=O)(=O)c1cccc([N+](=O)[O-])c1-c1nn[nH]n1 826090357 GJSODQIXTBVWOS-UHFFFAOYSA-N 284.257 -0.317 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1(C(N)=O)CCCC1 840404341 AMFREJUPCAPFEZ-HTQZYQBOSA-N 255.274 -0.092 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840669883 MOGNCEPYICVCTM-RKDXNWHRSA-N 297.223 -0.035 5 20 CBBD C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C(=O)O1 848073013 HXTKYOUAXIDHLV-NJGYIYPDSA-N 254.202 -0.248 5 20 CBBD CN(C)C[C@H](CO)NC(=O)CCC(C)(C)[N+](=O)[O-] 854463480 BZSBIOYWJAKVCQ-SECBINFHSA-N 261.322 -0.139 5 20 CBBD CCN1CCN(C(=O)CNc2c([N+](=O)[O-])cnn2C)CC1 892314025 JBEISGWNTXJBLP-UHFFFAOYSA-N 296.331 -0.096 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ncc([N+](=O)[O-])cc2F)CC1 1110324349 KJZYWRZEMYXHTO-UHFFFAOYSA-N 297.246 -0.325 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC(O)(CN)CC2)c1[N+](=O)[O-] 1261476118 LKMBOSRVOFHWCA-UHFFFAOYSA-N 283.288 -0.448 5 20 CBBD COCCN(C)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323615866 MFXIOIGKDWWXBH-UHFFFAOYSA-N 299.287 -0.988 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@@]2(CO)CCCNC2)c1 1580876891 YSNHICUJNMMKLN-NSHDSACASA-N 269.305 -0.505 5 20 CBBD CO[C@]1(C(=O)O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1606700411 KOHYGLZBYLOQMX-SNVBAGLBSA-N 284.228 -0.366 5 20 CBBD CNS(=O)(=O)c1ccc(N(C)CCO)c([N+](=O)[O-])c1 15174880 COESIUNQJOPTOY-UHFFFAOYSA-N 289.313 -0.069 5 20 CBBD CNC(=O)CN(C)S(=O)(=O)c1ccccc1[N+](=O)[O-] 18941148 TYHWGHNABYZQDS-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CCO1 50857200 PUJISHQUAWBLJZ-JTQLQIEISA-N 279.252 -0.079 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H](O)C1CC1 71303139 JFASGRODNMLUDB-VIFPVBQESA-N 254.246 -0.322 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 227046183 UZOYAEJVBRGMIP-LURJTMIESA-N 257.202 -0.813 5 20 CBBD CO[C@H]1COC[C@@H]1Nc1nccc(C(N)=O)c1[N+](=O)[O-] 290725050 PXLQILOQXKEHNC-YUMQZZPRSA-N 282.256 -0.086 5 20 CBBD COC[C@@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340549367 AIZQTYNCYCCOPP-SECBINFHSA-N 299.283 -0.730 5 20 CBBD COC[C@](C)(NCc1c([N+](=O)[O-])ncn1C)C(=O)OC 347547694 XUEAPPKZXHNSQO-NSHDSACASA-N 286.288 -0.004 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OC[C@H]1COC(=O)O1 763922539 QDICWNQEOSYDNH-ZETCQYMHSA-N 271.185 -0.130 5 20 CBBD C[C@H](COC(=O)[C@@H]1CCCN(C(N)=O)C1)[N+](=O)[O-] 813105066 VEEPEJJVUGNOEV-HTQZYQBOSA-N 259.262 -0.015 5 20 CBBD O=C(NCCOC[C@@H]1CCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 839684392 WADRXXOHBVFLNU-IVZWLZJFSA-N 258.274 -0.037 5 20 CBBD CNC(=O)[C@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 843112169 WUDZHCMTUYLVLN-WDEREUQCSA-N 283.284 -0.675 5 20 CBBD O=C(NC1CN(C(=O)Cc2ccc[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991289931 ILXOMTDQVQRTFJ-GHMZBOCLSA-N 292.295 -0.451 5 20 CBBD CNC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1094204448 QJDXOVULMCWWPX-UHFFFAOYSA-N 296.287 -0.553 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ccncn1 1117532249 ACIINBGNKPANFK-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1324343259 GBWUWYFDURXQBG-URLYPYJESA-N 293.279 -0.547 5 20 CBBD C[C@]1(COC(=O)Cn2cnc([N+](=O)[O-])n2)COC(=O)N1 1343867556 AXJYKGQJKUMDJO-VIFPVBQESA-N 285.216 -0.772 5 20 CBBD C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1593406490 CJLHTJSJUYARDV-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H](C)CN 179190723 IAQHFBYORGPFEJ-SSDOTTSWSA-N 255.278 -0.095 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 227046190 UZOYAEJVBRGMIP-ZCFIWIBFSA-N 257.202 -0.813 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1C[C@@H](O)C[C@H]1C(=O)O 253085983 AEVGTPHDUMOOFD-IUCAKERBSA-N 284.272 -0.380 5 20 CBBD COc1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)nn1C 274645728 BUTQELXLFQZJJU-UHFFFAOYSA-N 294.271 -0.037 5 20 CBBD C[C@@H](O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 291089395 XDARBABZGUTKTI-MRVPVSSYSA-N 269.257 -0.404 5 20 CBBD CC(=O)NCCCNC(=O)Cn1ccc([N+](=O)[O-])n1 340189645 ZNAQVAHOIXAQNE-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD Cn1c(C(=O)N[C@H]2CCN(C(N)=O)C2)ccc1[N+](=O)[O-] 358035599 BCZOXRLGTJUXNU-ZETCQYMHSA-N 281.272 -0.184 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@@H](O)C[C@@H]1CO 360187882 CUCAMNRGWWHKRO-SFYZADRCSA-N 282.256 -0.629 5 20 CBBD CC(=O)N1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1 361861804 HPUSHBWRUMLYBV-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD CCCN(CCn1cc([N+](=O)[O-])ccc1=O)CC(N)=O 429128810 CFYNKIIQYGRDJR-UHFFFAOYSA-N 282.300 -0.046 5 20 CBBD CN(CCN1CCCC1=O)C(=O)Cn1cc([N+](=O)[O-])cn1 522168101 KMNHCTXDPASHJR-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C(N)=O)C1 522266979 OMYAETLRLAQATF-SSDOTTSWSA-N 281.272 -0.184 5 20 CBBD COC[C@]1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCN1 570962841 KCDUARWHWBDTFB-LLVKDONJSA-N 283.288 -0.184 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cccc([N+](=O)[O-])c1N 600240540 BQZWNVPZIAKSNF-MUWHJKNJSA-N 294.267 -0.762 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 600315416 NZSWHLFYYFWABL-URHBZAFASA-N 253.218 -0.688 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](CF)C(=O)O)n1 600665538 UYDHHZBSYAGYDP-BYPYZUCNSA-N 296.236 -0.971 5 20 CBBD CCN(C)C(=O)COC(=O)c1c([N+](=O)[O-])cnn1C 766968354 UODYSSQWWCMMTD-UHFFFAOYSA-N 270.245 -0.037 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)NCC(=O)O 821369416 TYSQFOGLSRNEPJ-UHFFFAOYSA-N 297.223 -0.465 5 20 CBBD Cn1cncc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022064114 WXBKNNWZWRRVQP-RBLKWDMZSA-N 293.327 -0.178 5 20 CBBD COC[C@@H](OC)C(=O)OCCn1cnc([N+](=O)[O-])n1 1263385170 MBUPJXQRLFEPHK-SSDOTTSWSA-N 274.233 -0.609 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H](C)C(N)=O 1323742911 BSMQFUYFWOHCGW-YFKPBYRVSA-N 256.218 -0.483 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCOCCN1 1328404145 ZWDMHNDOBVLLTR-UHFFFAOYSA-N 282.256 -0.880 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H](CO)[C@H](CO)C1 1329200742 GZDLKQFNPHQXMM-UWVGGRQHSA-N 296.279 -0.027 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1c([N+](=O)[O-])cnn1C 1329401690 DHGMAXMAMIAMGC-UHFFFAOYSA-N 279.260 -0.271 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)O[C@@H]1CCS(=O)(=O)C1 1341869328 SXWHCAGROCULLM-SSDOTTSWSA-N 289.269 -0.478 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)O[C@H]1CCS(=O)(=O)C1 1516638589 WSPOCBTZBYKEKY-QMMMGPOBSA-N 289.269 -0.478 5 20 CBBD C[C@@](O)(CO)CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1589992926 FQWZTXCGZGKURV-NSHDSACASA-N 294.271 -0.070 5 20 CBBD Cn1nccc1[C@H](NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1601034704 QSMSEIRRDUHHIW-JTQLQIEISA-N 294.271 -0.060 5 20 CBBD C[C@@](O)(CO)CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] 1603690477 KJJPISSBAOMVNQ-NSHDSACASA-N 294.271 -0.070 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H](CO)C1 51885657 PYNDIMAFPNZGGN-QMMMGPOBSA-N 254.246 -0.368 5 20 CBBD CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])c(O)c1 63749239 NQPHBAUFZUVWHM-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD C[C@@H](CO)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 86631478 SVJSQCXZWBDCHG-PSASIEDQSA-N 258.278 -0.630 5 20 CBBD C[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 184927119 QNSXIIRTSDWPOB-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H](CO)O1 229996437 VVPHOYMYIZURAE-BDAKNGLRSA-N 284.272 -0.601 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC[C@@H](C(N)=O)C1 301113064 WIXZUXDWASLANF-SSDOTTSWSA-N 293.283 -0.210 5 20 CBBD Cc1ncc([N+](=O)[O-])n1Cc1cc(=O)n(C)c(=O)n1C 330665881 HNIJLFBXVWAEFN-UHFFFAOYSA-N 279.256 -0.455 5 20 CBBD COC1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 353012180 OEBNRJDRWZFXTN-SECBINFHSA-N 256.262 -0.517 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1cc(F)cc([N+](=O)[O-])c1N 355614605 DVUTWQQCYCDHCU-SSDOTTSWSA-N 287.247 -0.259 5 20 CBBD CC(C)C(=O)NCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 393161291 LBMDTLQXPAJUFK-LLVKDONJSA-N 299.331 -0.486 5 20 CBBD O=C(NC1(c2nn[nH]n2)CC1)c1cnc(O)c([N+](=O)[O-])c1 430336379 YMZKCNGCZBJEAD-UHFFFAOYSA-N 291.227 -0.372 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)NC(N)=O 436476361 ZEMJPFLBIGFLBG-UHFFFAOYSA-N 254.202 -0.740 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CN(C)CCO1 586799499 KKQNCYACKQSVNC-VXNVDRBHSA-N 283.288 -0.233 5 20 CBBD CCCc1[nH]nc(C(=O)NCCNC(N)=O)c1[N+](=O)[O-] 737857725 AGHACUZDPQFJLJ-UHFFFAOYSA-N 284.276 -0.332 5 20 CBBD Cn1cc(C(=O)COC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 741327572 YGEBPIDLWRADPT-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD COC(=O)C1=NO[C@H](Cn2cnc([N+](=O)[O-])n2)C1 760188725 LXZMEJLLCIQVKE-YFKPBYRVSA-N 255.190 -0.496 5 20 CBBD COC(=O)N(C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 855937197 DYXSJQWLKAQUKR-UHFFFAOYSA-N 285.260 -0.394 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NOCCN1CCCC1=O 856036950 AZBKQDOGDVVCQH-UHFFFAOYSA-N 297.271 -0.539 5 20 CBBD CN(CC[N+](=O)[O-])[C@@H]1CCN(S(C)(=O)=O)C1 930540452 HIRORWINSIEGKW-MRVPVSSYSA-N 251.308 -0.771 5 20 CBBD Cn1cnc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)n1 1093590340 REYAXQRIHIFESB-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD CCc1[nH]nc(C(=O)NCCS(C)(=O)=O)c1[N+](=O)[O-] 1320795584 ZJTFAUBRRCRBFV-UHFFFAOYSA-N 290.301 -0.345 5 20 CBBD O=C(NCCN1CC=CC1)c1cc([N+](=O)[O-])n[nH]1 1322068070 BEWMPNNBGGZOSQ-UHFFFAOYSA-N 251.246 -0.081 5 20 CBBD CN1CCN(C2CN(C(=O)c3c[nH]nc3[N+](=O)[O-])C2)CC1 1332563917 NMCSHCMFEUTPDX-UHFFFAOYSA-N 294.315 -0.610 5 20 CBBD Cc1nc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n[nH]1 1592328356 SOQDATRDUOMMID-UHFFFAOYSA-N 276.220 -0.554 5 20 CBBD O=C(NC/C=C\CNCc1cnns1)[C@@H]1C[C@H]1[N+](=O)[O-] 1754118932 FKEDTFTVLOBMRU-BSANDHCLSA-N 297.340 -0.035 5 20 CBBD C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C(N)=O 33615460 OQHDAIGDUWOSHR-SSDOTTSWSA-N 267.241 -0.036 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 48269539 SEAAESCUUGEBAB-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD COCCOCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 68242234 JGDGCNMJEPVGNY-UHFFFAOYSA-N 286.288 -0.121 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])n1C 110516111 OAVIDEDQQLDPOD-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD COc1c(C(=O)N[C@H](CO)C(=O)O)cccc1[N+](=O)[O-] 137531239 NHVNKKHCPNTTQF-SSDOTTSWSA-N 284.224 -0.221 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 229975173 FCGZASSLAWOCAE-ZETCQYMHSA-N 287.659 -0.176 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H](CO)O1 229996453 VVPHOYMYIZURAE-DTWKUNHWSA-N 284.272 -0.601 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCc1ncn[nH]1 230697932 QCWZCOUMKACYLE-UHFFFAOYSA-N 277.244 -0.337 5 20 CBBD O=C(O)c1cnc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 236496006 RZTNJSCZAOROHN-ZCFIWIBFSA-N 257.202 -0.547 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 274724623 YMPRXXKAXNLVPX-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD CC1(O)CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 338606855 KGLHTRDJTALLHR-UHFFFAOYSA-N 252.230 -0.221 5 20 CBBD CN1CCN(C(=O)Cn2nccc2[N+](=O)[O-])CC1 340674215 HESUINODMLTEMV-UHFFFAOYSA-N 253.262 -0.435 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)OC 351811581 RZSSTOZZRKYYLB-SSDOTTSWSA-N 271.229 -0.159 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 429318706 RZJNNSWJGIJHQP-ZETCQYMHSA-N 254.250 -0.993 5 20 CBBD N[C@H]1C[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCN2C1=O 519613889 LJSRUQLAUWBCJW-SFYZADRCSA-N 293.283 -0.693 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H]1CNOC1 808088732 OXSWWNGOBJYZMN-ZETCQYMHSA-N 256.218 -0.454 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](NCc2cccc([N+](=O)[O-])c2)C1 1020533196 KSKRGRJPHWYGHG-MGCOHNPYSA-N 292.295 -0.183 5 20 CBBD CO[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCO1 1116895688 IITNWOOJOIDGRY-GFCCVEGCSA-N 297.267 -0.412 5 20 CBBD C[C@@H](c1nnc(N2CCN3C(=O)CC[C@H]3C2)n1C)[N+](=O)[O-] 1338057270 OIRZCQZUZPPPKL-IUCAKERBSA-N 294.315 -0.036 5 20 CBBD CNC(=O)C1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 48554284 RYMRZGOYQPQFBA-UHFFFAOYSA-N 280.288 -0.071 5 20 CBBD Cn1cc(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 94196153 QEHVSPRQFYVUBQ-SNVBAGLBSA-N 266.261 -0.002 5 20 CBBD CC[C@H]1C(=O)NCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247201865 CCDKOQRGAVWUJF-MNOVXSKESA-N 297.315 -0.637 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1nc(O)n[nH]1 350904889 WJHWMOXJLWDPES-UHFFFAOYSA-N 279.216 -0.674 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)NCCn1ncnn1 353119946 DBPRJCCNCVHKEH-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 353372378 XSWBIVLANRWWCC-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD CNC(=O)[C@@H](C)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 357490976 SVPOZCXRLQPVJT-ZETCQYMHSA-N 295.299 -0.093 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2ccc([N+](=O)[O-])o2)C1 358047609 MBFMQYMPBYJZKP-LLVKDONJSA-N 269.257 -0.016 5 20 CBBD C[C@@]1(CNc2ncc([N+](=O)[O-])c(N)n2)CCC(=O)N1 413335799 GEGMASJHWYSJBO-JTQLQIEISA-N 266.261 0.048 5 20 CBBD CN1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 424962630 XFDAXCBQCMLKED-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD C[C@@]1(CO)CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427079618 YUWBQANRQIBWMA-KWQFWETISA-N 283.288 -0.146 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H]1CCNC1=O 445146076 WHYGIQKNSPXJPO-ZETCQYMHSA-N 280.240 -0.344 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3CC[C@@H](CO)[C@@H](O)C3)nn12 572419232 FRDZSMRGEXPKHA-IUCAKERBSA-N 293.283 -0.183 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@]1(C)C(=O)O 581728244 AWQWVZPYZVXNNX-RDDDGLTNSA-N 297.271 -0.245 5 20 CBBD CCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 586712022 NUYQHJYZJDSRGE-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD O=C1CCC[C@@H](CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)N1 591763892 PVKQYONFNAFERJ-ONGXEEELSA-N 297.315 -0.590 5 20 CBBD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NC1CNC1 592368505 ROLCHGXEJWFHGI-UHFFFAOYSA-N 287.297 -0.147 5 20 CBBD CN1CC[C@H]1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 712587278 RTRJIVZEZDXTSM-GXSJLCMTSA-N 269.305 -0.554 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](CO)C1CC1 771025379 JASAJKVCDCOXQN-SNVBAGLBSA-N 281.268 -0.356 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1COCO1 861975454 LCAQXBUGCPLYNY-SSDOTTSWSA-N 268.229 -0.325 5 20 CBBD CN1CC[C@](O)(CNc2c([N+](=O)[O-])cnn2C)C1 893186783 FCBRFNPWAPTIEK-JTQLQIEISA-N 255.278 -0.193 5 20 CBBD Cc1cc(N(C)CCCNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1095719255 XPIBWLLCJLAUCZ-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD C[C@H](O)C1(NC(=O)c2c([N+](=O)[O-])cnn2C)CC1 1328433993 XNSVKKJEBPITNZ-LURJTMIESA-N 254.246 -0.029 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C(=O)O)O1 1599924703 YFZDODYGLQNFNI-FSPLSTOPSA-N 284.228 -0.368 5 20 CBBD O=C(O)[C@@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 1610801487 ZRZNMDGRBFIYOK-UWVGGRQHSA-N 270.241 -0.337 5 20 CBBD COC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 35175455 NSAUAGKGEMABCC-UHFFFAOYSA-N 255.186 -0.814 5 20 CBBD CS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 53298963 FXJFRHBREMEHFR-UHFFFAOYSA-N 262.243 -0.038 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 54310315 ICFGFCGCIRONPP-ZCFIWIBFSA-N 256.218 -0.372 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cn1C 110517453 GGADIDISDVCNDO-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD O=c1c(Br)cn(C[C@H](O)CO)cc1[N+](=O)[O-] 128109849 LTTFXGJRZULHSU-YFKPBYRVSA-N 293.073 -0.128 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCC(=O)N1CCOCC1 138143046 OYYHUJGGYGWJHA-UHFFFAOYSA-N 297.267 -0.051 5 20 CBBD CNC(=O)CCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 155337208 CJNOIQVWKTUQSC-NSHDSACASA-N 299.331 -0.390 5 20 CBBD CCNS(=O)(=O)CCNc1c([N+](=O)[O-])c(C)nn1C 227009984 IDIVUEOAUHTUBS-UHFFFAOYSA-N 291.333 -0.012 5 20 CBBD CN1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 265293845 OPKVIWISEHHHFE-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD CS(=O)(=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273652381 UPGACXCMDMFPDO-UHFFFAOYSA-N 287.301 -0.534 5 20 CBBD CNC(=O)C[C@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 322770515 IEDBZPUPXZPFFM-WPRPVWTQSA-N 285.304 -0.734 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 344936248 OYLHVFNRAHUJCI-UHFFFAOYSA-N 279.256 -0.610 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[S@@](=O)C1 350867743 NHGJZYJFUZOOHE-ZLWQNGGKSA-N 284.297 -0.177 5 20 CBBD CN(C[C@@H](O)CO)C(=O)CNc1ccccc1[N+](=O)[O-] 355636343 WNFRZTWFPQJACR-SECBINFHSA-N 283.284 -0.182 5 20 CBBD Nc1nc(=NC[C@H]2CN3CCC[C@H]3CO2)[nH]cc1[N+](=O)[O-] 363571472 NXJCXCVIQKJLHY-IUCAKERBSA-N 294.315 -0.336 5 20 CBBD Cn1c(C(=O)NCc2cc(C(N)=O)no2)ccc1[N+](=O)[O-] 426821318 RRGJQTLCSIMDSK-UHFFFAOYSA-N 293.239 -0.050 5 20 CBBD CNc1nccc(C(=O)NC/C=C/CO)c1[N+](=O)[O-] 597991000 CJKNJGYSYWTISM-NSCUHMNNSA-N 266.257 0.310 5 20 CBBD CC[C@](COC)(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)OC 840474253 FGMPLNUGODJLKR-SOCHQFKDSA-N 274.273 -0.264 5 20 CBBD CN1C(=O)C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1=O 848049238 OACCPLQANXSWKV-ZETCQYMHSA-N 271.273 -0.305 5 20 CBBD CN(C)CCN(CC(=O)N(C)C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 855697716 WQEYTSQDQBDIGX-NXEZZACHSA-N 286.332 -0.870 5 20 CBBD CN(CCCNC(=O)C(N)=O)c1ncccc1[N+](=O)[O-] 1095719244 WUNFOUZIAYUXMK-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD O=C(N[C@@H](CO)C1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1116942474 VWKLESLRYGJKLS-VIFPVBQESA-N 284.272 -0.165 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@H](CO)C1 1319629591 CZWUAZNYTIGXQB-VIFPVBQESA-N 281.268 -0.403 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(=O)N1CCCC1 1319984626 QVCMPJIIKBOIGY-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCOCCF 1330990384 RFYXRWXMORYNSF-UHFFFAOYSA-N 287.247 -0.141 5 20 CBBD CCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1346541450 QKBWBRCBVKKTTC-ZETCQYMHSA-N 271.277 -0.797 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC(CO)(CO)C2)n1 1602403930 VPVWRSOSZOTKSX-UHFFFAOYSA-N 283.240 -0.521 5 20 CBBD CCCNC(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 48816124 LPCSYHLLXFVVGS-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1n[nH]c(=O)[nH]1 92869793 JMHZZRUNPNRISP-UHFFFAOYSA-N 289.207 -0.198 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 167607128 XEUKUJDIKUMIPV-WPRPVWTQSA-N 284.272 -0.601 5 20 CBBD Cc1nn(CCC(=O)N[C@H](C)C(N)=O)c(C)c1[N+](=O)[O-] 171425612 XJSPKSVIKAYVEB-SSDOTTSWSA-N 283.288 -0.212 5 20 CBBD C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C(N)=O 226601048 HHEOXYSAKVVYKK-BYPYZUCNSA-N 270.220 -0.080 5 20 CBBD O=C(NCCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])o1 264421736 AIZSFZWHCZCYSI-UHFFFAOYSA-N 296.239 -0.141 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H](O)C[C@H]1CO 274811777 NLCRDCSDGQETKQ-IUCAKERBSA-N 282.252 -0.132 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H](CO)C2)c1 304380528 YFEHPDRWCVORFL-PWSUYJOCSA-N 284.316 -0.144 5 20 CBBD CN(Cc1nnnn1C)C(=O)c1cc([N+](=O)[O-])c[nH]1 342390945 WVFGDRWQBRHCQM-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](CO)[C@@H]2CCCO2)c1[N+](=O)[O-] 344922543 PGKBTSYTKMGWKK-SFYZADRCSA-N 284.272 -0.104 5 20 CBBD COCc1noc(Cn2ncc([N+](=O)[O-])c2N)n1 346465573 URTCOIZJWFRHJR-UHFFFAOYSA-N 254.206 -0.049 5 20 CBBD NC(=O)c1ccc(N2CCO[C@H](C(N)=O)C2)c([N+](=O)[O-])c1 353088583 OXTCBEZYRTYUBQ-JTQLQIEISA-N 294.267 -0.616 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)NCCN(C)C 552077722 VLUTWRHHFDUUAV-ZETCQYMHSA-N 298.303 -0.886 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(c2c([N+](=O)[O-])c(C)nn2C)C1 592003995 JPAHNHZCMUKIIG-IUCAKERBSA-N 298.299 -0.003 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H]3C[C@H]2CN3)c1[N+](=O)[O-] 602589346 UROKDTNYRNCNLE-YUMQZZPRSA-N 265.273 -0.177 5 20 CBBD C[S@@](=O)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 737172160 GYYOQEAVWSBUNW-HXUWFJFHSA-N 297.300 -0.040 5 20 CBBD Cc1c(C(=O)NOCC(N)=O)cc([N+](=O)[O-])cc1[N+](=O)[O-] 772949882 XYKYGCKJRCCWOA-UHFFFAOYSA-N 298.211 -0.042 5 20 CBBD Cn1nnnc1NC(=O)CCn1cc([N+](=O)[O-])cn1 779466286 BBXLDONPKVNXOG-UHFFFAOYSA-N 266.221 -0.656 5 20 CBBD COCCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839663937 VTDSXMZFVIOSQY-HBNTYKKESA-N 271.317 -0.121 5 20 CBBD CC(C)C(=O)NCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839716503 CSXMLOHEOZPFNX-RKDXNWHRSA-N 257.290 -0.118 5 20 CBBD O=C(Cn1nc2n(c1=O)CCCC2)OCCC[N+](=O)[O-] 860919159 JYIGUGCIKAIPGU-UHFFFAOYSA-N 284.272 -0.409 5 20 CBBD COCC(=O)N1CCC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 953927141 SCKKHYGRTSFIDY-GHMZBOCLSA-N 299.327 -0.253 5 20 CBBD CN(C(=O)c1ncc[nH]1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954222979 GBURJQIYXJJHPK-RKDXNWHRSA-N 293.283 -0.642 5 20 CBBD CS(=O)(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1253818906 UPDKAVOIBXHCTC-UHFFFAOYSA-N 262.247 -0.908 5 20 CBBD CCS(=O)(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319701139 KRELBESCIAMIBH-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(O)CCC1 1320432679 WGEVQSIYFHJULR-UHFFFAOYSA-N 254.246 -0.027 5 20 CBBD NC(=O)[C@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 1329020064 YIVXYOMNBRMDHG-JTQLQIEISA-N 269.261 -0.975 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ncnn1C 1343513932 ZHUQQBRVGAEOST-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1 35160313 OYTCANVSLBXYDJ-VIFPVBQESA-N 268.225 -0.142 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)Cn1ccc([N+](=O)[O-])n1 162063660 OXWGJGWHIPFWSA-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H](O)C2)c1 174649576 IOBVTAHBCCELMF-QWRGUYRKSA-N 270.289 -0.391 5 20 CBBD COCCN(CCn1ccc([N+](=O)[O-])n1)CC(=O)N(C)C 176245417 GZIVZIBCCMHWSA-UHFFFAOYSA-N 299.331 -0.172 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 227049004 LKPNUHAVUMWSGN-SSDOTTSWSA-N 257.202 -0.813 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 228766383 AOMYXGNKPYRUPS-UHFFFAOYSA-N 296.283 -0.331 5 20 CBBD CN(CC(N)=O)C(=O)CN(C)c1ccccc1[N+](=O)[O-] 266290632 ZEMCSDRHIFBUQR-UHFFFAOYSA-N 280.284 -0.025 5 20 CBBD C[C@@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(N)=O 340625593 YXBKRWWZFFPLIA-ZCFIWIBFSA-N 295.251 -0.030 5 20 CBBD CN(CCC(N)=O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 343483671 WMRXUTLFZKAPKF-UHFFFAOYSA-N 268.229 -0.357 5 20 CBBD CCN(CCO)CCNC(=O)c1ccc([N+](=O)[O-])n1C 347793265 NQSZFRQHAZYAKQ-UHFFFAOYSA-N 284.316 -0.023 5 20 CBBD CN(CCOCCO)C(=O)c1ccnc(N)c1[N+](=O)[O-] 576715362 IEPOTVGEEWZDSE-UHFFFAOYSA-N 284.272 -0.347 5 20 CBBD O=C([C@@H]1CCCO1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839462616 BUZNYTBSHOJURC-MXWKQRLJSA-N 297.311 -0.499 5 20 CBBD COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C)C1 839717202 CBLQSRCVBNBKAG-HBNTYKKESA-N 299.327 -0.253 5 20 CBBD CN1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 1256346400 GMKOLIUCKZSOSU-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD CC(C)N(CC(N)=O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1324265488 DUNVEJMLVHIODK-UHFFFAOYSA-N 296.283 -0.521 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCC[C@@H]1CCCN1 1325825588 FYXZICYDKHXZFZ-VIFPVBQESA-N 282.304 -0.165 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1344728105 PNFYRRJGSOWLFY-LURJTMIESA-N 267.245 -0.379 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(NCc2cnn[nH]2)CC1 1578030097 OAGHIFIBYPNECG-GHMZBOCLSA-N 294.315 -0.450 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@](C)(O)C(=O)O 1594460665 KNXVSYDYLGHLJF-SNVBAGLBSA-N 286.244 -0.948 5 20 CBBD CN(CCNC(=O)c1cc([N+](=O)[O-])ccc1N)CC(=O)O 1598492009 BTIINUQZGSGNJP-UHFFFAOYSA-N 296.283 -0.077 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCC(=O)CCC(=O)O)n1 1600970690 NCAPXGFLFXYSTC-UHFFFAOYSA-N 285.212 -0.081 5 20 CBBD CN(C)C(=O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 178420967 ZLWNZYJUXCQZCQ-UHFFFAOYSA-N 284.276 -0.821 5 20 CBBD NC(=O)c1ccc(CN2C[C@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 179171297 PGCQDIKYMJFMTI-GHMZBOCLSA-N 295.295 -0.379 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)C(F)F 230231391 APSTUOMTYAFYOT-RXMQYKEDSA-N 264.188 -0.467 5 20 CBBD COCCN1CN(c2ncc([N+](=O)[O-])c(N)n2)CC1=O 282897549 FEANQGKTTAJLRH-UHFFFAOYSA-N 282.260 -0.781 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)CCNc1ccccc1[N+](=O)[O-] 352995804 YQTICTOEIOUQIX-SECBINFHSA-N 296.283 -0.641 5 20 CBBD Cc1nc(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 354491706 AXZKFBQFNCRKKF-UHFFFAOYSA-N 279.260 -0.423 5 20 CBBD N[C@H]1C[C@@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 563431265 LRHMKMCLEJQBOI-ZJUUUORDSA-N 277.284 -0.262 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cn1C 577808617 ZELCBNUTVGFTPE-LURJTMIESA-N 254.246 -0.073 5 20 CBBD N[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[C@H]1F 595261407 ZFBQRPPDCSSKCJ-HTQZYQBOSA-N 271.252 -0.311 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCc1nn[nH]n1 609496260 CPYPYXVSSRHIAU-UHFFFAOYSA-N 264.205 -0.786 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 814042336 ICUBQVLYPVNRRS-JVXZTZIISA-N 299.283 -0.085 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)c1n[nH]cc1[N+](=O)[O-])C2 861869560 MTMSDZGTALZSMV-CRCLSJGQSA-N 252.186 -0.542 5 20 CBBD O=[N+]([O-])c1cnn(C/C=C/Cn2ncc([N+](=O)[O-])n2)n1 863372618 YEEQRWYUGVVSRH-OWOJBTEDSA-N 280.204 -0.058 5 20 CBBD Cc1cc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)no1 991282128 WPVUBFXQANXQRT-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD Cc1cnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1030292551 OESKAEBALRHWCW-NXEZZACHSA-N 280.284 -0.051 5 20 CBBD CC(=O)NCCN1CCC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1055483811 QSTGZYLFXDVDJX-VXGBXAGGSA-N 298.343 -0.632 5 20 CBBD O=C(N1CCOCC1)N1CCN(CC[N+](=O)[O-])CC1 1119740150 FURNRYLHMROSKL-UHFFFAOYSA-N 272.305 -0.667 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1319756516 PAZCFXUSGRHVEH-MRVPVSSYSA-N 295.299 -0.074 5 20 CBBD CC(C)(CCC(=O)N[C@@](C)(CO)C(=O)O)[N+](=O)[O-] 1592742556 PMSYSPASFYKEOU-JTQLQIEISA-N 262.262 -0.226 5 20 CBBD CNC(=O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 5038977 XBJUQKGGNDFHHO-UHFFFAOYSA-N 254.202 -0.788 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1c([N+](=O)[O-])cnc1C 65694084 GOBKVGKCODMRIH-SSDOTTSWSA-N 299.287 -0.040 5 20 CBBD Cn1c(C(=O)NC(C)(CO)CO)ccc1[N+](=O)[O-] 126136042 UKVKKXBQVQNSLW-UHFFFAOYSA-N 257.246 -0.594 5 20 CBBD CCN1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174646079 SGSIOASESQLBHR-LBPRGKRZSA-N 283.332 -0.210 5 20 CBBD COC(=O)[C@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 227050772 GTYVPDHYNJCARK-SNVBAGLBSA-N 282.252 -0.213 5 20 CBBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1C[C@@H](O)C[C@H]1CO 274810258 MREAXHRFDKPDHI-IUCAKERBSA-N 282.252 -0.132 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)O1 285624208 JZQRFFNRSVZSLA-VDTYLAMSSA-N 283.244 -0.919 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)CO)c([N+](=O)[O-])n1 339038961 DNPNJLSINLIDKF-LURJTMIESA-N 278.290 -0.530 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 348630569 UOMKZPMGQITMKH-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NCCOCC(N)=O)c1 353295378 WNDOIUMYHGDXSH-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD CCNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 360743469 DVJZBVHDGPTQCD-UHFFFAOYSA-N 281.272 -0.464 5 20 CBBD COC(=O)NCCOC(=O)Cn1ccc([N+](=O)[O-])n1 491517875 DSHJWXWVSHOQPY-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD COC(=O)N1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 494095456 VMPCBAJPFUGHGL-UHFFFAOYSA-N 297.271 -0.148 5 20 CBBD O=[N+]([O-])c1cnn(CCNc2nccn3nnnc23)c1 532020268 KRPSGVICUTZVFZ-UHFFFAOYSA-N 275.232 -0.264 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)c1c[nH]nc1[N+](=O)[O-] 547754491 RGZZOFTWMMUTIS-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD CCCN(CC(N)=O)C(=O)c1ccnc(NC)c1[N+](=O)[O-] 575428845 BMFVMMLNJRQEPQ-UHFFFAOYSA-N 295.299 0.369 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)c1c[nH]nc1[N+](=O)[O-] 598174572 GGOMXZGVXNWXQW-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD CN(CC(N)=O)c1ncnc(N2CCOCC2)c1[N+](=O)[O-] 598590793 PIXSMBKAQSSYLS-UHFFFAOYSA-N 296.287 -0.857 5 20 CBBD NC(=O)c1cccc([N+](=O)[O-])c1N1C[C@H](O)[C@@H](O)C1 599125214 MNOBOPFDPXPDIO-IUCAKERBSA-N 267.241 -0.765 5 20 CBBD CN(CC(N)=O)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O 757813288 NKWWNIDELACCNW-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD O=C(O)[C@H]1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CCO1 821511047 PASMEUZZUHHQRY-SECBINFHSA-N 296.239 -0.271 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)C(C)(F)F)C1 954234989 NWWZIKSUBGIPSA-HTQZYQBOSA-N 291.254 -0.024 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccco1 990077530 PBDYPXLCLKFBNM-RKDXNWHRSA-N 279.252 -0.115 5 20 CBBD NC[C@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 1326492361 XWQTWDMTDDIWGL-MRVPVSSYSA-N 286.313 -0.041 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1327076567 ZIXCLFFBNGVPQW-LURJTMIESA-N 267.245 -0.345 5 20 CBBD COC(COCCNC(=O)c1c[nH]nc1[N+](=O)[O-])OC 1344727396 JNVKYOJQKPNBDT-UHFFFAOYSA-N 288.260 -0.317 5 20 CBBD O=[N+]([O-])c1cnn(-c2ccnc(-c3nn[nH]n3)n2)c1 1593486889 CFENCLAXTMIREG-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nnn[nH]1 44929394 XUVNPVRQTIVKMM-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD C[S@](=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 171850274 NEVFVLUVRQFMAK-SFHVURJKSA-N 274.302 -0.324 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN1CCn1cc([N+](=O)[O-])cn1 188597509 FLCIFGNOEFWHAO-VHSXEESVSA-N 284.272 -0.601 5 20 CBBD COC[C@H](C)OC[C@@H](O)Cn1cnc([N+](=O)[O-])n1 234800162 NQSUJSYARXDDLP-YUMQZZPRSA-N 260.250 -0.401 5 20 CBBD O=C1CN(CCNc2ncc([N+](=O)[O-])cn2)CCN1 273724168 HCHNYNLRFCXGQW-UHFFFAOYSA-N 266.261 -0.772 5 20 CBBD COCC[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 281556933 KQZXXNBKTANCIU-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD C[C@@H](CO)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 283750111 YXCMWJJWJVYHKE-QMMMGPOBSA-N 269.257 -0.404 5 20 CBBD C[C@H](C(=O)N[C@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1F 341732398 PWBOTANCGWDLNE-QUBYGPBYSA-N 299.258 -0.200 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CC[C@@H](O)[C@H]3C2)c1 344067569 PVEHDEWHQRQEBL-ZBAXXZLZSA-N 296.327 -0.145 5 20 CBBD CS(=O)(=O)CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 350664228 XFCYOEJXIRTGSL-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD Cc1nc(CCNC(=O)c2cc([N+](=O)[O-])nn2C)n[nH]1 359489866 HWWBKJBXRJSTCY-UHFFFAOYSA-N 279.260 -0.273 5 20 CBBD CCN1CCOC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 378445941 WXZSFMQEBJDOIU-NSHDSACASA-N 297.315 -0.372 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1C[C@H](O)[C@@H](N(C)C)C1 602838093 PTDQJAVIWKRICJ-QWRGUYRKSA-N 283.332 -0.294 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)NC(=O)[C@H]3C2)c1[N+](=O)[O-] 611509876 IKVFXEUWRBIWHJ-SSDOTTSWSA-N 294.271 -0.623 5 20 CBBD Cc1[nH]nc(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 807921647 QVAXEOZWNQJEQZ-UHFFFAOYSA-N 266.221 -0.957 5 20 CBBD O=C(N[C@H]1C[C@@H]2CCCCN2C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839793585 UYYZHSQFUZUIRL-QCLAVDOMSA-N 267.285 -0.079 5 20 CBBD CN(CCN(C)c1ncccc1[N+](=O)[O-])C(=O)CC(N)=O 1105348338 DALZHHQJFDTBSP-UHFFFAOYSA-N 295.299 -0.240 5 20 CBBD C=CC(=O)NCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1321725249 ISKHMPUIJOUQAG-UHFFFAOYSA-N 281.272 -0.331 5 20 CBBD CN1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 1324405714 VXSSQHQDEPTCHO-LBPRGKRZSA-N 293.279 -0.071 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2[C@@H]3CNC[C@@H]32)c1[N+](=O)[O-] 1326899161 MHDLNUYKDUCTKI-JIGDXULJSA-N 265.273 -0.416 5 20 CBBD N[C@H]1C[C@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1580429056 OVADLCZSKCTYIJ-ZKCHVHJHSA-N 266.257 -0.638 5 20 CBBD CNc1c(C(=O)N[C@@H](CO)C(=O)O)cccc1[N+](=O)[O-] 1598676889 DYDMQHMOMJZECS-ZETCQYMHSA-N 283.240 -0.188 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)NC(CO)(CO)CO 236488272 PAXFGPBWUDBTNR-UHFFFAOYSA-N 285.256 -0.568 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCCOCCO 255189717 RPHFKXYPGWFYDR-UHFFFAOYSA-N 269.257 -0.084 5 20 CBBD COC[C@@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 280056907 QJLPIQDHGYXVIV-MRVPVSSYSA-N 269.257 -0.086 5 20 CBBD Nc1nc(N2CC[C@](F)(CO)C2)ncc1[N+](=O)[O-] 338415583 BHHFDXGBLQITJF-SECBINFHSA-N 257.225 -0.122 5 20 CBBD O=C1NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@H]12 352443981 UXSSZIVIUQRPIW-SSDOTTSWSA-N 293.239 -0.701 5 20 CBBD Cc1nc(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)n[nH]1 358602474 RNVQSRUIVZBDHH-UHFFFAOYSA-N 279.260 -0.423 5 20 CBBD CC(C)(CNC(=O)c1ccnc(N)c1[N+](=O)[O-])C(N)=O 548084664 CQTOSNTYSINHOC-UHFFFAOYSA-N 281.272 -0.187 5 20 CBBD CCOC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n[nH]1 560631481 MZJLSCMFTNJHKC-UHFFFAOYSA-N 294.227 0.470 5 20 CBBD Nc1nc(N2CCO[C@@H](CC(=O)O)C2)ncc1[N+](=O)[O-] 578991863 HNWRALKPLZFIPU-LURJTMIESA-N 283.244 -0.353 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc([N+](=O)[O-])cn2)n1 590551463 OEIZXHOTJWGXRP-UHFFFAOYSA-N 277.244 -0.337 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H](C)O1 593840760 ZYIZDNHGPWQJIW-XPUUQOCRSA-N 298.255 -0.280 5 20 CBBD O=C(NCC[C@@]1(O)CCCOC1)c1cc([N+](=O)[O-])n[nH]1 593879325 FOEPQYZTFJNCRM-NSHDSACASA-N 284.272 -0.021 5 20 CBBD NC(=O)[C@@]1(NC(=O)Cc2ccccc2[N+](=O)[O-])CCOC1 594404905 QKVQNDAAUWHPCL-CYBMUJFWSA-N 293.279 -0.102 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 598516824 IIRSQAQYSMPTCW-IZLXSQMJSA-N 268.229 -0.001 5 20 CBBD CNC(=O)[C@H](O)CNc1nc2ccccn2c1[N+](=O)[O-] 758113487 ITTURVWZCQOVBF-SSDOTTSWSA-N 279.256 -0.239 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 763698725 LZZVEWJIVRKZLR-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1[N+](=O)[O-] 1117727518 SXCWPFCLSNQTLG-JIGDXULJSA-N 266.257 -0.063 5 20 CBBD CO[C@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118786136 GFWDCKAGVRRDEY-MRVPVSSYSA-N 269.257 -0.092 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1nnc(C[N+](=O)[O-])n1C 1350597838 JHAZPCMPLZBNSA-ZETCQYMHSA-N 268.277 -0.741 5 20 CBBD Cn1c(Cn2cnc([N+](=O)[O-])n2)nnc1N1CCCC1 1518160873 QERBXRBIZWEDPX-UHFFFAOYSA-N 278.276 -0.037 5 20 CBBD Cn1cc(CN2CCO[C@H](C(=O)O)C2)c([N+](=O)[O-])n1 1594542886 PCWVPEGUKFYOGK-QMMMGPOBSA-N 270.245 -0.386 5 20 CBBD O=C(O)C1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 1594950803 BXNDCJWPKLEPAT-UHFFFAOYSA-N 267.197 -0.148 5 20 CBBD COC[C@H](O)CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1609330931 YYNMZUMRAWPQIW-SSDOTTSWSA-N 295.259 -0.411 5 20 CBBD CNc1ccc(C(=O)NCC(N)=O)cc1[N+](=O)[O-] 48521455 JIHSFJVZXBWEQL-UHFFFAOYSA-N 252.230 -0.148 5 20 CBBD CO[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)O 227274772 QEORYVQUIPFEPS-QMMMGPOBSA-N 271.229 -0.237 5 20 CBBD CN[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 261808391 SJVZWAUYYOODNV-QMMMGPOBSA-N 268.273 -0.519 5 20 CBBD Cc1c(NC(=O)C(=O)NC(CO)CO)cccc1[N+](=O)[O-] 267393330 PESGCGHITRTFMF-UHFFFAOYSA-N 297.267 -0.689 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCN(CCO)CC1 275068750 WDWPTGIKIMUPCE-UHFFFAOYSA-N 296.283 -0.555 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 280132991 RQPJCARSFYMCOH-LBPRGKRZSA-N 295.299 -0.095 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H](CO)C2)c1 304380530 YFEHPDRWCVORFL-ZYHUDNBSSA-N 284.316 -0.144 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H](S(N)(=O)=O)C1 342429449 YCQUPUWKSGMHTN-SSDOTTSWSA-N 289.317 -0.414 5 20 CBBD Cc1c(CC(=O)N[C@@H](CO)C(N)=O)cccc1[N+](=O)[O-] 353001482 GIAPTFCHGBPLQB-VIFPVBQESA-N 281.268 -0.592 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC(O)(C2CC2)C1 364959998 KYQSMFDHAXUEOR-UHFFFAOYSA-N 293.279 -0.260 5 20 CBBD C[C@@H](CO)N(Cc1c([N+](=O)[O-])ncn1C)C[C@@H](C)O 443343114 GAFQRMPZXFSYJR-DTWKUNHWSA-N 272.305 -0.108 5 20 CBBD CN1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C(=O)N1 450615588 QHWODNKNEUQLBK-VIFPVBQESA-N 282.231 -0.191 5 20 CBBD COC[C@H](CCO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 515179354 JSYATFLTWKMLNO-ZETCQYMHSA-N 284.272 -0.301 5 20 CBBD NC(=O)c1ccnc(NCC(=O)N2CCCO2)c1[N+](=O)[O-] 599089852 OUTGGKRKUJGNLZ-UHFFFAOYSA-N 295.255 -0.336 5 20 CBBD Cn1ccc(CC(=O)OCCn2cnc([N+](=O)[O-])n2)n1 782611700 QFGJMFFFMRGZNX-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839578025 JJLODINVFROEIT-GMTAPVOTSA-N 277.280 -0.136 5 20 CBBD CC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)C1 839705205 CUPDUTALOIKVFX-SZEHBUNVSA-N 255.274 -0.269 5 20 CBBD CN(C)C(=O)CN1CCC(NCC[N+](=O)[O-])CC1 905107283 XVBDABBZPVDVMB-UHFFFAOYSA-N 258.322 -0.595 5 20 CBBD CCN1C(=O)[C@@H]2CN(CC[N+](=O)[O-])CCN2C1=O 929809479 KSZWMAABWJTQFU-QMMMGPOBSA-N 256.262 -0.769 5 20 CBBD COCCN1CC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2 1053253791 YPRRXISEWDHVRL-GHMZBOCLSA-N 299.327 -0.789 5 20 CBBD CN(C)C[C@@H](O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 1117684149 FXQPCWKXOZFWRL-ZETCQYMHSA-N 283.288 -0.577 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1261245988 XCPJQVHCLYVZQG-YFKPBYRVSA-N 255.234 -0.509 5 20 CBBD COC[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 1599182297 ZLKPPNQHQOBXRL-ZCFIWIBFSA-N 273.201 -0.566 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H](C(=O)O)O1 1599918614 QJCSDOZESBQEGK-YUMQZZPRSA-N 298.255 -0.508 5 20 CBBD CCc1nc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n[nH]1 1604557649 PTZPLHPEQLVVPM-UHFFFAOYSA-N 290.247 -0.300 5 20 CBBD CCOC(=O)CCCNC(=O)Cn1cnc([N+](=O)[O-])n1 48603024 DTGOABJSMJFKLQ-UHFFFAOYSA-N 285.260 -0.354 5 20 CBBD O=C(Cn1cnnn1)NCc1ccc([N+](=O)[O-])cc1 55796935 ZPFGUMPRXKXJGR-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD Cc1c(C(=O)N(CC(N)=O)CC(N)=O)cccc1[N+](=O)[O-] 68340429 FJWTXQQZVUDEPU-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD NCC(F)(F)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 190248221 HYTSLFKHJLITNV-UHFFFAOYSA-N 290.226 -0.533 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 195143934 JLKGCXNNFHLIRQ-HZGVNTEJSA-N 293.283 -0.174 5 20 CBBD NC(=O)CCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230683890 HGFUNXAIRCEVIY-UHFFFAOYSA-N 267.245 -0.433 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1C(=O)N(CC(N)=O)CC(N)=O 264911405 RKIUAHFAOSDJLZ-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 270732471 POBMURHOSNUUIK-ZCFIWIBFSA-N 268.229 -0.047 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C[C@@H](C)O)CC2)c1[N+](=O)[O-] 275443713 MIGABNPTUUTJFA-MRVPVSSYSA-N 297.315 -0.235 5 20 CBBD NC(=O)N[C@H](CO)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 352184696 UZERECOEAJJWSN-MRVPVSSYSA-N 286.219 -0.298 5 20 CBBD NS(=O)(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])cn2)C1 354515178 ZOXNTNYCEAJLKB-QMMMGPOBSA-N 287.301 -0.358 5 20 CBBD Cn1nnc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)n1 362951233 LLYWWUOEJWARKD-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCn2c(O)nnc2C1 438448903 KZYQAYFXECEAIQ-UHFFFAOYSA-N 279.216 -0.729 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 443037009 NATAQSVIVWLPNO-FSPLSTOPSA-N 267.245 -0.428 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCC1CN(S(C)(=O)=O)C1 490032923 ODLIDBMHXDUPIQ-UHFFFAOYSA-N 289.317 -0.368 5 20 CBBD C[C@@]1(CO)CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 546103499 CQLVOSLTFGABDJ-RYUDHWBXSA-N 284.316 -0.001 5 20 CBBD C[C@](O)(CNc1ccc2ncc([N+](=O)[O-])n2n1)C(=O)O 565602700 GFHDQZGQTSXKOV-JTQLQIEISA-N 281.228 -0.115 5 20 CBBD CO[C@@H]1C[C@@H](CC(=O)O)N(c2ncc([N+](=O)[O-])c(N)n2)C1 571288254 VPKFOJXHMZOWCS-NKWVEPMBSA-N 297.271 0.035 5 20 CBBD O=[N+]([O-])c1cnc(N2CC(N3CC[C@@H](O)C3)C2)nc1 593507146 CSSYNZCPOTXBRI-SNVBAGLBSA-N 265.273 -0.360 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 600324850 HMWYVWRAMLRVBA-UHFFFAOYSA-N 288.285 -0.704 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN(C)C[C@@H]1CO 699457421 JXFZJPFATBBYOW-LLVKDONJSA-N 283.332 -0.292 5 20 CBBD NS(=O)(=O)c1ccc(C(=O)OCCO)cc1[N+](=O)[O-] 801440145 YBCVXJWQTXHDNM-UHFFFAOYSA-N 290.253 -0.609 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840418049 DQQCKJUTAPLPJH-SGIHWFKDSA-N 258.274 -0.350 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 863704448 KGLBCTZSDSMPLO-ZCFIWIBFSA-N 285.260 -0.236 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cocn2)C1 954235015 OLYJHLGPSLGROD-PSASIEDQSA-N 294.267 -0.377 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCS(=O)CC1 1318607228 HDHHORGQGARSAT-UHFFFAOYSA-N 299.308 -0.653 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H](C)CN)c1[N+](=O)[O-] 1328236794 SWEVQEZGAQOEGR-ZCFIWIBFSA-N 255.278 -0.039 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H]2CNCCCO2)c1[N+](=O)[O-] 1328333193 UFIUPAGHDBJZQS-VIFPVBQESA-N 297.315 -0.255 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@H](F)C(=O)O 1601522178 QTGKZWJXYFBQLY-YFKPBYRVSA-N 272.192 -0.044 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1603124744 OLUGONCMTUFUEJ-YFKPBYRVSA-N 257.206 -0.834 5 20 CBBD O=C(NC(CO)CO)c1cc(F)ccc1[N+](=O)[O-] 87750820 JDRFJVKKFGYKFL-UHFFFAOYSA-N 258.205 -0.183 5 20 CBBD CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 163627768 LTQADXUPCQAHDQ-UHFFFAOYSA-N 253.218 -0.768 5 20 CBBD CC(C)[C@@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 289472257 ZCLQSGFDRKNHDB-ZYHUDNBSSA-N 299.331 -0.358 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H]2CNC[C@@H]2C1 290174817 PDAGJSKNLJJDAW-NXEZZACHSA-N 279.300 -0.141 5 20 CBBD COC(=O)[C@H](CNc1ncc([N+](=O)[O-])c(N)n1)OC 292241348 JKTZYOVCRPHVMS-LURJTMIESA-N 271.233 -0.433 5 20 CBBD COc1ccc(C(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 298244491 RDOQGDYZMWJZBR-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(N)=O 355268032 SIHVGHRFFUZKTE-ZCFIWIBFSA-N 254.246 -0.073 5 20 CBBD C[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(N)=O 444835246 MIUKMTJBQYONIB-BYPYZUCNSA-N 254.202 -0.701 5 20 CBBD NS(=O)(=O)c1c(N2CC[C@@H](O)C2)cccc1[N+](=O)[O-] 522735169 YLAYRGRAYCBMRM-SSDOTTSWSA-N 287.297 -0.187 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CO)[C@@H](O)C1 547403080 ZQVMNHCSIPNJKP-KWQFWETISA-N 283.284 -0.251 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCc1nn[nH]n1 611528291 DVSHVUUQJIGZOP-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)CCNc1ccccc1[N+](=O)[O-] 618923402 ITNOJVRFSWBWJQ-JTQLQIEISA-N 296.283 -0.641 5 20 CBBD CN(CCS(C)(=O)=O)c1c([N+](=O)[O-])ncn1C 728051357 RUEHFTFFBAHPGJ-UHFFFAOYSA-N 262.291 -0.191 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CCN1C 928563818 SKEKOPRGDJKZQU-VIFPVBQESA-N 267.289 -0.080 5 20 CBBD C[C@H]1C[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(=O)O1 1329065851 KPXUWAOSFWQOLO-WDSKDSINSA-N 268.229 -0.238 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@](C)(CO)C(=O)O)n1 1597899634 NTKAHVOTCHPOGK-SNVBAGLBSA-N 286.244 -0.623 5 20 CBBD O=C(c1[nH]nc([N+](=O)[O-])c1Cl)N1CC(O)(C(=O)O)C1 1609026794 DIXURJXNQUJGEA-UHFFFAOYSA-N 290.619 -0.757 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 35175382 FDUSMTNLUVMMPG-SSDOTTSWSA-N 271.229 -0.803 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H](O)C2CC2)c1 71304731 LULOMGOMDYMRDL-QWRGUYRKSA-N 270.289 -0.487 5 20 CBBD CC(C)(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 171813192 AQZICQMLQRTXJY-SECBINFHSA-N 283.288 -0.193 5 20 CBBD NC(=O)NC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 185170370 UQQUTNMMIJGMPH-UHFFFAOYSA-N 253.218 -0.136 5 20 CBBD CNS(=O)(=O)CC(=O)NCc1ccccc1[N+](=O)[O-] 267598088 MIABVFHJMVSVBK-UHFFFAOYSA-N 287.297 -0.240 5 20 CBBD CN(C(=O)CN1C[C@H](O)[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1 278693850 JJASNJAWWIWECK-RYUDHWBXSA-N 295.295 -0.405 5 20 CBBD CC[C@@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285390743 NXUDOUTVTSRIBF-SECBINFHSA-N 297.315 -0.153 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CCC[C@H]2CO)c1 312878660 VLYAAMMWKRHEDC-DLOVCJGASA-N 284.316 -0.097 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCC1 337574120 FFNNZWYMTNUFAW-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD COCCCN(CCO)C(=O)c1cc([N+](=O)[O-])nn1C 353350380 UARUXPLIGDTDME-UHFFFAOYSA-N 286.288 -0.201 5 20 CBBD O=C(N[C@@H]1C=C[C@@H](CO)C1)c1cc([N+](=O)[O-])n[nH]1 354065068 PFLIMNYCHZOURO-RNFRBKRXSA-N 252.230 -0.015 5 20 CBBD NC(=O)Cn1ccc(Nc2ncc([N+](=O)[O-])cn2)n1 354607533 QLSUHSROJXHDDK-UHFFFAOYSA-N 263.217 -0.190 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 436977879 SYHGBVNKRFPAED-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@H](CO)[C@H](O)C1 545282204 OZBAJGLZFCTLRJ-VXNVDRBHSA-N 269.257 -0.262 5 20 CBBD Cc1cc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 591740912 GHZPSIGBJUBOMO-NSHDSACASA-N 280.288 -0.026 5 20 CBBD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCN 592363156 GLCBJMNVXCJBQA-UHFFFAOYSA-N 275.286 -0.160 5 20 CBBD O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N[C@H]1CNOC1 722489735 LRXOQIMJHUKRNT-LURJTMIESA-N 291.260 -0.084 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 799949395 NQVNFJUZRKYKGC-MRVPVSSYSA-N 274.302 -0.132 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@@H]1CCCN(C(N)=O)C1 814042194 HVCIVECMHVIVRE-JGVFFNPUSA-N 259.262 -0.015 5 20 CBBD COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H]1C 840411084 SZMLJIMGAPQICC-HBNTYKKESA-N 299.327 -0.253 5 20 CBBD CN1CC[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc([N+](=O)[O-])n1 923298108 LYCMNDVLACXNCX-VHSXEESVSA-N 294.315 -0.119 5 20 CBBD Cc1c[nH]cc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991290667 NFLYJKHGEOGIJY-MWLCHTKSSA-N 292.295 -0.071 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)C(F)F 1122372575 LXEVQKGRMQKZGZ-UHFFFAOYSA-N 277.231 -0.201 5 20 CBBD C[C@]1(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCNC1 1327592394 KMDSMNHLBWKARJ-LBPRGKRZSA-N 280.284 -0.375 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](O)C[C@H]1CO 1342932145 LUKNSCWCTDDMHB-IUCAKERBSA-N 284.272 -0.946 5 20 CBBD CC(C)(C)S(=O)(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1347699492 VZTZRWOGTFRJKU-UHFFFAOYSA-N 291.289 -0.569 5 20 CBBD NC(=O)c1cc(NC[C@H](O)CO)ccc1[N+](=O)[O-] 1350473994 JGVXLCRUTSTGSM-ZETCQYMHSA-N 255.230 -0.541 5 20 CBBD COCCN(CC(=O)O)C(=O)c1c[nH]nc1[N+](=O)[O-] 1593997917 PTFPOIPAHRYCKB-UHFFFAOYSA-N 272.217 -0.509 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CCO1 50855930 FZWXNUCIRVPOQY-SNVBAGLBSA-N 279.252 -0.079 5 20 CBBD CN(CC(N)=O)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 56058503 UVSKSNULCGNBRL-UHFFFAOYSA-N 287.297 -0.158 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCc1ncn[nH]1 80586263 TVJXVQVXVDEDLE-UHFFFAOYSA-N 265.233 -0.732 5 20 CBBD NC(=O)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N 173015871 QQFOFCFHNSIYJS-UHFFFAOYSA-N 270.220 -0.079 5 20 CBBD COC(=O)N(C)CC(=O)Nc1c([N+](=O)[O-])cnn1C 274596551 LNBNPBJAFLCMQK-UHFFFAOYSA-N 271.233 -0.035 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NCC(=O)NCCO 277597832 OGWGMXMZSHOALR-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD COC(=O)C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CCO1 287575668 QTIRNMRNOQRRRH-SSDOTTSWSA-N 298.255 -0.278 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 576031288 MADGPOSHJSGSNS-ZCFIWIBFSA-N 281.228 -0.805 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 576238873 LHKIPKDGLTVVGY-ZETCQYMHSA-N 295.299 0.238 5 20 CBBD COc1ccc(CNC(=O)C2(O)CNC2)cc1[N+](=O)[O-] 595930992 DWJLOPCRHJWEGE-UHFFFAOYSA-N 281.268 -0.446 5 20 CBBD O=C(c1cc2c(c([N+](=O)[O-])c1)OCO2)N1C[C@H](O)[C@@H](O)C1 600217207 SOASSIZMRIXGCW-IUCAKERBSA-N 296.235 -0.499 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@H](c2nn[nH]n2)C1 619789412 ZZCYLZZTNRKOSB-LURJTMIESA-N 292.259 -0.149 5 20 CBBD NC(=O)C1(C(=O)OCCn2ccc([N+](=O)[O-])n2)CC1 748122766 PANUUCOSJWOECN-UHFFFAOYSA-N 268.229 -0.400 5 20 CBBD CC[C@@]1(C)NC(=O)N(NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 769812320 JHGCMELMECKBMR-SNVBAGLBSA-N 296.243 -0.317 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1C(=O)O 828349913 VLUGYAZGBAPHDR-RNFRBKRXSA-N 283.244 -0.635 5 20 CBBD O=C(CO[C@H]1CCCNC1)NCCn1cc([N+](=O)[O-])cn1 843495348 PMBMTZNQWVSMRI-NSHDSACASA-N 297.315 -0.324 5 20 CBBD CCN1C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 846461698 OWWCPCLMLCMBAF-IWSPIJDZSA-N 255.274 -0.364 5 20 CBBD O=[N+]([O-])c1c(NCCn2cnnn2)ccnc1O 853709187 FXMGIHSUKWXRBZ-UHFFFAOYSA-N 251.206 -0.206 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@H](O)C1 863833931 YINWSPCGXAWFRB-JTQLQIEISA-N 294.311 -0.027 5 20 CBBD O=[N+]([O-])c1cnc(N2C[C@H](O)[C@@H](CO)C2)c(F)c1 894162239 PLTPOIXYGFUOLR-MUWHJKNJSA-N 257.221 -0.082 5 20 CBBD Cc1c[nH]nc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991299317 TWRJVNFORZQUIM-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD COCC[C@@H](Nc1ncc([N+](=O)[O-])cn1)C(N)=O 1116579430 QEKWTVQJECHAQF-SSDOTTSWSA-N 255.234 -0.313 5 20 CBBD CN[C@@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1118203542 SEHMEWGKDPTYCC-SSDOTTSWSA-N 253.262 -0.238 5 20 CBBD Cn1cc([N+](=O)[O-])c(NCCC(=O)NCCC(=O)O)n1 1600971035 VMKIZEWLGCUBGC-UHFFFAOYSA-N 285.260 -0.279 5 20 CBBD O=C(O)c1ccnc(N2CC[C@@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 1602479740 OCELIXDKUJZILB-SFYZADRCSA-N 283.240 -0.380 5 20 CBBD CN(CC(=O)N1CCOCC1)Cn1cc([N+](=O)[O-])cn1 111163940 VEEKMMIXLWBYIS-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1CCn1ccc([N+](=O)[O-])n1 176259551 JCWMPNVQVNAAAS-VIFPVBQESA-N 288.329 -0.090 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCN1CCCC1=O 193128703 VYAIPUOKJSWBSZ-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@H]1O 285399481 AVLQXIOHSZITIR-NXEZZACHSA-N 256.262 -0.517 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCOCCO 337618981 PODSHIDCCLXMBH-UHFFFAOYSA-N 286.288 -0.433 5 20 CBBD CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1COC[C@@H]1O 352794938 BMXMJGBYFJMYQJ-NEPJUHHUSA-N 295.295 -0.115 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 357652063 SFSCOYVBRNVZHE-MRVPVSSYSA-N 281.272 -0.485 5 20 CBBD CC[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)NC 450940130 LHZWBBJLGQSYCF-YFKPBYRVSA-N 254.250 -0.097 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(N3CC[C@@H](O)C3)C2)c1[N+](=O)[O-] 593856106 VIEURMLESGTSCB-SECBINFHSA-N 295.299 -0.483 5 20 CBBD C[C@]1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCNC1 595993121 VVBQHPWOULLUDA-LBPRGKRZSA-N 280.284 -0.375 5 20 CBBD O=C(O)CN1CC[C@H](n2cc([N+](=O)[O-])cc(F)c2=O)C1=O 853002697 SNEZZEJKCPOOSS-QMMMGPOBSA-N 299.214 -0.246 5 20 CBBD Cc1ccc(N(C)CCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1100294540 AOKQQXHHAIYGKR-UHFFFAOYSA-N 280.284 -0.059 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCn2cnnc2C1 1321892349 DGNNWPJKSNBQLD-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD C[C@@H]([C@@H](C)O)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589995170 IVKIQMGFRGMMJY-CRCLSJGQSA-N 253.222 -0.087 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N[C@@H]1COC[C@H]1O 1593469884 BGPBOZJJGRRDAB-PSASIEDQSA-N 292.255 -0.054 5 20 CBBD O=C(O)COCC(=O)OCCn1ccc([N+](=O)[O-])n1 1602077738 SJAIPZSTTNCDFF-UHFFFAOYSA-N 273.201 -0.564 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](O)C[C@@H]2C(=O)O)n1 1605926393 WGHYGZIZKGHMOA-RNFRBKRXSA-N 298.255 -0.529 5 20 CBBD COC(=O)[C@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])o1 1606324694 VTCMHKBLJJFJLX-YFKPBYRVSA-N 286.196 -0.066 5 20 CBBD Cn1ccnc1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 71273617 VAQNIMZTBRDWOV-JTQLQIEISA-N 280.288 -0.325 5 20 CBBD C[C@@](O)(CO)CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] 90287848 GDTXALPVASXTTG-LBPRGKRZSA-N 294.267 -0.014 5 20 CBBD CCc1nn(C)c(NCCNS(C)(=O)=O)c1[N+](=O)[O-] 91562507 YPBHWKWQFYQFJX-UHFFFAOYSA-N 291.333 -0.148 5 20 CBBD COCCN(CC(=O)O)C(=O)c1nn(C)cc1[N+](=O)[O-] 263280586 OGXMQZPPFBVRRB-UHFFFAOYSA-N 286.244 -0.499 5 20 CBBD CN1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1=O 263746246 BFGAMTPZWKUXDT-MRVPVSSYSA-N 294.267 -0.897 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1C[C@H](O)[C@H](O)C1 278659526 HTICRBQHTSHOIZ-ZMLRMANQSA-N 298.295 -0.628 5 20 CBBD CO[C@@H]1C[C@@H](CO)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 314565471 MGDZUEMCSYYMLU-DTWKUNHWSA-N 296.283 -0.206 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)NCCF 337073761 ZQCXDCUDISTFIH-ZETCQYMHSA-N 287.251 -0.618 5 20 CBBD CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 344185662 QUUFANNQVPVDQP-JGVFFNPUSA-N 298.303 -0.394 5 20 CBBD CN1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@H]2C1 347653840 LSLZNPWBOVQSPI-DTORHVGOSA-N 279.300 -0.038 5 20 CBBD CN1CC[C@](O)(CNc2c([N+](=O)[O-])ncn2C)C1 358325077 AJBNCTZGVASSFF-JTQLQIEISA-N 255.278 -0.193 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 371049168 NOOWAMRTXLPDLS-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CNC(=O)C[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 571225033 QZFHWIHDLFXEFS-LURJTMIESA-N 281.272 -0.174 5 20 CBBD Cc1noc(CN2CCOC[C@@H]2CC(N)=O)c1[N+](=O)[O-] 595524104 XREMQHFDHRHLOE-QMMMGPOBSA-N 284.272 -0.033 5 20 CBBD CN(CCOCCN)C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 599612888 NBACXNFIENABAD-UHFFFAOYSA-N 283.288 -0.149 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CCO1 615927471 JCWIYOHGPDUFNK-NSHDSACASA-N 284.272 -0.069 5 20 CBBD NC(=O)C1(C(=O)OCCn2ccc([N+](=O)[O-])n2)CCC1 769092750 KDJZFFZIAGVLFO-UHFFFAOYSA-N 282.256 -0.010 5 20 CBBD Cn1[nH]c(C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)nc1=N 834858171 SRJDDIQPPORERI-RKDXNWHRSA-N 294.315 -0.401 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1COCO1 861967718 HTMPBWBGJNBOLD-SECBINFHSA-N 284.272 -0.021 5 20 CBBD CC(=O)NCC(=O)NCCNc1ccnc(O)c1[N+](=O)[O-] 1093455279 DJZNUUZYBIFAFP-UHFFFAOYSA-N 297.271 -0.640 5 20 CBBD NC(=O)NCC(=O)NCCNc1cccc(F)c1[N+](=O)[O-] 1093501532 ZFEGPGARPGZIIS-UHFFFAOYSA-N 299.262 -0.070 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](CO)[C@H](O)C1 1320788533 OQOGTDNAPDCTDW-NXEZZACHSA-N 298.299 -0.699 5 20 CBBD Cc1nn(C)c(C(=O)NCCNC(=O)C2CC2)c1[N+](=O)[O-] 1337326177 CWBLLGUFFVBBNJ-UHFFFAOYSA-N 295.299 -0.107 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1nnnn1C 1337497062 ZJASUKDPQOTXFV-ZCFIWIBFSA-N 279.260 -0.052 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1c1nnc(C[N+](=O)[O-])n1C 1338059422 KVWZRPYAIPLPIX-QMMMGPOBSA-N 282.304 -0.351 5 20 CBBD C[C@@H](CC(=O)O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1592408767 GZNMCYZRJKRRBN-IVZWLZJFSA-N 285.300 -0.341 5 20 CBBD O=C(O)Cc1nnn(C[C@@H](O)c2cccc([N+](=O)[O-])c2)n1 1602154073 APINGKLQWRIDQC-SECBINFHSA-N 293.239 -0.058 5 20 CBBD CC(C)(O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 87030299 UPQMHLADZNNINZ-UHFFFAOYSA-N 255.230 -0.216 5 20 CBBD CC(CO)(CO)NC(=O)COc1ccc([N+](=O)[O-])cc1 126040404 IXWBTJYZSGSUFG-UHFFFAOYSA-N 284.268 -0.167 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1=O 156624257 XBVCNCLIVWZKFV-UHFFFAOYSA-N 252.234 -0.755 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNS(N)(=O)=O 193984611 PMBNJJIMWDZBBM-UHFFFAOYSA-N 261.259 -0.104 5 20 CBBD Cn1ncc(CNCCn2cc([N+](=O)[O-])cn2)n1 293163439 FUBIIGMUGWDTKJ-UHFFFAOYSA-N 251.250 -0.290 5 20 CBBD Nc1nc(NC[C@@]2(O)CCOC2)ncc1[N+](=O)[O-] 301866359 VJXNFFPLGRMDMU-VIFPVBQESA-N 255.234 -0.470 5 20 CBBD C[C@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CCN1CCO 331120247 AOPWUHCJRVHMNN-JTQLQIEISA-N 283.332 -0.173 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)C1CCOCC1 360741140 VQUNYWRXZNNKNS-JTQLQIEISA-N 298.299 -0.305 5 20 CBBD CO[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361371677 IKCQFSKWNDMRBJ-GHMZBOCLSA-N 270.289 -0.127 5 20 CBBD C[C@@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)CCO1 522275009 RRWMILNEOUXTOS-MRVPVSSYSA-N 282.304 -0.479 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])cn2C)C1 547294431 ORPZCAQVPXIFJZ-GFCCVEGCSA-N 282.300 -0.270 5 20 CBBD CN1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1=O 568497673 QCPKPSDHGGASNV-UHFFFAOYSA-N 278.268 -0.028 5 20 CBBD C[C@@H](CCO)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 593107857 PFUUHQFJONCYSC-GXSJLCMTSA-N 272.305 -0.145 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN([C@H]2CCOC2)CC1 619788862 NKJXNRUODUKOCZ-VIFPVBQESA-N 295.299 -0.135 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)CC(F)F 717732389 IEGWVWVYVOBIPK-ZCFIWIBFSA-N 278.215 -0.076 5 20 CBBD NC(=O)CNC(=S)NCCNc1ccccc1[N+](=O)[O-] 727072030 IBTSMFKSBWARNU-UHFFFAOYSA-N 297.340 -0.044 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1=O 780698368 ZODOFJKKQXKTAG-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD CN1C(=O)CC[C@@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 786191826 SMIQFRUGXMGDND-MRVPVSSYSA-N 282.256 -0.045 5 20 CBBD Cn1nncc1NC(=O)NCCn1cc([N+](=O)[O-])cn1 787792379 ITOVYEAHJXEJIQ-UHFFFAOYSA-N 280.248 -0.259 5 20 CBBD NC(=O)[C@@H]1CCCN1CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 862649378 XXVYKCMCTILMGV-KXUCPTDWSA-N 284.316 -0.892 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@H](CN)C2)c1[N+](=O)[O-] 1118207371 LDOMUIFDRYFIBE-MRVPVSSYSA-N 283.288 -0.564 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC/C=C/CO 1331406425 WMARDNHXWFPSLX-NSCUHMNNSA-N 254.246 -0.236 5 20 CBBD NC(=O)c1cc(N2CCO[C@H](C(=O)O)C2)ccc1[N+](=O)[O-] 1594648735 JKDUTEIOPWLARC-JTQLQIEISA-N 295.251 -0.017 5 20 CBBD O=C(O)C1CCN(CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1601826021 DECLUUPZCPUBPF-GHMZBOCLSA-N 299.327 -0.046 5 20 CBBD O=C(O)[C@@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 1608577041 XZWZAHQGLAAKJF-SNVBAGLBSA-N 270.245 -0.375 5 20 CBBD O=C(O)C[C@@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 1610765088 XEGFJWYCFOWIRZ-SECBINFHSA-N 284.272 -0.033 5 20 CBBD CN1CCN(CCNc2c([N+](=O)[O-])ncn2C)CC1 37497045 BQMMMJVWCHHYDE-UHFFFAOYSA-N 268.321 -0.012 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 132920140 PZUOSPHRBPVMGK-VIFPVBQESA-N 281.272 -0.086 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1CCn1ccc([N+](=O)[O-])n1 176259537 JCWMPNVQVNAAAS-SECBINFHSA-N 288.329 -0.090 5 20 CBBD C[C@H](N)[C@H]1CN(c2nn(C)cc2[N+](=O)[O-])CCO1 231672439 ZHAFFXKQUDKUSG-IONNQARKSA-N 255.278 -0.119 5 20 CBBD Cc1ccnc(N2CCN[C@H](C(N)=O)C2)c1[N+](=O)[O-] 265157644 CYTKVZBVFXKUHU-QMMMGPOBSA-N 265.273 -0.438 5 20 CBBD CS(=O)(=O)NCCn1cc([N+](=O)[O-])cc(Cl)c1=O 265518677 OKEDTMBSMOTBJJ-UHFFFAOYSA-N 295.704 -0.041 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 265842023 DLVBLXPMAJYFFS-UHFFFAOYSA-N 252.230 -0.163 5 20 CBBD COC(=O)[C@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])OC 489044129 OZZLAZNSHIOXRT-ZETCQYMHSA-N 298.255 -0.311 5 20 CBBD Nc1nccc(C(=O)NCC(F)(F)CO)c1[N+](=O)[O-] 568880371 KEEIWHAHELEYCH-UHFFFAOYSA-N 276.199 -0.071 5 20 CBBD CC(=O)NCCN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 583273519 TUUCSVFLYAIVBW-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)C[C@H]2C)c1[N+](=O)[O-] 610241207 AXIJDCZZDKSEEF-ZCFIWIBFSA-N 281.272 -0.023 5 20 CBBD CCN(CC(=O)N(C)C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 610367556 XTZDWGPYJNRLSP-NSHDSACASA-N 299.331 -0.438 5 20 CBBD Cn1ncc(C(=O)OCCn2cc([N+](=O)[O-])cn2)c1N 754536106 NWPSHGRAJOEMLJ-UHFFFAOYSA-N 280.244 -0.036 5 20 CBBD C[C@@H](NS(=O)(=O)c1cccnc1[N+](=O)[O-])C(=O)O 760118023 QFQHCDNZMOWSKO-RXMQYKEDSA-N 275.242 -0.259 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N1C[C@H](O)[C@H](O)C1 823630293 WDYAAHAEBDLRDW-AOOOYVTPSA-N 292.255 -0.683 5 20 CBBD O=[N+]([O-])c1cnn(CCn2ccnc2-c2nn[nH]n2)c1 826500972 UCAVTTDSBAUOKZ-UHFFFAOYSA-N 275.232 -0.132 5 20 CBBD COCCCNC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672665 KOWAVFWXZNVPQN-IWSPIJDZSA-N 274.273 -0.264 5 20 CBBD Cn1nnc2c1CC[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 847199295 RPMVOSYJAMNEPD-BRDIYROLSA-N 265.273 -0.546 5 20 CBBD CNc1nccc(C(=O)N2CCCNC(=O)C2)c1[N+](=O)[O-] 847427438 UXABIFDIJKRXSU-UHFFFAOYSA-N 293.283 -0.006 5 20 CBBD COC(=O)[C@H]1CC[C@H](C(=O)OC)N(CC[N+](=O)[O-])C1 931176459 LDUFTEUWSGPIFX-DTWKUNHWSA-N 274.273 -0.310 5 20 CBBD CC(C)(C(=O)NCc1nc[nH]n1)n1cc([N+](=O)[O-])cn1 1117778227 OLRDCXLOCWIRRD-UHFFFAOYSA-N 279.260 -0.039 5 20 CBBD COC[C@@H](OC)C(=O)Nc1c([N+](=O)[O-])cnn1C 1328623202 DYTKQKLWVAPGML-SSDOTTSWSA-N 258.234 -0.072 5 20 CBBD CN(C)C[C@@]1(O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1348964917 HQTJCTQGZKKNDD-KKZNHRDASA-N 257.290 -0.823 5 20 CBBD O=[N+]([O-])c1cnn(Cc2cc(-c3nn[nH]n3)ccn2)n1 1607085481 FLJADVAGWMASOR-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD Cc1noc(CN[C@@](C)(CO)C(=O)O)c1[N+](=O)[O-] 1608027892 MSTMBKDIVIBUMA-VIFPVBQESA-N 259.218 -0.184 5 20 CBBD O=C(NC[C@@]1(C(=O)O)CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1608428488 SSJYSTJZAFVVMT-XSSZXYGBSA-N 258.230 -0.741 5 20 CBBD COCCN(C)CCNc1ncc([N+](=O)[O-])c(N)n1 76269997 MNBXFYFHTGGXOG-UHFFFAOYSA-N 270.293 -0.043 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCN1C[C@@H](C)O 120865763 WACHDGSPHCGNIB-DTWKUNHWSA-N 297.315 -0.155 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 274344366 CADBMKQCYYDLJC-UHFFFAOYSA-N 280.240 -0.487 5 20 CBBD O=C(NCCCN1C(=O)CNC1=O)c1cc([N+](=O)[O-])c[nH]1 341878561 XHEFZBVWXNGNBX-UHFFFAOYSA-N 295.255 -0.405 5 20 CBBD COC(=O)[C@H](CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-])OC 347858692 YSQMGHPNWCIKQY-LURJTMIESA-N 286.244 -0.456 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354781050 ZWKAXXOPXOADMC-SNVBAGLBSA-N 286.244 -0.638 5 20 CBBD C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[S@@]1=O 558743453 OFINZPUZAQSAHG-QQOXFEPMSA-N 272.286 -0.089 5 20 CBBD O=C(NC[C@]1(O)CN2CCC1CC2)c1n[nH]cc1[N+](=O)[O-] 560508107 RKQMHXPOPXRJQO-LBPRGKRZSA-N 295.299 -0.496 5 20 CBBD C[C@@H](N)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 592383465 VXTGDZMWJBZMTG-ZCFIWIBFSA-N 260.275 -0.385 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 593811274 BHXXRPXUHATRLH-SYDPRGILSA-N 253.218 -0.688 5 20 CBBD Nc1ccc(N2CC(N3CC[C@@H](O)C3)C2)nc1[N+](=O)[O-] 596296690 YREQIWXLYUZHLQ-SECBINFHSA-N 279.300 -0.173 5 20 CBBD O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCOCCN1 854690909 PQDNWTBRRHDUAJ-NSHDSACASA-N 281.268 -0.008 5 20 CBBD CNC(=O)[C@H]1CN(Cc2cccnc2[N+](=O)[O-])CCO1 886122640 FUDRXEUIPLCEES-SNVBAGLBSA-N 280.284 -0.063 5 20 CBBD Cn1ncnc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020138882 GGEPSVBMMQYKOR-ZYUZMQFOSA-N 294.315 -0.783 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 1116484841 LPXDNZMTJICBRU-SSDOTTSWSA-N 283.288 -0.157 5 20 CBBD O=C(NCCC1(CNCCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1164494813 UEFSUJJCFCPAQQ-GHMZBOCLSA-N 285.344 -0.090 5 20 CBBD COCC[C@H](Nc1c([N+](=O)[O-])ncn1C)C(N)=O 1254166447 VXXLIDRRVZGFMM-LURJTMIESA-N 257.250 -0.369 5 20 CBBD C[S@@](=O)CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1262199759 YPXIRRCBHYNDEA-QGZVFWFLSA-N 260.275 -0.184 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CCOCCO)c1[N+](=O)[O-] 1321384704 TXJLCACRQXBWFG-UHFFFAOYSA-N 286.288 -0.282 5 20 CBBD O=C(O)[C@@H](C(=O)OCCn1cnc([N+](=O)[O-])n1)C1CC1 1594836957 ARCRLSFJMYMMBP-ZETCQYMHSA-N 284.228 -0.160 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](O)CN1 40676268 SEJDAUWGLFXQHQ-VXGBXAGGSA-N 279.296 -0.024 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)CC(=O)N(C)C 157439008 XWGITUIISLDTQQ-UHFFFAOYSA-N 255.278 -0.189 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1CCNC1 179071498 KIFMIIOSUURAKD-VIFPVBQESA-N 267.289 -0.080 5 20 CBBD O=C(O)c1cn(CCn2ccc(=O)c([N+](=O)[O-])c2)nn1 212469487 ITDSDAHYPNLBEJ-UHFFFAOYSA-N 279.212 -0.254 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@H](O)[C@@H](O)C1 236574113 UULKQDYCKXHFOB-UWVGGRQHSA-N 270.216 -0.089 5 20 CBBD COC[C@H](CCO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 278217878 RVAJEIMTJPBBDQ-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD CN(C)S(=O)(=O)NCCNc1ncccc1[N+](=O)[O-] 288859821 FAVJXPUAMDHFHD-UHFFFAOYSA-N 289.317 -0.202 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1=CCNCC1 427604816 SKMPIDUACLHURH-UHFFFAOYSA-N 265.273 -0.173 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](N)C1 428481561 NXWLJTOKSKLYFV-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCNC1 428655963 OAOMKZRVUWBEFO-VIFPVBQESA-N 267.289 -0.032 5 20 CBBD C[C@H]1OC(=O)N[C@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 496506810 HIUXNNAXBBHXQG-HTRCEHHLSA-N 284.228 -0.169 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)CO)c1[N+](=O)[O-] 552967504 UQWAIAWPLWFBTI-ZCFIWIBFSA-N 254.246 0.142 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] 571047633 GFSHBPJAWBSZOA-SECBINFHSA-N 293.327 -0.190 5 20 CBBD O=C(O)[C@@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CCO1 582304015 WRBYFRNYZAWLEG-ZETCQYMHSA-N 293.239 -0.073 5 20 CBBD CC1(C)CNCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 591678506 VUBJSVYVZHFEGN-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD O=[N+]([O-])c1cnn(Cc2nc(N3CCNCC3)no2)c1 823346119 DQIHBWNHPYWXGT-UHFFFAOYSA-N 279.260 -0.368 5 20 CBBD CN(C)c1noc(COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 840672499 AHNDNNLBJGCPKS-PHDIDXHHSA-N 256.218 -0.156 5 20 CBBD C[C@H](COC(=O)Cn1nc2n(c1=O)CCCC2)[N+](=O)[O-] 845574874 DWYFIPLKBCZLTJ-MRVPVSSYSA-N 284.272 -0.411 5 20 CBBD NS(=O)(=O)c1cc(COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])co1 849806623 ISPFDYGWRUBJQY-RNFRBKRXSA-N 290.253 -0.365 5 20 CBBD C[C@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)COC(=O)N1 860995620 PFJLSFYMZQVXCR-JTQLQIEISA-N 284.228 -0.167 5 20 CBBD C[C@@H]1COC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 928892607 INYJYHXBDATSAJ-APPZFPTMSA-N 254.246 -0.058 5 20 CBBD NC(=O)C(=O)NC/C=C/CNc1ncccc1[N+](=O)[O-] 1107480653 PPHWVSZEGYIFPT-OWOJBTEDSA-N 279.256 -0.441 5 20 CBBD NC(=O)COC1CCN(c2ncc([N+](=O)[O-])cn2)CC1 1116578857 GBPYRRLRQHBIIP-UHFFFAOYSA-N 281.272 -0.145 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CCC(N)=O)c1[N+](=O)[O-] 1258149680 PMXPVINMJVTJSM-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1nccn1C 1261911407 CGGZLYYXJHTWHA-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)O 1589144119 AXPZOXYQFBHHEM-NSHDSACASA-N 284.224 -0.134 5 20 CBBD COc1cc([N+](=O)[O-])cn(CC(=O)C(=O)O)c1=O 1594068082 XOIFBEWNGJMIFO-UHFFFAOYSA-N 256.170 -0.581 5 20 CBBD CO[C@@]1(C(=O)O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 1599076964 BYAXBBBVUDWEPY-NSHDSACASA-N 284.272 -0.033 5 20 CBBD CCNC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 48800789 KSZLLPBMPSGQRJ-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD COc1ccc(S(=O)(=O)NC2CNC2)cc1[N+](=O)[O-] 90289247 ZTOWNZIGPZDVAM-UHFFFAOYSA-N 287.297 -0.147 5 20 CBBD O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[C@@H](O)CO 105843969 WSZBDWHWKQGSLV-ZCFIWIBFSA-N 266.209 -0.456 5 20 CBBD Cc1c(CC(=O)NC(CO)CO)cccc1[N+](=O)[O-] 119535622 JAVYJCHCNMYCGX-UHFFFAOYSA-N 268.269 -0.085 5 20 CBBD COCCONC[C@H](O)Cn1cc([N+](=O)[O-])cn1 156083451 BCGRWWGMUUQMQG-VIFPVBQESA-N 260.250 -0.680 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC[C@H]1CCNC1 178944641 MATNGUVWDWINDL-SECBINFHSA-N 267.289 -0.093 5 20 CBBD C[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 237587853 CEARMAGQRJEYEL-ZCFIWIBFSA-N 256.218 -0.229 5 20 CBBD Cn1nnc(Cn2cc([N+](=O)[O-])cc(Cl)c2=O)n1 278570295 NNTHYOOOKAJFBH-UHFFFAOYSA-N 270.636 -0.018 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](N)CC(N)=O 353440967 OIJZSZQYEODUEP-VIFPVBQESA-N 296.283 -0.578 5 20 CBBD CC(C)(CS(C)(=O)=O)NC(=O)c1cc([N+](=O)[O-])n[nH]1 354777617 FQSCRWAESVAHAH-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD CO[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H](CN)C1 359211927 KAUDIHNENVQUEZ-NXEZZACHSA-N 297.315 -0.244 5 20 CBBD COC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 359785465 DGNRVPMMSOUGED-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc([N+](=O)[O-])o1 447629639 LVVRAMBVNUSNKG-UHFFFAOYSA-N 268.185 -0.163 5 20 CBBD COC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 495613601 RMYZNDBDKSSXRR-UHFFFAOYSA-N 283.244 -0.158 5 20 CBBD C[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 567503103 UYGNMEHBAXSBKO-LURJTMIESA-N 271.233 -0.436 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCN2CC[C@H]1C2 597709899 ORSHBCLDZPYFMY-JTQLQIEISA-N 292.295 -0.327 5 20 CBBD COCCN(CCO)c1nccc(C(N)=O)c1[N+](=O)[O-] 1324222146 RPUYALKDPNGWLY-UHFFFAOYSA-N 284.272 -0.466 5 20 CBBD O=[N+]([O-])c1cn(Cc2cn[nH]c2)nc1-c1nn[nH]n1 1593486436 SQZKMXXARASSGJ-UHFFFAOYSA-N 261.205 -0.257 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1601908125 AKEDCXJRHITRJF-MWLCHTKSSA-N 298.251 -0.420 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CC(O)C1 161468573 RCQQLNUGGXTLJK-MRVPVSSYSA-N 293.279 -0.084 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1O 249602983 YWLVQTFFFGLTPC-YUSALJHKSA-N 284.316 -0.145 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 341748995 SWRIEGOIGCYROU-MRVPVSSYSA-N 293.235 -0.083 5 20 CBBD CSc1ccc(C(=O)N[C@H](CO)C(N)=O)cc1[N+](=O)[O-] 352981439 ARXIJZPRMVXHIK-SSDOTTSWSA-N 299.308 -0.107 5 20 CBBD O=C(N[C@@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])n[nH]1 353375629 STZZISMMAHJTCS-NEXAQPNMSA-N 258.259 -0.431 5 20 CBBD Nc1nccc(C(=O)OC[C@@H]2CNC(=O)O2)c1[N+](=O)[O-] 496332684 WJTWTHWIZOCYEV-YFKPBYRVSA-N 282.212 -0.163 5 20 CBBD CN(C[C@H]1COCCO1)c1ncc([N+](=O)[O-])c(N)n1 596459260 LLJCEUVBHRIWBP-ZETCQYMHSA-N 269.261 -0.181 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] 597586620 PEGMKWKOGFICGV-VIFPVBQESA-N 285.231 -0.761 5 20 CBBD O=C1CN(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C(=O)N1 755053318 KHTBTYCZDQGQTG-UHFFFAOYSA-N 280.196 -0.503 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN(C2COC2)CC1 893074350 NLAPKIKBPVHVGF-UHFFFAOYSA-N 267.289 -0.151 5 20 CBBD CC(C)(C)C(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042976446 BBESXNXGPKBZJD-RKDXNWHRSA-N 299.327 -0.613 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@]2(O)CCN(C)C2)c1[N+](=O)[O-] 1321134967 CBFPSCRNUWPDSQ-LBPRGKRZSA-N 297.315 -0.567 5 20 CBBD O=C(NCCO)C1CCN(c2ncc([N+](=O)[O-])cn2)CC1 1351766839 BCBMHXYEDSZDAU-UHFFFAOYSA-N 295.299 -0.290 5 20 CBBD CS(=O)(=O)CCN1CCC(NCC[N+](=O)[O-])CC1 1356100611 QBZGATDWVBNYLI-UHFFFAOYSA-N 279.362 -0.638 5 20 CBBD O=C(O)[C@@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1574620510 BTBPLUJEXUYKTR-OPRDCNLKSA-N 279.252 -0.141 5 20 CBBD NC(=O)c1cc(N2CC[C@@](O)(C(=O)O)C2)ccc1[N+](=O)[O-] 1601161818 NHYSEFIGIPJNSB-LBPRGKRZSA-N 295.251 -0.281 5 20 CBBD O=C(O)CSCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1602099961 RCAQYKPJZSKJDF-UHFFFAOYSA-N 274.258 -0.135 5 20 CBBD Cc1nn(CC(=O)NCCC(=O)O)c(C)c1[N+](=O)[O-] 37433923 MCZAXGMMRVNWSW-UHFFFAOYSA-N 270.245 -0.001 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1COCCO1 55845198 JGSYAPYWMGXRIO-VIFPVBQESA-N 270.245 -0.677 5 20 CBBD NC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 165572426 AVQYECUFCFQCGH-SSDOTTSWSA-N 254.246 -0.277 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@@H](O)C[C@H]1CO 185918491 MNNGAMLPEFDMCR-UWVGGRQHSA-N 295.295 -0.039 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 265661034 AZIDOAUHIFWGQQ-ZETCQYMHSA-N 281.272 -0.071 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)Cn1ccc([N+](=O)[O-])n1 281330847 XDLNGMGMCLSGDQ-ZETCQYMHSA-N 270.245 -0.189 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CCNC1=O 340483067 DDFSBLBXZMNGMJ-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)CC[C@H]2C1 408046510 LMRNIGTYSXFLJA-ZETCQYMHSA-N 279.256 -0.235 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1CCS(=O)CC1 408106609 LOWDXVSAZZYKPB-UHFFFAOYSA-N 285.281 -0.100 5 20 CBBD COC(=O)NCCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 496407153 RYMKIYIJYLTCDJ-UHFFFAOYSA-N 283.244 -0.111 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O 555553651 SFOBDTDBDLCUIW-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1C[C@@H]2CNC[C@@H]2C1 579832663 NMJSUWCNKFUHGB-DTORHVGOSA-N 298.324 -0.170 5 20 CBBD CS(=O)(=O)NC1CN(c2ncc([N+](=O)[O-])cn2)C1 599147003 IZXINUYWBNQAGI-UHFFFAOYSA-N 273.274 -0.877 5 20 CBBD CC(CO)(CO)C(=O)OCCn1ccc([N+](=O)[O-])n1 767099041 QVBHPDWTMHHDTQ-UHFFFAOYSA-N 273.245 -0.675 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1nnn(C)n1 799479267 ZDIPWZUPGVTZLY-UHFFFAOYSA-N 295.259 -0.243 5 20 CBBD COCC(=O)N1CCC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 948649859 LPQNLGQTIBVJMX-GHMZBOCLSA-N 299.327 -0.347 5 20 CBBD CC(=O)NCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1 1101476943 VKKMRBLUEPTRBA-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD O=C(CNCC[N+](=O)[O-])NCCN1CCCCCC1 1120503610 VAGLJQDOTNBRES-UHFFFAOYSA-N 272.349 -0.155 5 20 CBBD COc1ccc(=O)n(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1322471030 KREVIPVTSFQFLW-VIFPVBQESA-N 295.255 -0.582 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1cc([N+](=O)[O-])cn1C 1323348856 ILGWTYJJZYCUEA-UHFFFAOYSA-N 298.299 -0.232 5 20 CBBD CCN(CCO)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1348510388 HNRNNMGSADZUPM-UHFFFAOYSA-N 271.277 -0.638 5 20 CBBD COC(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)OC 1591334048 MJKUFFKUDZUTNS-UHFFFAOYSA-N 269.221 -0.410 5 20 CBBD C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1599864351 XXMKBTDJRDGBIC-VDTYLAMSSA-N 284.228 -0.368 5 20 CBBD Cc1nn(CC(=O)NCCC(=O)O)cc1[N+](=O)[O-] 1600780531 JDNYNHAKTYSYAI-UHFFFAOYSA-N 256.218 -0.309 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc(O)c([N+](=O)[O-])c1 1601564736 UKBJZRNCXLRWCK-LURJTMIESA-N 270.197 -0.524 5 20 CBBD CCNC(=O)CNCCN(CC)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1754045184 HOEZQYPBIWVWIE-NXEZZACHSA-N 286.332 -0.774 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)O 20215153 VXZWLCOGFBLOTO-LURJTMIESA-N 257.202 -0.891 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)Cn1ccc([N+](=O)[O-])n1 53231086 XACVTXWOUCMCKU-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD COC(=O)C(C)(C)NC(=O)Cn1ccc([N+](=O)[O-])n1 55278996 JHXCDNAJQXDQHK-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@]1(C(=O)O)CCOC1 85850431 KKFKRBBPCAFNPJ-SNVBAGLBSA-N 284.228 -0.849 5 20 CBBD NC(=O)C[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 174726834 VELUYRCSFVWGLY-VIFPVBQESA-N 295.299 -0.095 5 20 CBBD COC[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 179437811 PYOBEBSRSHDOFK-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD C[C@H]1CCNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 186761226 WRQPJKCGNZPVNQ-GXSJLCMTSA-N 294.311 -0.129 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1csc([N+](=O)[O-])c1 188917047 DNZAUWBSCDZZLY-UHFFFAOYSA-N 293.326 -0.065 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](O)[C@@H](O)C1 234795723 ZVGLNEPFBIUXMT-UWVGGRQHSA-N 282.252 -0.219 5 20 CBBD CCn1cc(S(=O)(=O)NCCO)c([N+](=O)[O-])n1 339039544 KXLXJBNUBRISRM-UHFFFAOYSA-N 264.263 -0.918 5 20 CBBD NC(=O)NC(=O)CCn1cc([N+](=O)[O-])ccc1=O 347965413 FZAXFDIOSSZYIG-UHFFFAOYSA-N 254.202 -0.659 5 20 CBBD Nc1ccnc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 354460261 RSPLYWQSECEXKH-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCN[C@H](C(N)=O)C1 360879342 FJDJMVXLMVKXLJ-QMMMGPOBSA-N 282.304 -0.617 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@@H](O)C[C@@H]1CO 368428165 CTLXASLJEYESDH-MNOVXSKESA-N 296.279 -0.072 5 20 CBBD CCOC1CC(O)(CNC(=O)c2cc([N+](=O)[O-])nn2C)C1 444612778 JANRUBLPQYOZMK-UHFFFAOYSA-N 298.299 -0.012 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 447741548 NFXJRXRZJRAWRP-HQJQHLMTSA-N 284.272 -0.402 5 20 CBBD CC(C)NC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 537771514 LGTPCMYNQAEJEV-UHFFFAOYSA-N 281.272 -0.174 5 20 CBBD O=C(C[C@@H]1COCCN1)NCCn1cc([N+](=O)[O-])cn1 573083439 NDSWMZMCWJJHOA-SECBINFHSA-N 283.288 -0.714 5 20 CBBD C[C@@H](C[C@@H](C)N)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 573923409 QTGILBJZQRWBFZ-BDAKNGLRSA-N 282.300 -0.002 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592307353 FYVNEPKQNNZGFK-XPUUQOCRSA-N 269.261 -0.494 5 20 CBBD CNc1nccc(C(=O)N[C@@H](CO)CCF)c1[N+](=O)[O-] 594373362 RQCPRMZFZYSTGM-SSDOTTSWSA-N 286.263 0.482 5 20 CBBD Cc1c(NC(=O)C(=O)NOCC(N)=O)cccc1[N+](=O)[O-] 785389378 RGZHBKCZCCTJBM-UHFFFAOYSA-N 296.239 -0.625 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])cn(CC2(O)CCOCC2)c1=O 833306727 FZYSSXZQXZQIMJ-UHFFFAOYSA-N 298.251 -0.004 5 20 CBBD CCN1CC[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 849699130 BEWQYRCPGMTTDO-QMMMGPOBSA-N 282.256 -0.045 5 20 CBBD Cc1nn(C)c(C(=O)NN2CCOC2=O)c1[N+](=O)[O-] 862699205 MNVFFWSSGTXWFO-UHFFFAOYSA-N 269.217 -0.266 5 20 CBBD COC[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)OC 1321286114 CMDISDWVAHKCIJ-LURJTMIESA-N 272.217 -0.764 5 20 CBBD NC(=O)CC1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 1321530157 PDLMLYKBYSUYNA-UHFFFAOYSA-N 252.230 -0.130 5 20 CBBD CCOCC[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1322880311 OTGQLTIJRMLWHH-ZETCQYMHSA-N 272.261 -0.322 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CN(C)CCO1 1341460153 LRGNAWMWZPVVMB-SCZZXKLOSA-N 297.315 -0.223 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1-c1nn[nH]n1 1606443677 HMUQXCHRXGESAT-UHFFFAOYSA-N 270.230 -0.578 5 20 CBBD CCOC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 49277660 XXKLVYBWNXVZMV-UHFFFAOYSA-N 271.233 -0.744 5 20 CBBD O=C(NCC1(O)CCOCC1)c1cc([N+](=O)[O-])c[nH]c1=O 93653317 HQWSNAHYMJNLMA-UHFFFAOYSA-N 297.267 -0.446 5 20 CBBD CN1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 152466187 JGKIPDVBAIJWSK-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD C[C@](O)(CO)CNc1ncc(C(=O)O)cc1[N+](=O)[O-] 235721876 PYOOGPMEUVRNIC-SNVBAGLBSA-N 271.229 -0.157 5 20 CBBD N[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 261961872 RYYRDEZZLINUIA-MRVPVSSYSA-N 253.262 -0.355 5 20 CBBD O=C1C[C@H](N(C(=O)c2ccc([N+](=O)[O-])[nH]2)C2CC2)C(=O)N1 263837163 QVFJISUZPMYVSY-QMMMGPOBSA-N 292.251 -0.057 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC[C@H](C(N)=O)C1 301113065 WIXZUXDWASLANF-ZETCQYMHSA-N 293.283 -0.210 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@]1(O)CCOC1 332316714 MOMXRBONEYAXLE-LLVKDONJSA-N 284.272 -0.551 5 20 CBBD O=C1C[C@@H](N(C(=O)c2cc([N+](=O)[O-])c[nH]2)C2CC2)C(=O)N1 339224698 CUMVDLWEXGFFAP-SECBINFHSA-N 292.251 -0.057 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC(C)(C)CC(N)=O 360677462 ZBEDPRMDMLVVTI-UHFFFAOYSA-N 269.261 -0.288 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@H](O)C[C@H]1CO 368411201 NLCRDCSDGQETKQ-DTWKUNHWSA-N 282.252 -0.132 5 20 CBBD C[C@H]1C[C@@H](O)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 429117927 RFWFOFWRSKSFFB-ZMLRMANQSA-N 284.316 -0.003 5 20 CBBD CO[C@@H]1C[C@H](C(=O)O)N(CCn2ccc([N+](=O)[O-])n2)C1 568067128 MXEDICLMCNDOBQ-RKDXNWHRSA-N 284.272 -0.035 5 20 CBBD O=C(O)c1ccnc(N2CC[C@@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 569728660 UCIPTXWVNPEVJV-IONNQARKSA-N 297.267 -0.133 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC(N2CC[C@@H](O)C2)C1 593248928 HIECOVQWTKFPQE-SNVBAGLBSA-N 280.284 -0.186 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(n2ccnn2)C1 779552761 GALULIKIHKXSHV-UHFFFAOYSA-N 277.244 -0.534 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@H]2C[C@]2(CO)C1 783790025 VXUBNKDUDVTHRD-LDYMZIIASA-N 266.257 -0.368 5 20 CBBD COCCCN(C)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839689494 CIMWYVHFTLECQC-NXEZZACHSA-N 259.306 -0.264 5 20 CBBD O=C(NCC1(N2CCOCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 839739644 KFOLGRZIXXXMBW-NXEZZACHSA-N 269.301 -0.367 5 20 CBBD CN1CCC[C@H]1C(=O)N1CCN(CC[N+](=O)[O-])CC1 929847613 XXJQFZNLHBMORU-NSHDSACASA-N 270.333 -0.499 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1nnc(CCC[N+](=O)[O-])n1C 1121380926 GNNODQKPYDPYIZ-SECBINFHSA-N 296.331 -0.309 5 20 CBBD O=C(NCCNCc1csnn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932443 XZVHTUORUWVMLF-HTQZYQBOSA-N 271.302 -0.591 5 20 CBBD O=C(NCC1[C@@H]2CNC[C@@H]12)c1cc([N+](=O)[O-])cnc1O 1580641885 LQNMOTYFIZXNJP-RKDXNWHRSA-N 278.268 -0.109 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NC2(C(=O)O)CCOCC2)n1 1605501656 VSYLEOOABLPMRR-UHFFFAOYSA-N 298.255 -0.308 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)NCCOCCO 52925271 NLVIJLUJJPILBX-UHFFFAOYSA-N 290.297 -0.118 5 20 CBBD CN(C)CCCNC(=O)Cn1cccc([N+](=O)[O-])c1=O 124565117 YRKGMHDWMZQOKN-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD CCCN(CC(=O)NC)C(=O)Cn1cc([N+](=O)[O-])cn1 193656705 FBCKKMFKJJCFKZ-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD COC(=O)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 214124826 CDJFODRACXUUGF-RXMQYKEDSA-N 286.196 -0.066 5 20 CBBD COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])cnc1O 230277325 NJGWFCSVABOMOU-ZETCQYMHSA-N 285.256 -0.177 5 20 CBBD COC[C@](C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 262273772 SUSXRFMHMWGXMK-JTQLQIEISA-N 286.244 -0.603 5 20 CBBD CN1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1=O 265873050 JUOZVWJNVGMGTK-UHFFFAOYSA-N 294.267 -0.943 5 20 CBBD COc1cc(S(=O)(=O)NCCO)ccc1[N+](=O)[O-] 269739041 UEEVZBJMQJJUJJ-UHFFFAOYSA-N 276.270 -0.126 5 20 CBBD COC(=O)[C@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 271246247 QLRJSQIABMJZSU-NSHDSACASA-N 284.272 -0.287 5 20 CBBD CNC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 354027189 FLKRTRBZQQYOBU-UHFFFAOYSA-N 296.283 -0.601 5 20 CBBD CC[C@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 354308608 QWNFMZKLBHYWDD-JTQLQIEISA-N 285.260 -0.356 5 20 CBBD CCC[C@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 412516366 FVMMEQPNFNTVPK-UWVGGRQHSA-N 298.299 -0.176 5 20 CBBD C[C@H]1CN(CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 552066168 LVPPNXJMRYZAAS-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD CN1C[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(=O)N1 593582159 ZFVWGFZBEVKBQT-VIFPVBQESA-N 296.258 -0.262 5 20 CBBD C[C@H](O)CN(CCO)c1ccc([N+](=O)[O-])c(C(N)=O)c1 596236711 LPPPZGBDBASTQL-QMMMGPOBSA-N 283.284 -0.127 5 20 CBBD CON(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 817770099 BFVLTBCOOZNLKD-UHFFFAOYSA-N 284.228 -0.555 5 20 CBBD CCOCCS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842305143 SKFHPMHHIJNPTO-RNFRBKRXSA-N 266.275 -0.866 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)N(C)C 1118011703 VPJYFNTVXWITKD-RXMQYKEDSA-N 255.234 -0.476 5 20 CBBD Cc1n[nH]c(C)c1CCNC(=O)Cn1cnc([N+](=O)[O-])n1 1328723883 JGPFINLQBHOINF-UHFFFAOYSA-N 293.287 -0.115 5 20 CBBD C[C@]1(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC(=O)N1 1345619314 RESADNWSJQIVBO-CMPLNLGQSA-N 297.315 -0.590 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](C)c2nnnn2C)c1[N+](=O)[O-] 1514766897 HULKCVACPAFNIS-ZCFIWIBFSA-N 294.275 -0.349 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@](O)(C(=O)O)C2)n1 1597899684 PHLJHYLKUXSGKD-LLVKDONJSA-N 298.255 -0.527 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1ccc([N+](=O)[O-])cc1O 1601523737 OGUBIEKQHFUQJX-QMMMGPOBSA-N 270.197 -0.524 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 26011883 AIALRXWMDUYGCZ-ZCFIWIBFSA-N 282.256 -0.463 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F 55240415 AQHPHYWORPFDSD-UHFFFAOYSA-N 291.260 -0.160 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)N1CCCC1 62885040 OTNMVKKWJUKOKZ-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CC(=O)NCCCOC(=O)Cn1cc([N+](=O)[O-])cn1 143620632 YWUHFHGLHWXPPV-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD NC(=O)NC(=O)CCNc1ncccc1[N+](=O)[O-] 301625556 PWTJPFVMOLOTOH-UHFFFAOYSA-N 253.218 -0.013 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@@H](O)C2)c1 330403384 BYJJXERTCMSEHA-ZJUUUORDSA-N 256.262 -0.781 5 20 CBBD COCCN(CCO)C(=O)c1c([N+](=O)[O-])c(C)nn1C 342232171 WAUOIFWPTHNEIO-UHFFFAOYSA-N 286.288 -0.282 5 20 CBBD COC(=O)CCNC(=O)Cn1ccc(C)c([N+](=O)[O-])c1=O 349221147 ZFEVCUKOBBCSAV-UHFFFAOYSA-N 297.267 -0.256 5 20 CBBD COC[C@H](C(N)=O)N(C)C(=O)c1c(N)cccc1[N+](=O)[O-] 354622420 NUNAVVQQDISNAZ-SECBINFHSA-N 296.283 -0.251 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@H](C)O 442924869 ZHKKIBCOKZIVJO-RCOVLWMOSA-N 285.256 -0.415 5 20 CBBD COC(=O)NCCOC(=O)Cn1cc([N+](=O)[O-])cn1 491407943 XGTCHPICSOKFQG-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD CNc1nccc(C(=O)N2CCOCC2)c1[N+](=O)[O-] 552829470 KJCFFJQAUHQOTN-UHFFFAOYSA-N 266.257 0.504 5 20 CBBD COc1cc(C(=O)OCC(=O)NC(N)=O)ccc1[N+](=O)[O-] 725945209 HHLKDTJUSBGMTQ-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD Cc1[nH]nc(C(=O)NC2CN(C(=O)O)C2)c1[N+](=O)[O-] 740034540 WNSODZHJISOIER-UHFFFAOYSA-N 269.217 -0.282 5 20 CBBD CCN(C)C(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 746569029 HGKFEHXZYMVYRC-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD COC[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 755641196 MKZNLTDPNSQPRQ-SSDOTTSWSA-N 283.240 -0.470 5 20 CBBD CCONC(=O)CNc1ncc([N+](=O)[O-])c(N)n1 845715510 MUYKGRKKJGEDHF-UHFFFAOYSA-N 256.222 -0.553 5 20 CBBD Cc1cnoc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 998967808 MBEVHMLZACSQMO-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD C[C@]1(CN)CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1118085522 HFFZRJWLZQLIKJ-SNVBAGLBSA-N 268.277 -0.616 5 20 CBBD COC[C@H](O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319638324 XBTVQLSODBIYKY-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD C[C@@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1=O 1324145945 PNUMVBJSNGFDEB-SECBINFHSA-N 254.202 -0.247 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 1324443771 IIFCPRORUONTEQ-LURJTMIESA-N 267.245 -0.745 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@@H](O)[C@H](CO)C1 1331704528 XORPYKNMBPWODE-VHSXEESVSA-N 253.258 -0.225 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCNC1(CO)CCOCC1 1336109462 RZMSEFREMSAQCE-UHFFFAOYSA-N 297.311 -0.112 5 20 CBBD O=C1N[C@@H]2CN(CC[N+](=O)[O-])CC[C@H]2N1C1CCNCC1 1580855354 SVURZNYOZNDMEY-VXGBXAGGSA-N 297.359 -0.517 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)c1c[nH]nc1[N+](=O)[O-] 1593699343 AIOIPOBAARELJX-UHFFFAOYSA-N 285.260 -0.594 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])c1 26123595 XYFSACWCTPCQFS-MRVPVSSYSA-N 281.272 -0.342 5 20 CBBD CN(CC(=O)N1CCOCC1)Cn1nccc1[N+](=O)[O-] 111163502 LLKBSRWFRJHSBV-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD NC(=O)[C@@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCN1 148180264 DEFJPFQHQSZIFC-LURJTMIESA-N 296.312 -0.433 5 20 CBBD C[C@H](O)C(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 153023249 VQAICWAEPNWBHR-JTQLQIEISA-N 297.315 -0.684 5 20 CBBD O=C(CNC(=O)Cc1cccc([N+](=O)[O-])c1)NCCO 268709659 ZNXNNNQLMUHJMF-UHFFFAOYSA-N 281.268 -0.638 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@H]1OC 277163865 HDCUMNRUNBTKQY-AOOOYVTPSA-N 296.283 -0.061 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCNC1 311901287 PXORZQIWOVOGCS-QMMMGPOBSA-N 268.277 -0.698 5 20 CBBD CO[C@H]1C[C@H](CO)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 314565457 MGDZUEMCSYYMLU-BDAKNGLRSA-N 296.283 -0.206 5 20 CBBD NC(=O)CCNC(=O)c1c(N)cccc1[N+](=O)[O-] 354405546 OCHZMJDUMHCPSV-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD NC(=O)N[C@@H]1CCN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 359018175 LJSHLVUJKUXBDO-SSDOTTSWSA-N 294.271 -0.314 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 436980309 PDHWQZKVNBABCH-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 547752190 KESDWVJIMLFKHU-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD C[C@H](CN)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 565598417 YKVFYAYXTIHJCZ-SSDOTTSWSA-N 274.302 -0.137 5 20 CBBD Nc1nc(SCCN2CCNC2=O)ncc1[N+](=O)[O-] 572542513 DGNSWTBGWJUGFM-UHFFFAOYSA-N 284.301 0.084 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 592477266 UMGZFCBSQWJBSI-BDAKNGLRSA-N 283.288 -0.634 5 20 CBBD COC(=O)[C@H]1C[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 596066260 AREXGPKOWWZXOO-QXEWZRGKSA-N 298.299 -0.307 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1 600243367 ZFISAPFHPVHQDJ-APPZFPTMSA-N 295.251 -0.639 5 20 CBBD CC[C@@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600650751 BAYPNTJNEAXTLX-RXMQYKEDSA-N 292.273 -0.530 5 20 CBBD CO[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 615925275 HPTHVYNUKRMDOE-SNVBAGLBSA-N 270.245 -0.377 5 20 CBBD CC(=O)N1CC(C(=O)OCCn2cnc([N+](=O)[O-])n2)C1 788368509 AELXOAITMXUCOI-UHFFFAOYSA-N 283.244 -0.792 5 20 CBBD CN1CC[C@@H](OC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 848786322 GAZLOTNVWVHNFP-SSDOTTSWSA-N 280.240 -0.041 5 20 CBBD O=C1[C@@H]2[C@@H](C(=O)N1CCNCC[N+](=O)[O-])[C@H]1C=C[C@H]2C1 905158076 DEKFYVUMYVKFRN-NAKRPEOUSA-N 279.296 -0.340 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1ncc[nH]1 1126800655 JRTUTIHTUKCSMK-UHFFFAOYSA-N 293.287 -0.429 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1254237302 DVNVUALORXHUNO-JTQLQIEISA-N 272.261 -0.545 5 20 CBBD O=C(NCC1(O)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1321792553 KUJSBCUCAFFYJK-UHFFFAOYSA-N 270.245 -0.411 5 20 CBBD C[C@H](c1nnc(N2CCN3CCOC[C@@H]3C2)n1C)[N+](=O)[O-] 1338207306 AHTXJCXBPIZFFV-ZJUUUORDSA-N 296.331 -0.326 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@](C)(O)C(=O)O 1594460663 KNXVSYDYLGHLJF-JTQLQIEISA-N 286.244 -0.948 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 194174376 ZJUCPOSCHZXYHU-GMSGAONNSA-N 281.272 -0.568 5 20 CBBD CC(C)N1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 272613193 RQBHWXMIPJVBPE-UHFFFAOYSA-N 295.299 -0.130 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](O)[C@H](O)C1 278664965 HXIGQKHKHUHNFQ-VXGBXAGGSA-N 295.295 -0.121 5 20 CBBD C[C@@H](CN(C)C)NC(=O)Cn1cc([N+](=O)[O-])cn1 287221193 OOVSDSIKGMWPPK-QMMMGPOBSA-N 255.278 -0.142 5 20 CBBD C[C@H](NS(=O)(=O)c1cncc([N+](=O)[O-])c1)C(=O)O 310952016 ZGKIBSFSTFMTPR-YFKPBYRVSA-N 275.242 -0.259 5 20 CBBD NC(=O)[C@H](O)CNc1ncnc2sc([N+](=O)[O-])cc12 336811828 OQAVAGQNXFSDMK-RXMQYKEDSA-N 283.269 -0.142 5 20 CBBD O=C(CNC(=O)Cc1ccccc1[N+](=O)[O-])NCCO 343105306 GLBJCVATZQQECN-UHFFFAOYSA-N 281.268 -0.638 5 20 CBBD COC[C@@H](O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 346016226 AHCACYVAQZBVCP-JTQLQIEISA-N 286.288 -0.305 5 20 CBBD CN(C)C(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 355749288 WFDGAAPINXJRRQ-UHFFFAOYSA-N 283.292 -0.326 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN1C(=O)CCC1=O 359507025 WTZCJIPVGATDFE-UHFFFAOYSA-N 295.255 -0.793 5 20 CBBD CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 538623295 KFOMVAMIYSXSKS-UHFFFAOYSA-N 267.245 -0.758 5 20 CBBD O=C(O)Cc1ccc(NC[C@H](O)CO)c([N+](=O)[O-])c1 574640894 OGVLIHFCWMDTBM-QMMMGPOBSA-N 270.241 -0.013 5 20 CBBD Nc1nccc(C(=O)NC[C@@H]2CCCC(=O)N2)c1[N+](=O)[O-] 594348429 RRLCEVQHHCMWHR-ZETCQYMHSA-N 293.283 -0.030 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cn1C 600466998 BUMOKMIFGJOQQS-QMMMGPOBSA-N 285.256 -0.413 5 20 CBBD CNC(=O)[C@H](O)CNc1c([N+](=O)[O-])c(C)nn1C 757700838 DLKBXCYANSZMIC-ZCFIWIBFSA-N 257.250 -0.844 5 20 CBBD O=C1C[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CN1 780838090 XXCLDLPPXQZWMS-YFKPBYRVSA-N 291.310 -0.177 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1cnn(C)n1 802976973 IJYNXROWMJRHRA-UHFFFAOYSA-N 280.244 -0.028 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc2ncc([N+](=O)[O-])n2n1 808047820 APROUIMPZLFNRW-LURJTMIESA-N 280.244 -0.844 5 20 CBBD Cn1cc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 990201362 GEFUBFAUUPKHNT-NXEZZACHSA-N 293.283 -0.974 5 20 CBBD Cc1c[nH]cc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991701849 JLQUSIVTQLYEMS-MWLCHTKSSA-N 292.295 -0.071 5 20 CBBD COCCCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1112835787 PDYYQFOAXLPEDB-GHMZBOCLSA-N 271.317 -0.168 5 20 CBBD CC(=O)NCCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1116410329 YVYIZGFEQQYLFU-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD CN(Cc1ccn(C)n1)c1nnc(C[N+](=O)[O-])n1C 1262864283 CJMFYMLSBCPDPB-UHFFFAOYSA-N 265.277 -0.038 5 20 CBBD Cc1[nH]nc(C(=O)NCc2nnc(S)n2C)c1[N+](=O)[O-] 1318362499 JOOSLQMQFOHCRY-UHFFFAOYSA-N 297.300 -0.026 5 20 CBBD NCC1(O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1326179474 FVOXSHCGIZVHMO-UHFFFAOYSA-N 269.261 -0.756 5 20 CBBD O=C(CCNCC[N+](=O)[O-])NCc1ccccn1 1357127872 XCKTUXSUVVFLEP-UHFFFAOYSA-N 252.274 -0.046 5 20 CBBD C[C@@H](O)[C@@H](O)CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1589997624 SYHVZGFAJOUBFT-LDWIPMOCSA-N 294.271 -0.072 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1601770886 ZXYIKEVCHCWFNA-WDSKDSINSA-N 284.228 -0.775 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 62119240 SYUIPRXCPPWWED-SSDOTTSWSA-N 268.229 -0.276 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 153451983 VTYKAMIYNDTRGW-LBPRGKRZSA-N 299.331 -0.390 5 20 CBBD COCCCN(C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 172669033 JGOCVXUDHLVTHW-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)COc1cccc([N+](=O)[O-])c1 217699931 YWKZHCFBQPLTKE-JTQLQIEISA-N 298.251 -0.376 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N(CCO)CC(F)F 231335855 ADQVLBDWGFRXQV-UHFFFAOYSA-N 278.215 -0.123 5 20 CBBD COCC(=O)Cn1cc([N+](=O)[O-])cc(C(=O)OC)c1=O 279864762 FZBAFDQOALJEBD-UHFFFAOYSA-N 284.224 -0.241 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)NCCF 286016753 RNQWJPCAUUWSQB-RXMQYKEDSA-N 273.224 -0.478 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 298713191 OCCDPVVFGYXMLZ-MRVPVSSYSA-N 281.272 -0.342 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN=C1O 330662616 UJOYDLFOUZPYPF-UHFFFAOYSA-N 253.218 -0.144 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCN=C1O 330779206 MJEGXYVCQYQCNA-UHFFFAOYSA-N 266.213 -0.487 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCn1ncnn1 359038809 LZIHKFRNCWLCDT-UHFFFAOYSA-N 278.232 -0.780 5 20 CBBD CNC(=O)Cn1cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 507152632 XFHJAGITJVDSBA-UHFFFAOYSA-N 293.243 -0.487 5 20 CBBD C[C@H](C(=O)N[C@@H](CO)C(N)=O)c1cccc([N+](=O)[O-])c1 552964977 FIENWMFCOYZAIS-XVKPBYJWSA-N 281.268 -0.339 5 20 CBBD CC[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 592953644 XNOXJIMQJJHWCR-MRVPVSSYSA-N 297.267 -0.017 5 20 CBBD CN(Cc1nnc(O)o1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 595547009 KZVCOMYKXPMOFB-QMMMGPOBSA-N 298.259 -0.627 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 598520162 GWZLUKHWNGPYEK-ZKCHVHJHSA-N 282.256 -0.141 5 20 CBBD Nc1c(C(=O)NCCN2CC[C@H](O)C2)cccc1[N+](=O)[O-] 600807396 BTZZFLKRGYHYIH-VIFPVBQESA-N 294.311 -0.027 5 20 CBBD Cc1c(C(=O)NC(CO)CO)cc([N+](=O)[O-])cc1[N+](=O)[O-] 755686171 GDZOFAJQASYQLG-UHFFFAOYSA-N 299.239 -0.106 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1cc([N+](=O)[O-])n[nH]1 795849762 ADBUUNHFRSODGK-DTWKUNHWSA-N 295.299 -0.089 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 798129799 YADZSFIAACZIJF-ZCFIWIBFSA-N 273.270 -0.507 5 20 CBBD COC[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 886875964 YOFNPPFCPCPXIZ-VIFPVBQESA-N 284.272 -0.335 5 20 CBBD NC(=O)C1(NCCn2ccc([N+](=O)[O-])n2)CCOCC1 1118563529 NERAORZWULGYBQ-UHFFFAOYSA-N 283.288 -0.585 5 20 CBBD Cc1nn(C)c(C(=O)N2CCC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 1318011216 OBFBCCLAWDXJFD-MRVPVSSYSA-N 295.299 -0.026 5 20 CBBD CCS(=O)(=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1319139847 PVRGPARXWYCLAS-MRVPVSSYSA-N 263.275 -0.413 5 20 CBBD CN(CC(=O)Nc1c([N+](=O)[O-])cnn1C)S(C)(=O)=O 1320368314 STQJDCGMBBLCEP-UHFFFAOYSA-N 291.289 -0.842 5 20 CBBD Cc1nn(C)c(C(=O)NCCn2ncnn2)c1[N+](=O)[O-] 1341871167 VSSGXHVMQYIQHE-UHFFFAOYSA-N 280.248 -0.947 5 20 CBBD Cc1cc(NC(CO)CO)cc(-c2nn[nH]n2)c1[N+](=O)[O-] 1592035713 PBVDBLGRXIDBEK-UHFFFAOYSA-N 294.271 -0.152 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](C(=O)O)C1 1598611914 VNPGHWWTTIZWKD-SSDOTTSWSA-N 297.271 -0.594 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)N[C@](C)(CO)C(=O)O)n1 1600304145 HJUFXIZERYTRLL-LLVKDONJSA-N 283.240 -0.136 5 20 CBBD O=C(O)C1=NO[C@@H](Cn2cccc([N+](=O)[O-])c2=O)C1 1601738999 BJDFCJWTAIUNKM-ZCFIWIBFSA-N 267.197 -0.014 5 20 CBBD Nc1c(C(=O)N[C@H]2CCC(=O)NC2=O)cccc1[N+](=O)[O-] 157565059 AVYRYQGQCPNVCX-ZETCQYMHSA-N 292.251 -0.288 5 20 CBBD CNS(=O)(=O)CCNc1c([N+](=O)[O-])c(C)nn1C 221049228 REEGKHFYHWUFMJ-UHFFFAOYSA-N 277.306 -0.402 5 20 CBBD COC[C@H](O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 231619974 UKSWXIFPUIADJZ-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H]1OC 277166265 HGJSNVXEYPXRBC-OCAPTIKFSA-N 269.261 -0.183 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(F)F 360755355 PGOITOKUXQMNCP-YFKPBYRVSA-N 264.188 -0.316 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1[C@H]2CNC[C@H]12 495112705 SLIDTJBEVLVWQU-YUMQZZPRSA-N 265.273 -0.566 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1[C@@H]2CNC[C@@H]12 495120310 NCSOXFNXGZYWAR-RKDXNWHRSA-N 278.268 -0.910 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@@H](c2nn[nH]n2)C1 538225814 XIATVRHFJUCARL-ZCFIWIBFSA-N 292.259 -0.149 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)CCN 583498882 AYHBVXBCWAOGGG-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD Nc1cc(N2C[C@@H](O)C[C@@H]2CO)cc(CO)c1[N+](=O)[O-] 588008413 RNOBPNXODHKSAC-ZJUUUORDSA-N 283.284 -0.399 5 20 CBBD O=C(Nc1nnc2nc[nH]n12)c1cc([N+](=O)[O-])cnc1O 590378735 DUDGMTMSKIOCBW-UHFFFAOYSA-N 290.199 -0.287 5 20 CBBD Nc1ccc(NCCCc2nc(O)n[nH]2)nc1[N+](=O)[O-] 596145532 PGVCQRRHJWESBB-UHFFFAOYSA-N 279.260 0.440 5 20 CBBD Cc1nn(C)c(C(=O)N2CCOC[C@@H]2C(=O)O)c1[N+](=O)[O-] 833012924 KMXRYJMGQCEERB-SSDOTTSWSA-N 298.255 -0.438 5 20 CBBD Cc1cc(N(C)CCNC(=O)CC(N)=O)ncc1[N+](=O)[O-] 1099971036 XGMAYFOIHINWNU-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD Cn1nnnc1CNC(=O)CCn1cc([N+](=O)[O-])cn1 1320497827 AJYNVCKJJAXZPQ-UHFFFAOYSA-N 280.248 -0.979 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCc2n[nH]cc2C1 1323009140 OEMREUCBKGNHCQ-UHFFFAOYSA-N 277.244 -0.506 5 20 CBBD C[C@]1(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 1323924316 ZRJCZKUSOXXSRR-KOLCDFICSA-N 284.272 -0.553 5 20 CBBD O=C(NCCCn1cncn1)c1n[nH]cc1[N+](=O)[O-] 1331795624 KGEKVWNGBXOVFR-UHFFFAOYSA-N 265.233 -0.271 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1[C@@H]2CNC[C@@H]21 1578389345 FUOJRSUZRCLACE-KPCSLPGQSA-N 251.246 -0.392 5 20 CBBD O=C(O)C(=O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O 1605881015 MTWNJJZAEYFOQK-UHFFFAOYSA-N 277.192 -0.042 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NOCCCC(=O)O 1608158715 DGXYFFRFUBVWRI-UHFFFAOYSA-N 272.217 -0.146 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCNC[C@@H]1C(=O)O 1610607044 DGUHMXSUKPOSLO-SNVBAGLBSA-N 296.283 -0.178 5 20 CBBD NS(=O)(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 48411599 UZOGUSKYFBWUGZ-UHFFFAOYSA-N 287.301 -0.685 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCOCC1 49419766 VSRVUIIUBPQNNF-UHFFFAOYSA-N 254.246 -0.041 5 20 CBBD CNC(=O)CCCN(C)c1ncc([N+](=O)[O-])c(N)n1 157672025 BWTAPKSNXVQMSZ-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1O 176293606 FICYZAONATYRMW-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD O=C1CN2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]2CN1 229121893 FTALNKRFRAKBBG-SECBINFHSA-N 290.235 -0.138 5 20 CBBD C[C@@H](NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C(N)=O 272160650 DLOVIDQZIOGZFE-RXMQYKEDSA-N 281.224 -0.073 5 20 CBBD CCc1[nH]nc(C(=O)N2CCO[C@H](C(N)=O)C2)c1[N+](=O)[O-] 345875975 YRSIXYFNEVFIFN-ZETCQYMHSA-N 297.271 -0.793 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)CCC1=O 357043184 HAUZAUNJWWLCNE-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cccc([N+](=O)[O-])c2N)C1 358038635 BMJZJJNSRBVGFI-CYBMUJFWSA-N 294.311 -0.027 5 20 CBBD Cn1cc(CC(=O)NCCn2cc([N+](=O)[O-])cn2)cn1 491032716 GDHYWJGYIQUXQK-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD CNC(=O)[C@H](CO)Nc1ccc([N+](=O)[O-])c(OC(C)C)n1 563424831 FFAKJLRFBIUWPD-QMMMGPOBSA-N 298.299 0.296 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 588864449 JIFMVTNOHPERMR-SECBINFHSA-N 283.284 -0.047 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCCN1 591677310 IIEITXBWQUYIEQ-QMMMGPOBSA-N 268.277 -0.555 5 20 CBBD C[C@H]1C(=O)NCCN1c1ccc2ncc([N+](=O)[O-])n2n1 611370817 RNHXLTHDPJDARP-ZETCQYMHSA-N 276.256 -0.038 5 20 CBBD CN(CCC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 737988963 MJVODJRJZPAVSW-UHFFFAOYSA-N 257.206 -0.881 5 20 CBBD NC(=O)NCCCOC(=O)CCn1cc([N+](=O)[O-])cn1 744145474 WLZOKBJAUVYEKK-UHFFFAOYSA-N 285.260 -0.217 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)N(C)C 748921052 NODDVLJKXKLMRO-QMMMGPOBSA-N 297.267 -0.224 5 20 CBBD NC(=O)CC(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1 1096997520 IZRMJPMUKOUEJP-ZKCHVHJHSA-N 293.283 -0.076 5 20 CBBD CNC[C@H](C)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 1332358350 ICMPLYSGXOZVHJ-LURJTMIESA-N 267.249 -0.060 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCN1 1346046413 JCMXRJLWYGXNMA-SECBINFHSA-N 280.284 -0.423 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1cnnn1C 1347012563 STLQQQNSIKXOEG-UHFFFAOYSA-N 279.260 -0.455 5 20 CBBD CNC(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 1347717419 IIXOJNRWHAWELQ-UHFFFAOYSA-N 267.245 -0.493 5 20 CBBD O=C(O)C[C@@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601965762 PQQFYZNSOSMRKZ-ZCFIWIBFSA-N 284.228 -0.366 5 20 CBBD Cc1nn(CCN2C(=O)CNC2=O)c(C)c1[N+](=O)[O-] 31637321 LXLJMOIRAOIFJU-UHFFFAOYSA-N 267.245 -0.040 5 20 CBBD CC(C)CN(CC(N)=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75624269 QPKAMBIYBOAGIQ-NSHDSACASA-N 299.331 -0.405 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCN1CCCC1=O 126639314 QMZZAYMNCXZRBN-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H](O)C2)c1 174649562 IOBVTAHBCCELMF-WDEREUQCSA-N 270.289 -0.391 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H](C)CN 179190715 IAQHFBYORGPFEJ-ZETCQYMHSA-N 255.278 -0.095 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1c1ncc([N+](=O)[O-])c(N)n1 265837309 ROHHGCUJMQNKSM-ZCFIWIBFSA-N 287.301 -0.410 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCn1ccnn1 302191903 RISARGYIJXJYCK-UHFFFAOYSA-N 277.244 -0.208 5 20 CBBD Cn1c(C(=O)NCC(=O)NC2CC2)ccc1[N+](=O)[O-] 344444354 GVPMLSUKMKSFLP-UHFFFAOYSA-N 266.257 -0.058 5 20 CBBD CN(C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@H]1O 354554448 SVZWYOKBZJXXBX-VHSXEESVSA-N 299.287 -0.808 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(CC(N)=O)C2)c1[N+](=O)[O-] 358100408 VZCYWRFXDICZES-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD NC(=O)c1ccc(N2CCS(=O)(=O)CC2)c([N+](=O)[O-])c1 441822955 LDFSSRXNBWOVGF-UHFFFAOYSA-N 299.308 -0.072 5 20 CBBD O=C(COC[C@H]1CCOC1)NCCn1cc([N+](=O)[O-])cn1 492960905 MRPAVLMPTWYNNZ-JTQLQIEISA-N 298.299 -0.039 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H]2CNC[C@@H]2C1 569358659 FYQFGZBAIWBZBH-HTQZYQBOSA-N 265.273 -0.001 5 20 CBBD CNC[C@H](O)CNC[C@H](O)COc1ccccc1[N+](=O)[O-] 584172815 GZBLCZJEXNWCDC-QWRGUYRKSA-N 299.327 -0.496 5 20 CBBD O=C1NCC[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 597445596 DXVFSQWXWCNQLF-SSDOTTSWSA-N 289.251 0.546 5 20 CBBD CNC(=O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 742271004 AHJSMOPOPUHWQK-UHFFFAOYSA-N 274.258 -0.986 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CN2CCCCC2=O)c1=O 781379043 PFMLGEOOEPXKSS-UHFFFAOYSA-N 294.267 -0.175 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1cnnn1C 808428406 WWFXRFJDCHYDKD-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD C[C@@H]([C@@H](C)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])N1CCOCC1 839658989 WCBZAJMQVTZUJH-LMLFDSFASA-N 271.317 -0.123 5 20 CBBD CON(C)C(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 848229395 OOHUACGLPOIJJD-UHFFFAOYSA-N 283.244 -0.678 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]n1 973906931 WAHFDLOKVJIOIH-IBCQBUCCSA-N 293.283 -0.548 5 20 CBBD O=C(NC1CN(CC(=O)N2CCCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030292764 UWOBZUWQXYELCD-GHMZBOCLSA-N 296.327 -0.926 5 20 CBBD CCN(CCCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cn1 1095961049 JWWQOTINMWAFQP-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1261441512 NSFQNJZGETUCCG-LURJTMIESA-N 295.255 -0.795 5 20 CBBD Cn1cc([C@H](O)CNC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 1319343975 NNZHURDDAQKYGM-SECBINFHSA-N 294.271 -0.625 5 20 CBBD CC(C)(O)CONC(=O)Cn1cnc([N+](=O)[O-])n1 1347761978 IPPYNTSIERTWPU-UHFFFAOYSA-N 259.222 -0.995 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 1349796368 KSUCAVSTLPPAMM-NTSWFWBYSA-N 269.217 -0.994 5 20 CBBD O=C(NC/C=C/CNCc1cnns1)[C@@H]1C[C@H]1[N+](=O)[O-] 1754118933 FKEDTFTVLOBMRU-UFLMBTITSA-N 297.340 -0.035 5 20 CBBD CN1C[C@@H](O)[C@H](Nc2nc(C(=O)O)ccc2[N+](=O)[O-])C1 1777093359 YMYMACLWYPNBIO-VXNVDRBHSA-N 282.256 -0.225 5 20 CBBD Cc1nn(Cc2cc(=O)n(C)c(=O)n2C)cc1[N+](=O)[O-] 181831513 NELUXBNMZKYNJL-UHFFFAOYSA-N 279.256 -0.455 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O 217315898 XPKZCOQBDXSFNO-ZETCQYMHSA-N 293.235 -0.213 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@H](C)CN1 237614702 ACUVQDZZCZTGAN-VHSXEESVSA-N 294.311 -0.035 5 20 CBBD COC[C@H](CCO)Nc1ncc([N+](=O)[O-])c(N)n1 265840019 SEAUNGDIYYIBMJ-LURJTMIESA-N 257.250 -0.224 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C1(O)CCC1 275003827 CVLQSTCLAOIMEX-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD NC(=O)NC[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285554329 IQCTZWLYWJBZKX-SSDOTTSWSA-N 296.287 -0.019 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](C)C1 330601652 IMDLMORWBXKAMG-BDAKNGLRSA-N 297.315 -0.155 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1cc([N+](=O)[O-])c[nH]1 341238725 PQQVDBDMHATPEP-UHFFFAOYSA-N 271.273 -0.014 5 20 CBBD NC1(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCC1 342584138 HUPITGPPTYPZDX-UHFFFAOYSA-N 280.284 -0.246 5 20 CBBD O=C(N[C@H](CO)[C@H]1CCCO1)c1cnc(O)c([N+](=O)[O-])c1 344820800 HSDURFKMQJOILA-PSASIEDQSA-N 297.267 -0.035 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 351864018 RFHKXSJYCVAQSR-IONNQARKSA-N 254.246 -0.370 5 20 CBBD COc1n[nH]c(NC(=O)c2cc([N+](=O)[O-])nn2C)n1 360684950 IHUBVZBSSPTQHU-UHFFFAOYSA-N 267.205 -0.293 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C(=O)N1 436956785 PCMHTCWYZZGIET-MRVPVSSYSA-N 280.240 -0.625 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOC1 569257619 DFBFMDQGTXXPOP-JTQLQIEISA-N 268.229 -0.703 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 572563232 KODWHLKDZYJOEH-LBPRGKRZSA-N 297.315 -0.386 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1C 592641560 RMIVCXHRDYWENE-HTQZYQBOSA-N 297.271 -0.546 5 20 CBBD COC(=O)[C@](C)(CO)NCc1onc(C)c1[N+](=O)[O-] 595533050 FRLQTACGRWDVDK-JTQLQIEISA-N 273.245 -0.095 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@H]2C(=O)O)n1 595985415 JIJKKBNSUFZBEA-QMMMGPOBSA-N 298.255 -0.263 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 760891050 UAMNJVMDKQRQQO-SSDOTTSWSA-N 283.240 -0.470 5 20 CBBD Cn1[nH]c(COC(=O)c2ccc([N+](=O)[O-])cc2N)nc1=O 765387546 VLEJVQUNASVYAB-UHFFFAOYSA-N 293.239 -0.044 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1c(N)cccc1[N+](=O)[O-] 778146165 SYNIVYUFVIIYLJ-UHFFFAOYSA-N 296.239 -0.211 5 20 CBBD Cc1nonc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 796520264 JMPOHWDNNOCWJC-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1C[C@@H](C)OC1=O 808202535 NYYAQSIBQGGBFW-HTRCEHHLSA-N 282.256 -0.080 5 20 CBBD Nc1ccc(NC(=O)N(CCO)CCO)cc1[N+](=O)[O-] 823973414 HNJUAGWFWKNGPE-UHFFFAOYSA-N 284.272 -0.005 5 20 CBBD CS(=O)(=O)N1CCC(C(=O)OCCC[N+](=O)[O-])CC1 860912913 HGIFLCSQQNQCSY-UHFFFAOYSA-N 294.329 -0.132 5 20 CBBD COC[C@H](O)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1319874966 ASCJETFORPOPER-SSDOTTSWSA-N 272.261 -0.246 5 20 CBBD O=C(O)[C@@H]1CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 1601835372 VDOJICUWWKQFPI-QMMMGPOBSA-N 281.224 -0.558 5 20 CBBD O=C(O)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1601992391 FSYKPEVKEVDTBZ-SECBINFHSA-N 272.261 -0.393 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1CCn1cc([N+](=O)[O-])ccc1=O 90552532 JEQRKJGWIKTBNR-ZYHUDNBSSA-N 297.311 -0.162 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1 188973368 FZCVOVSXXLOZSV-UHFFFAOYSA-N 287.297 -0.126 5 20 CBBD O=C1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CCN1 277774119 LMVWMPVRKISQEX-UHFFFAOYSA-N 266.213 -0.733 5 20 CBBD NC(=O)[C@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 311239538 YEUKJNXKOCHAKD-LURJTMIESA-N 251.246 -0.116 5 20 CBBD CCOC(=O)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 314365995 QRSBIGIZGXKBPQ-UHFFFAOYSA-N 268.189 -0.206 5 20 CBBD CCNC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 351743644 IKQPJOMYKPVODL-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1COC[C@H]1O 352794939 BMXMJGBYFJMYQJ-NWDGAFQWSA-N 295.295 -0.115 5 20 CBBD Nc1nc(=NCc2ccnc(O)c2)[nH]cc1[N+](=O)[O-] 353052587 KSKGNEGJPQIEBV-UHFFFAOYSA-N 262.229 0.102 5 20 CBBD C[C@H]1C[C@H](O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 385022073 LTDNASVJXZFUBK-YUMQZZPRSA-N 254.246 -0.227 5 20 CBBD Nc1c(C(=O)NC[C@H]2CNCCO2)cccc1[N+](=O)[O-] 423986607 GCYKDQWBNLEZNT-MRVPVSSYSA-N 280.284 -0.105 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)Nc2n[nH]c(OC)n2)n1 427720886 VFQFKDPFXWDDKI-UHFFFAOYSA-N 281.232 0.190 5 20 CBBD CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCCN 428772658 NCZSJQCOYDFBIM-QMMMGPOBSA-N 284.320 -0.098 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H]1C 434672746 ZLVFBTOWZHVGEA-YUMQZZPRSA-N 268.277 -0.605 5 20 CBBD COC(=O)C1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 566134407 UZYAAYNEZKYAQA-UHFFFAOYSA-N 268.229 -0.047 5 20 CBBD CNc1nccc(C(=O)N[C@@H](CO)CCOC)c1[N+](=O)[O-] 579858346 YHJHJKKQBFULKP-MRVPVSSYSA-N 298.299 0.159 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 592910765 LORFNGZRMHGDRB-JGVFFNPUSA-N 297.267 -0.081 5 20 CBBD NC(=O)C(=O)N(CCO)CCNc1ccccc1[N+](=O)[O-] 1111557041 FEUUFYYAVWSUJA-UHFFFAOYSA-N 296.283 -0.687 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1nncn1C 1116930260 SSOOENNGJUTCEM-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD C[C@@H]1CCN(C(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1323568149 LBKBVLOFJPWKRT-SECBINFHSA-N 295.299 -0.224 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1nnc([C@@H](C)[N+](=O)[O-])n1C 1350589432 UXSUSBZPUHFPLL-HTQZYQBOSA-N 282.304 -0.180 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])c[nH]1)NC1CC1 52972330 KOQJHQRLAPLPRR-UHFFFAOYSA-N 252.230 -0.069 5 20 CBBD Cc1nn(C)c(N2CCO[C@@H](CO)C2)c1[N+](=O)[O-] 94267296 DNQZLWIIFRWKEG-MRVPVSSYSA-N 256.262 -0.166 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 110515974 TUOACWNYYKYKBC-ZCFIWIBFSA-N 252.230 -0.117 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 165998493 IQIBXYBDZBEXKP-SECBINFHSA-N 286.215 -0.002 5 20 CBBD C[C@](O)(CNC(=O)CNc1ccccc1[N+](=O)[O-])C(=O)O 262556989 VEXMVWZIHSQNKG-LBPRGKRZSA-N 297.267 -0.042 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCC[C@@H](OCCO)C1 285914942 ZISDJVJKWXMVFY-MRVPVSSYSA-N 284.272 -0.069 5 20 CBBD CN(CCOCCO)Cc1c([N+](=O)[O-])ncn1C 337443335 KNJNVDNXIVYIAL-UHFFFAOYSA-N 258.278 -0.231 5 20 CBBD O=C(NCCNc1cnccn1)c1n[nH]cc1[N+](=O)[O-] 343238078 ZNAVTURKJQRKBQ-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD CN1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@H]2C1 347653849 LSLZNPWBOVQSPI-RKDXNWHRSA-N 279.300 -0.038 5 20 CBBD Nc1noc(CCN=c2ccc3ncc([N+](=O)[O-])n3[nH]2)n1 347853026 ADHTZMNSRKZOHR-UHFFFAOYSA-N 290.243 -0.321 5 20 CBBD COC(=O)c1cc(OCC(=O)NC(N)=O)ccc1[N+](=O)[O-] 351508708 GNRWPYOFQOJZNK-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1ccc([N+](=O)[O-])o1 358944329 DCMNJAGOXQNGSO-UHFFFAOYSA-N 253.174 -0.059 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NCC(F)F 444336342 JTVUFGRNRWZNOH-UHFFFAOYSA-N 291.214 -0.711 5 20 CBBD COC(=O)[C@]1(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCOC1 446729363 PPIXFTGGSZDNHN-NSHDSACASA-N 298.255 -0.312 5 20 CBBD O=C1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CN1 450450244 GMJURFZJHRBNSE-YFKPBYRVSA-N 266.213 -0.686 5 20 CBBD CC[C@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 583085301 ZNZGBBPQCZMQNG-QMMMGPOBSA-N 268.273 -0.390 5 20 CBBD CC(C)C1(O)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 765603795 YNFKBJYRELTVEW-UHFFFAOYSA-N 295.295 -0.014 5 20 CBBD NC(=O)CONC(=O)c1cc(F)cc([N+](=O)[O-])c1N 772933405 OAAMQBDNLVWHCQ-UHFFFAOYSA-N 272.192 -0.537 5 20 CBBD NC(=O)[C@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCO1 776579082 IWFNZWUDHNKDEC-NWDGAFQWSA-N 295.295 -0.186 5 20 CBBD CCc1nn(C)c(NC[C@H](O)C(=O)NC)c1[N+](=O)[O-] 808048155 KGGNFRYSGXSFTM-ZETCQYMHSA-N 271.277 -0.591 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CNC(CO)CO)c1 843060348 UUHQLKGBKJVNNZ-LLVKDONJSA-N 256.258 -0.429 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1COCO1 861965951 NDCZIXDARJHVOD-SSDOTTSWSA-N 256.218 -0.720 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)CCC(C)(C)[N+](=O)[O-] 863012481 ANCBDYWVIXYTOO-QMMMGPOBSA-N 276.289 -0.138 5 20 CBBD Cc1nc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)co1 991278525 IBRYVAXMHSVNPT-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](C(=O)O)C1 1328606406 JRXQKDYLTQGGFW-SSDOTTSWSA-N 296.287 -0.580 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC[C@H]1CN2CCN1CC2 1334956441 PRJNSUXPQQVHGP-VIFPVBQESA-N 266.305 -0.260 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1ncccn1 1352253170 CWAFIYMOUISKHB-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD O=C(Cn1cnnn1)NCc1cccc([N+](=O)[O-])c1 67071837 SCZSKXJIHVNSCW-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD O=C(O)c1cn(C2CN(c3ncc([N+](=O)[O-])cn3)C2)nn1 92697746 MWIKGOSEXCTLPM-UHFFFAOYSA-N 291.227 -0.264 5 20 CBBD NC(=O)CCCOC(=O)Cn1cc([N+](=O)[O-])cn1 176178102 NJPWBXQCPPZMTD-UHFFFAOYSA-N 256.218 -0.400 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCOC[C@]12CCOC2 194373044 CGUBBUIWOAAGJP-GFCCVEGCSA-N 296.283 -0.191 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 228748256 IMBYTORLGRARQF-GFCCVEGCSA-N 284.316 -0.024 5 20 CBBD CNC(=O)CN(C)c1ncc(C(=O)OC)cc1[N+](=O)[O-] 276505923 DBUNUXNIPUALTE-UHFFFAOYSA-N 282.256 -0.041 5 20 CBBD COCCN1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 282361157 DHNQMFAYAQWISZ-UHFFFAOYSA-N 297.271 -0.934 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)CCC(N)=O 286181399 JFGGVVBMVPILFC-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD CC(C)N(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 298242090 OIEBLUJIDJOLQF-UHFFFAOYSA-N 269.261 -0.486 5 20 CBBD C[C@H](O)C(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 330562415 JMVJZXKDDPPDAG-QMMMGPOBSA-N 296.283 -0.412 5 20 CBBD Cn1cnc([N+](=O)[O-])c1Cn1nnn(C2CC2)c1=O 351894850 ZMNHPLPGGUNBHI-UHFFFAOYSA-N 265.233 -0.535 5 20 CBBD Nc1c(C(=O)NC[C@@H]2CNCCO2)cccc1[N+](=O)[O-] 423986613 GCYKDQWBNLEZNT-QMMMGPOBSA-N 280.284 -0.105 5 20 CBBD C[C@@H]1CN(CCNc2ncc([N+](=O)[O-])cn2)CCO1 546189060 WTXAUIOMHZVZSR-SECBINFHSA-N 267.289 0.517 5 20 CBBD CNc1nccc(C(=O)N2CCNC(=O)[C@@H]2C)c1[N+](=O)[O-] 584664085 VVDWASFADMVAOS-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD COC(=O)c1ccnc(NC[C@@H](O)CO)c1[N+](=O)[O-] 598606175 JQSMRSUIFSFWOL-ZCFIWIBFSA-N 271.229 -0.459 5 20 CBBD O=C1CN(CCn2ccc([N+](=O)[O-])n2)CCCN1 747959278 NGDPFVGUNFSUPU-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD COC[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C(N)=O 760043902 IYSOPJLBJVREBI-JTQLQIEISA-N 297.267 -0.410 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 788177211 QOLQYGMDUFZENU-SECBINFHSA-N 283.240 -0.863 5 20 CBBD CCNC(=O)N1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839704499 YQZPSOGQAMXONG-DJLDLDEBSA-N 270.289 -0.428 5 20 CBBD CN(C)S(=O)(=O)CCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840670882 MTMNNQFGLORSSU-HTQZYQBOSA-N 280.302 -0.524 5 20 CBBD COCC(=O)NC1CCN(Cn2nccc2[N+](=O)[O-])CC1 917460244 WZFZHYLFBJKZJO-UHFFFAOYSA-N 297.315 -0.024 5 20 CBBD C[C@H]1[C@@H](C)N(CC[N+](=O)[O-])CCN1CC[N+](=O)[O-] 931074518 XJPFMFMOXDWWPT-AOOOYVTPSA-N 260.294 -0.066 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC(O)(CO)CC1 1328650785 DHSVPKMTQDNBLM-UHFFFAOYSA-N 270.245 -0.723 5 20 CBBD O=C1OCC[C@@H]1n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1582789420 NOYSTFADJUAMPD-BYPYZUCNSA-N 265.189 -0.541 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCC(=O)C(=O)O 1605689364 ILINJPRFJIFAHW-UHFFFAOYSA-N 271.185 -0.622 5 20 CBBD O=C(O)CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 1606268875 HMXRVKCYSHKWFO-UHFFFAOYSA-N 261.215 -0.647 5 20 CBBD O=[N+]([O-])c1nn(C[C@H](O)CO)cc1Br 112798535 IPULSTZNRYGZBW-BYPYZUCNSA-N 266.051 -0.093 5 20 CBBD CC(C)(CO)CNC(=O)Cn1ccc([N+](=O)[O-])n1 124366137 MIIOSSZENBHMHY-UHFFFAOYSA-N 256.262 -0.074 5 20 CBBD NC(=O)NC(=O)CCn1cc(Cl)cc([N+](=O)[O-])c1=O 158784486 GEPGGWBUOURCNJ-UHFFFAOYSA-N 288.647 -0.005 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 231849568 HVSMZXRAPYCNQJ-KOLCDFICSA-N 299.331 -0.391 5 20 CBBD NC(=O)NC(=O)OCCCn1cc([N+](=O)[O-])cn1 270166996 VMNYFRLSXBXMBC-UHFFFAOYSA-N 257.206 -0.014 5 20 CBBD C[S@@](=O)CCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 346641989 XBGNHHBCIQVOOC-KRWDZBQOSA-N 259.291 -0.431 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C(=O)NCCn1cc([N+](=O)[O-])cn1 349594849 BFVJEMJOYAOELT-PSASIEDQSA-N 283.288 -0.044 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)N(C)C 356160012 REONTOCZEHRPFY-LURJTMIESA-N 269.261 -0.465 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H]1CO 357648622 FCBWKJRIHJQEHL-BQBZGAKWSA-N 253.262 0.032 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 554895071 LFMSWZHACXOVNN-SNVBAGLBSA-N 271.277 -0.640 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)C(=O)OC)c1[N+](=O)[O-] 561113511 LCLMKZHLALHPMF-LURJTMIESA-N 282.256 0.323 5 20 CBBD COC[C@@](C)(CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 768450737 HOUOEWICKRAVNQ-LLVKDONJSA-N 284.272 -0.301 5 20 CBBD COCC[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 775971991 LXQWZONPMQJOLK-VIFPVBQESA-N 296.283 -0.203 5 20 CBBD CC(=O)NCC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 784420426 XWDUPCHSDSCYJR-UHFFFAOYSA-N 295.251 -0.127 5 20 CBBD CN(C)CCONC(=O)c1cnc(O)c([N+](=O)[O-])c1 854945604 MSULHFVZCVWWSI-UHFFFAOYSA-N 270.245 -0.082 5 20 CBBD CC(C)C(=O)N1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954235343 VATDVOFHLPDPNR-NXEZZACHSA-N 269.301 -0.023 5 20 CBBD NC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 1055999336 IZBVFYCUSOYRRX-UHFFFAOYSA-N 279.256 -0.876 5 20 CBBD CCONC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1118270927 GDTDLFFTEXANPK-UHFFFAOYSA-N 285.260 -0.566 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](C(N)=O)C1 1324657165 JXOYAWSXNQUFCA-ZCFIWIBFSA-N 267.245 -0.724 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H](N)C1CC1 1349156047 OUIMJPAGRYBDBG-ZETCQYMHSA-N 253.262 -0.205 5 20 CBBD O=[N+]([O-])c1cn(Cc2csnn2)nc1-c1nn[nH]n1 1593485594 DNHQQQNMMRBWKA-UHFFFAOYSA-N 279.245 -0.129 5 20 CBBD CCCNC(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1605331854 PSBASQRYFNAPFE-UHFFFAOYSA-N 283.240 -0.019 5 20 CBBD COc1c(C(=O)NC(CO)CO)cccc1[N+](=O)[O-] 137582995 IQCHGZGPKNBREZ-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N2CCNC(=O)C2)n1 166656766 NLZJGVASHQBGAO-UHFFFAOYSA-N 280.240 -0.287 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 227047540 NCWIZCXEPSKICQ-YFKPBYRVSA-N 274.254 -0.080 5 20 CBBD O=C1C[C@H](N(C(=O)c2cc([N+](=O)[O-])c[nH]2)C2CC2)C(=O)N1 339224699 CUMVDLWEXGFFAP-VIFPVBQESA-N 292.251 -0.057 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1COC[C@@H]1O 342394702 DEUNZKAURNTFID-BQBZGAKWSA-N 256.218 -0.850 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)NCCn2ncnn2)c1 354618487 DNNSMFGSBZYLCY-UHFFFAOYSA-N 298.284 -0.440 5 20 CBBD CN(C)c1nc(N)nc(Cn2cccc([N+](=O)[O-])c2=O)n1 357045718 VFSCJBCVVYCXKG-UHFFFAOYSA-N 291.271 -0.362 5 20 CBBD CN1C[C@H](COC(=O)c2c([N+](=O)[O-])cnn2C)OC1=O 495731083 QFCHQSPENDHZIW-ZCFIWIBFSA-N 284.228 -0.064 5 20 CBBD CN1CCC[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 519596145 KIBXWNZSBZUUKB-GHMZBOCLSA-N 297.315 -0.637 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)N1 537577223 OWCGRMIZITUFCF-SECBINFHSA-N 264.241 -0.330 5 20 CBBD CN(Cc1nnc(O)o1)C(=O)CCn1cc([N+](=O)[O-])cn1 588849667 ZRXLWWDNOYIHTE-UHFFFAOYSA-N 296.243 -0.071 5 20 CBBD CNc1ccc(C(=O)N[C@@H](CO)C(=O)O)cc1[N+](=O)[O-] 737560743 APDXCYKDSWKFNH-QMMMGPOBSA-N 283.240 -0.188 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)N(C)C 748921049 NODDVLJKXKLMRO-MRVPVSSYSA-N 297.267 -0.224 5 20 CBBD Cn1nnc(COC(=O)c2cc([N+](=O)[O-])cn2C)n1 799462408 MSPWPWLTNIEQQT-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD Cc1nn(C)c(C(=O)NCCN2CCNCC2)c1[N+](=O)[O-] 1118139130 DIMCBCRMHQYPAV-UHFFFAOYSA-N 296.331 -0.728 5 20 CBBD COCCN(C)CCN1C[C@@H](NCC[N+](=O)[O-])CC1=O 1120603602 QIWJYNZNJFVVIX-NSHDSACASA-N 288.348 -0.968 5 20 CBBD C[C@@H]1CC(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1324649289 KMPMYGHVTLTEDK-SSDOTTSWSA-N 293.283 -0.197 5 20 CBBD COC1(CO)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1327114872 SBBBJTYJOSYZPD-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD O=C(N1CCc2ccc([N+](=O)[O-])cc2C1)C1(O)CNC1 1327918198 NWINTQSUIOEQKZ-UHFFFAOYSA-N 277.280 -0.186 5 20 CBBD CCc1[nH]nc(C(=O)N2CCC(O)(CO)CC2)c1[N+](=O)[O-] 1351086131 SSKXHZVFRVPDHL-UHFFFAOYSA-N 298.299 -0.160 5 20 CBBD COC[C@@](C)(CC(=O)O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1599148059 GDMIRQOREGWHEF-SNVBAGLBSA-N 286.244 -0.073 5 20 CBBD COc1c(O)ccc(CN2CC(O)(C(=O)O)C2)c1[N+](=O)[O-] 1607049481 ISAZCYOPBPNTSM-UHFFFAOYSA-N 298.251 -0.060 5 20 CBBD O=C(O)[C@@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3069539 IBPLOWHOPAHVSQ-MRVPVSSYSA-N 290.253 -0.681 5 20 CBBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H](N)CC(N)=O 37810263 ZKOZFUJLDLDGIY-SECBINFHSA-N 280.284 -0.244 5 20 CBBD C[C@H](CN)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 179201449 RVNHFHYNIJNPIV-MRVPVSSYSA-N 268.273 -0.438 5 20 CBBD C[C@H]1C(=O)N(C)CCN1CCn1cc([N+](=O)[O-])cn1 187001972 FABDIBXJPNSNEO-VIFPVBQESA-N 267.289 -0.046 5 20 CBBD CN(CCO)c1ccc([N+](=O)[O-])c(N(C)CCO)n1 192262684 QSPUFSIOPPVJLZ-UHFFFAOYSA-N 270.289 -0.153 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC(=O)NC1=O 230716779 SWLQMNANNJHOKU-SSDOTTSWSA-N 293.239 -0.893 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@H](OCCO)C1 269509777 OECUTLOAZUWMBB-NSHDSACASA-N 298.299 -0.209 5 20 CBBD C[C@H]1[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CCS1(=O)=O 292748677 NJSPFEYHNJQPIY-WDSKDSINSA-N 287.301 -0.046 5 20 CBBD COC[C@H](O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338647617 AANFGVBZXNSLKF-SECBINFHSA-N 286.288 -0.350 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1COC[C@@H]1O 342315171 KXDCWBVZGSGUJL-IUCAKERBSA-N 284.272 -0.682 5 20 CBBD O=C(NCCn1cccn1)c1n[nH]cc1[N+](=O)[O-] 343216785 IJBQUVZFJYOVHU-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 353000157 BUSYHCZIFZLFMO-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD COC[C@@H](O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357459793 PWTAQYXSBFYDHS-ZETCQYMHSA-N 284.272 -0.102 5 20 CBBD O=C(N[C@@H]1CC[S@](=O)C1)c1cnc(O)c([N+](=O)[O-])c1 445009657 MZNAQXRUBJJKHQ-XJZHNMMOSA-N 285.281 -0.054 5 20 CBBD CCN(CCO)C(=O)c1ccnc(NC)c1[N+](=O)[O-] 561116077 PBTLOGQMVGFRQH-UHFFFAOYSA-N 268.273 0.486 5 20 CBBD CNC[C@@H]1C[C@H](F)CN1C(=O)Cn1cnc([N+](=O)[O-])n1 592549036 OXVMOSMRHJWBOV-YUMQZZPRSA-N 286.267 -0.655 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)c1cc([N+](=O)[O-])n[nH]1 598177009 QQEHHRADAAPSPC-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CC(=O)N(C2CC2)C1 611236843 XMIUKBAZAAXJQT-SSDOTTSWSA-N 293.283 -0.179 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)N(C)C[C@@H]1C 782867178 JDRHSIIWMKQKBA-QMMMGPOBSA-N 295.299 -0.211 5 20 CBBD O=C(NC[C@H](CO)[C@@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1322483760 HCBZSKVQTRLASQ-HTQZYQBOSA-N 284.272 -0.307 5 20 CBBD NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1324620518 IVMLROHDFFETJA-UHFFFAOYSA-N 267.245 -0.345 5 20 CBBD O=[N+]([O-])CCN1CCC[C@H](n2cc(CO)nn2)C1 1341498540 KUZDRZNXBMKGBL-JTQLQIEISA-N 255.278 -0.316 5 20 CBBD CN(CC(N)=O)Cc1ccc(OCC(=O)O)c([N+](=O)[O-])c1 1598430655 XJFCHBSQAWIIGC-UHFFFAOYSA-N 297.267 -0.025 5 20 CBBD O=C(O)C[C@@H]1CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 1602105718 CKNVVXQIRYKBNE-JGVFFNPUSA-N 297.271 -0.054 5 20 CBBD CC1(C(N)=O)CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C1 1604505655 FNOYWXUJLYIPAL-UHFFFAOYSA-N 280.240 0.000 5 20 CBBD O=C(OCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C1CC1 1606986783 CETOPROLVCLROM-UHFFFAOYSA-N 279.216 -0.118 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@]1(C(=O)O)C[C@H](O)C1 1607968401 GAQQVBQQQSIIPU-DGFRNANFSA-N 298.255 -0.806 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 1608601520 KPMHAEBWDQEOPT-DTWKUNHWSA-N 284.272 -0.441 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CCNCC1 36278202 DAINTQLOFXOEMY-UHFFFAOYSA-N 281.316 -0.432 5 20 CBBD CNS(=O)(=O)[C@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 138331701 UOEAJSIUDGBEEI-VIFPVBQESA-N 289.317 -0.628 5 20 CBBD COCCN(CCn1ccc([N+](=O)[O-])n1)[C@@H](C)C(N)=O 176235033 ZVQNJJAJYDSKMM-VIFPVBQESA-N 285.304 -0.387 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H](C(N)=O)C1 188597614 CGCCVEJYYIBQCW-WPRPVWTQSA-N 295.299 -0.096 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnc[nH]1 225065353 RRQFGGUFDPCVSW-LURJTMIESA-N 265.233 -0.213 5 20 CBBD Cc1cccc(C(=O)NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 227871228 GQLWOTJMJSANNA-MRVPVSSYSA-N 267.241 -0.521 5 20 CBBD C[C@@H]1C[C@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 261924174 ZZKIMBQMYTWOOI-RKDXNWHRSA-N 267.289 -0.013 5 20 CBBD COC(=O)NCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 308224113 DHGPFEHTIFCALE-SECBINFHSA-N 287.276 -0.902 5 20 CBBD CN1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1=O 330864933 RIGJWMKUZFJAPF-VIFPVBQESA-N 294.267 -0.897 5 20 CBBD O=C(C[C@H]1NC(=O)NC1=O)Nc1cc([N+](=O)[O-])ccc1O 358673745 BCCDDGJCBLWTBW-SSDOTTSWSA-N 294.223 -0.163 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H](O)C[C@H]1CO 364346730 CBJJWKVBTXHBGQ-DTWKUNHWSA-N 282.252 -0.132 5 20 CBBD Nc1nc(=NCCC2CC(O)C2)[nH]cc1[N+](=O)[O-] 432864822 GOPXCMCIVQHCKK-UHFFFAOYSA-N 253.262 -0.038 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN[C@@H](CO)[C@H]1CCCO1 447921118 JLQSDNVIMBPPGB-NWDGAFQWSA-N 297.311 -0.114 5 20 CBBD CO[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 515197250 RATDBQOUIMPTMX-QMMMGPOBSA-N 269.213 -0.181 5 20 CBBD Nc1nc(N2CC[C@H]3CCN[C@H]3C2)ncc1[N+](=O)[O-] 591439669 XNYVNPXLMBRSHL-SFYZADRCSA-N 264.289 0.155 5 20 CBBD CN1C[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(=O)N1 593582155 ZFVWGFZBEVKBQT-SECBINFHSA-N 296.258 -0.262 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCS(=O)(=O)CC1 602773094 PNYOTZWKXWWUJD-UHFFFAOYSA-N 288.329 -0.170 5 20 CBBD CN(CCN1CCCC1=O)C(=O)Cn1ccc([N+](=O)[O-])n1 609578828 BUAHDQOYVVFTJB-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD C[C@@](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)(C(=O)O)C1CC1 827735015 OIFBHUGAXYSGOJ-JQWIXIFHSA-N 298.299 -0.005 5 20 CBBD Cc1nn(CC(=O)O[C@H](C)C[N+](=O)[O-])c(=O)n1C 847716792 QXHYNOMDJZTYII-ZCFIWIBFSA-N 258.234 -0.901 5 20 CBBD Cc1cc(C(=O)N2C[C@H](O)[C@@H](O)C2)c(N)c([N+](=O)[O-])c1 862582360 RURDEQMPXNMINH-UWVGGRQHSA-N 281.268 -0.337 5 20 CBBD NC(=O)CNC1CC2(C1)CC(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 963791815 QUBNYNKGIYQYAC-WILAIQFWSA-N 296.327 -0.846 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCOCC1 1115915559 GAFDJTZBGOPOSB-UHFFFAOYSA-N 255.234 -0.565 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1c[nH]nc1[N+](=O)[O-] 1340015689 FBYNRPMZSNOYTI-DTWKUNHWSA-N 295.299 -0.089 5 20 CBBD Cn1nnc(C[S@](=O)CCn2cc([N+](=O)[O-])cn2)n1 1346683690 UWDVQAFVDLHQOA-LJQANCHMSA-N 285.289 -0.736 5 20 CBBD Cc1nn(C)c(C(=O)O[C@H](C)C(=O)C(=O)O)c1[N+](=O)[O-] 1610569232 QVHCGCQODZYWQR-RXMQYKEDSA-N 285.212 -0.164 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@H]1CO 50469801 BJPJKJIFXKXCQG-QMMMGPOBSA-N 254.246 -0.225 5 20 CBBD O=C(NC(CO)CO)c1ccc(F)cc1[N+](=O)[O-] 159712674 FBDGGZQILBHLEB-UHFFFAOYSA-N 258.205 -0.183 5 20 CBBD CCN1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 188082946 VLLYPCIRXURWBC-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD CN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 265732473 RIEHLNIDPBFUOR-SSDOTTSWSA-N 252.230 -0.117 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCn1cncn1 337648461 BKAGIBQNPFADHG-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(N)=O 352996118 ZZNKBFSDHFOTLH-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD CN(C[C@@H](O)CO)C(=O)COc1ccccc1[N+](=O)[O-] 353939229 BFBOBTYNCJTOLJ-SECBINFHSA-N 284.268 -0.215 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CC(O)(C2CC2)C1 376838860 KOVIHCBFUYXSPN-UHFFFAOYSA-N 295.299 -0.042 5 20 CBBD O=C(NC[C@H](O)CO)C(=O)Nc1cccc([N+](=O)[O-])c1 442553203 KUDBUWPMUHPEDA-VIFPVBQESA-N 283.240 -0.997 5 20 CBBD O=C(N[C@H]1CC[S@@](=O)C1)c1cnc(O)c([N+](=O)[O-])c1 445009660 MZNAQXRUBJJKHQ-ZDVLTJLQSA-N 285.281 -0.054 5 20 CBBD COC(=O)NCCC(=O)OCCn1cnc([N+](=O)[O-])n1 492968322 KXDLEMMTOLIVDD-UHFFFAOYSA-N 287.232 -0.524 5 20 CBBD O=C(NCC1=CCNCC1)c1cc([N+](=O)[O-])n[nH]1 566206601 JWNDFKQGGGHNGG-UHFFFAOYSA-N 251.246 -0.033 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(C)(CO)CO 570457046 XLLZCAVLHAOCAG-UHFFFAOYSA-N 272.261 -0.951 5 20 CBBD C[C@H](CNc1ccc(N)c([N+](=O)[O-])n1)S(C)(=O)=O 596172832 MPXDJNGPSKQXKK-ZCFIWIBFSA-N 274.302 0.417 5 20 CBBD Cc1nn(C)c(N2CC(NS(C)(=O)=O)C2)c1[N+](=O)[O-] 599147642 LWALTDCHVHAQDX-UHFFFAOYSA-N 289.317 -0.625 5 20 CBBD Nc1ccc(C(=O)N2CC[C@H](CO)[C@@H](O)C2)cc1[N+](=O)[O-] 763269602 OTZNAZLKIPBCNB-SKDRFNHKSA-N 295.295 -0.008 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]2CCCC[C@H]2N1 839700702 GXEZWMHLJOAXAS-ZYUZMQFOSA-N 267.285 -0.079 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1256261708 CFTHOWRNKQYGMH-LHLIQPBNSA-N 270.245 -0.412 5 20 CBBD CCc1[nH]nc(C(=O)NCCn2cnnc2)c1[N+](=O)[O-] 1261743453 BGIIZDKIWCQZCK-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 1320788159 NMWRZXRHYBCIKW-ZETCQYMHSA-N 272.213 -0.158 5 20 CBBD COC(=O)[C@]1(NC(=O)c2c([N+](=O)[O-])cnn2C)CCOC1 1323234087 NYECFECGIBYQAM-NSHDSACASA-N 298.255 -0.610 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1342821227 SLOUFQVQTWPRLU-LURJTMIESA-N 267.245 -0.345 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1344578701 FPFMNGOGFVGHHP-VIFPVBQESA-N 256.218 -0.801 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1600768356 SSFZBJHGJTUOLL-NSHDSACASA-N 298.255 -0.702 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 119271982 VGRJWLFLAHBPGS-VIFPVBQESA-N 295.299 -0.075 5 20 CBBD CN(CCN1CCOCC1)C(=O)c1n[nH]cc1[N+](=O)[O-] 131234541 HFSPGUPYLSSOLM-UHFFFAOYSA-N 283.288 -0.278 5 20 CBBD CC[C@H](O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 135043669 ZBYFAAPDNBZTCR-WDEREUQCSA-N 272.305 -0.097 5 20 CBBD CC(C)N(C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152828959 LEFNUOAYYDQKPS-UHFFFAOYSA-N 291.333 -0.034 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1CCn1ccc([N+](=O)[O-])n1 153386390 SKGPHBLIEQZDKZ-NXEZZACHSA-N 270.289 -0.127 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NCCn1cc([N+](=O)[O-])cn1 193570196 PIXGFPIMSZSDMY-SCZZXKLOSA-N 267.289 -0.095 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@@H](C)NC)c([N+](=O)[O-])n1 261858125 YARIESWTKXGZLH-SSDOTTSWSA-N 291.333 -0.303 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)C1=O 265844583 XXIXOUKJZFWCGU-MRVPVSSYSA-N 280.240 -0.344 5 20 CBBD CC1(O)CN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1 277575143 CHLFMDNPASJASX-UHFFFAOYSA-N 293.279 -0.082 5 20 CBBD CNC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 299299598 SLWDXZZAPLZAJN-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 330601653 IMDLMORWBXKAMG-DTWKUNHWSA-N 297.315 -0.155 5 20 CBBD COCCN1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 338339311 QOUCDDDFGVJYLM-UHFFFAOYSA-N 297.271 -0.783 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)c1c([N+](=O)[O-])cnn1C 347104489 YWAXNZPWGXUYJC-UHFFFAOYSA-N 283.288 -0.088 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 356724159 BTQQPGCWJREYRA-YUMQZZPRSA-N 295.299 -0.027 5 20 CBBD Cc1nc(=NC(=O)c2cc([N+](=O)[O-])nn2C)o[nH]1 360557779 XAXMQYNSMWDQQI-UHFFFAOYSA-N 252.190 -0.306 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N1C[C@@H](O)C[C@@H]1CO 371521063 YWKVQNKSWNJYEW-ZJUUUORDSA-N 296.279 -0.072 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@H](C)N 429045512 LJHHGXJEAVKHEZ-ZETCQYMHSA-N 255.278 -0.047 5 20 CBBD Cc1ccc(NC(=O)C(=O)NCCC(N)=O)cc1[N+](=O)[O-] 445938636 PJYTUSGGQPQAKA-UHFFFAOYSA-N 294.267 -0.167 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)c1c[nH]nc1[N+](=O)[O-] 598174571 GGOMXZGVXNWXQW-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD COCC[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 775971978 LXQWZONPMQJOLK-SECBINFHSA-N 296.283 -0.203 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)C1(CO)COC1 797876522 MLLPHYHEVRFCOH-UHFFFAOYSA-N 271.229 -0.657 5 20 CBBD C[C@@H]1COC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 928893096 KIZUOEDDEOCMOD-SFYZADRCSA-N 254.246 -0.058 5 20 CBBD NC(=O)C(=O)N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 1055999226 BKTCOZHKWGOOCY-UHFFFAOYSA-N 297.246 -0.737 5 20 CBBD Cc1cc(NCCNC(=O)CC(N)=O)ncc1[N+](=O)[O-] 1093538303 GILBAJNWQAGRMA-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ncc[nH]1 1118707966 NZFQMJJSYUUGFF-ZCFIWIBFSA-N 265.233 -0.213 5 20 CBBD O=C1CC[C@@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)CN1 1122871369 VKCULKCDDPSTNE-ZCFIWIBFSA-N 269.217 -0.992 5 20 CBBD Cc1ccnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932102 IRHPQHUASGCSCI-NXEZZACHSA-N 279.300 -0.344 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CC(O)(C2CC2)C1 1255859847 SMCIIJKAPVIBOM-UHFFFAOYSA-N 293.279 -0.260 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1CCOCC1 1338116304 ZGNPRABMAJSROV-UHFFFAOYSA-N 269.261 -0.271 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC[C@]1(O)CCCOC1 1346306382 LNGFORBYKSHSCV-LLVKDONJSA-N 299.287 -0.766 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN[C@@H]3C[C@H]32)n1 1579970216 RXYHLEXMNDDBGP-RNFRBKRXSA-N 287.301 -0.937 5 20 CBBD O=[N+]([O-])c1cn(Cc2nnc(O)s2)nc1-c1nn[nH]n1 1593489991 RPTJGRBIPVIQAX-UHFFFAOYSA-N 295.244 -0.423 5 20 CBBD COC[C@@H](NC(=O)Cn1c([N+](=O)[O-])cnc1C)C(=O)O 1599169809 HWWOIBBBUZLIGS-SSDOTTSWSA-N 286.244 -0.684 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NCCN(C)CC(=O)O)n1 1605926597 XVKQZCAZGLPTFM-UHFFFAOYSA-N 299.287 -0.443 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])NCc1nnn[nH]1 44927503 NHSQSUSEISJGDP-UHFFFAOYSA-N 278.228 -0.197 5 20 CBBD CNC[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 237298899 AGEGZYKIAXMRDH-SECBINFHSA-N 282.300 -0.272 5 20 CBBD CCN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 273499761 PXMROLJZXHVLGG-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD O=C(NCCC1(O)CCOCC1)c1cc([N+](=O)[O-])[nH]n1 285976820 BNMPAFJXMVTGPY-UHFFFAOYSA-N 284.272 -0.021 5 20 CBBD O=C(O)c1cnc(N2C[C@@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1 316877523 POADTLJEYNEZND-IONNQARKSA-N 283.240 -0.523 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H]1CO 331261029 BOPFPFCHEUYQRI-YUMQZZPRSA-N 269.261 -0.584 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCc3nn[nH]c3C2)n1 429309795 VFCUDGKBQFSIIY-UHFFFAOYSA-N 263.261 -0.032 5 20 CBBD CO[C@@H](CN)CC(=O)NCCn1cc([N+](=O)[O-])cn1 565595750 FKQQJQPWPYELTC-SECBINFHSA-N 271.277 -0.729 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 583023873 RHAUAECAJHESPJ-MRVPVSSYSA-N 282.256 -0.505 5 20 CBBD CC1(C)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCN1CCO 614895207 QGOSJZMMZIVERI-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD Cn1c(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)ccc1[N+](=O)[O-] 793905592 WDPARLSIMBZZNX-LURJTMIESA-N 295.255 -0.707 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)C(=O)NC 808048045 GPDGFXJSEMOMFI-JTQLQIEISA-N 296.283 -0.527 5 20 CBBD CN(C)C(=O)COC(=O)c1ccnc(N)c1[N+](=O)[O-] 848788003 VEWBVVNZZZHJAA-UHFFFAOYSA-N 268.229 -0.183 5 20 CBBD CCC(=O)N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 972864495 DAHAYRHDSLMSAL-FNCVBFRFSA-N 255.274 -0.175 5 20 CBBD CN(CCNC(=O)CNC(N)=O)c1ncccc1[N+](=O)[O-] 1099910737 QVRIVASDWGNSKC-UHFFFAOYSA-N 296.287 -0.790 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)N(C)C 1118011705 VPJYFNTVXWITKD-YFKPBYRVSA-N 255.234 -0.476 5 20 CBBD O=C(NCCNCC(=O)N1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126943467 PBUYSGITNIPTPR-GHMZBOCLSA-N 298.343 -0.630 5 20 CBBD Cn1cncc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157761099 MVFBVZFKUDWFJY-GHMZBOCLSA-N 281.316 -0.319 5 20 CBBD O=C1N[C@@H](CO)C(=O)N1CCOc1ccc([N+](=O)[O-])cc1 1332405381 VZNPZQKRBJBDEY-JTQLQIEISA-N 295.251 -0.114 5 20 CBBD NC(=O)N1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 1339064581 MVTQFTDFUDAOEB-ZETCQYMHSA-N 282.260 -0.940 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1C[C@H]2COC[C@H]2C1 1341517038 QNPJQXLFLXTDNK-AOOOYVTPSA-N 297.315 -0.216 5 20 CBBD C[C@H](CN(C)C(=O)c1c([N+](=O)[O-])cnn1C)c1nn[nH]n1 1342900810 ZZBRARMHHDKOEU-ZCFIWIBFSA-N 294.275 -0.283 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CCOCC2)c1[N+](=O)[O-] 64334484 YXKFNGWHLHTXTF-UHFFFAOYSA-N 283.288 -0.312 5 20 CBBD O=C(CN1C[C@H](O)[C@H](O)C1)Nc1ccccc1[N+](=O)[O-] 93092101 ZMDPBWIKYNVJNG-PHIMTYICSA-N 281.268 -0.429 5 20 CBBD CS(=O)(=O)c1cccc(NC[C@H](O)CO)c1[N+](=O)[O-] 137976051 TVKPLHYCLZVXAJ-ZETCQYMHSA-N 290.297 -0.237 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CN3CCN2CC3)c1[N+](=O)[O-] 269629684 VTFDNAWEERISSO-VIFPVBQESA-N 294.315 -0.644 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 272171392 WMOYCZNVFITQPO-UHFFFAOYSA-N 269.261 -0.076 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)NC[C@@H]2C1 332259280 URBMZYPWZMEEAY-MRVPVSSYSA-N 294.271 -0.973 5 20 CBBD CC(C)C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339642119 MMPZUAQIXQUJSJ-ZETCQYMHSA-N 285.260 -0.198 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CCNC1 342761029 RHYMMOWCSJHJEB-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 353372377 XSWBIVLANRWWCC-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@]1(CO)CCOC1 359608343 ZAQFOFDBNDQLKL-CYBMUJFWSA-N 297.311 -0.160 5 20 CBBD CN1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2O)C(=O)N1 393958478 ZMOKBIQVLRJGNI-ZETCQYMHSA-N 280.240 -0.625 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 568727431 YOKFLYGTHYKKNA-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD CCOC1CC(O)(CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 578554315 NHOBGDGCYXBOBK-UHFFFAOYSA-N 284.272 -0.022 5 20 CBBD Nc1nccc(C(=O)N2CCOC[C@H](O)C2)c1[N+](=O)[O-] 581558330 MWVZLXMMGYGSMW-SSDOTTSWSA-N 282.256 -0.595 5 20 CBBD CCC[C@@H](O)[C@@H](CO)Nc1ccc(N)c([N+](=O)[O-])n1 596272490 HMQDWYLEZWCIQJ-RKDXNWHRSA-N 270.289 0.506 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCCn1cncn1 727050185 VXGYNVJTOFFSQC-UHFFFAOYSA-N 293.239 -0.409 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@]1(C)CCOC1=O 813297466 MGGDBTWGAZRHIG-LLVKDONJSA-N 282.256 -0.078 5 20 CBBD Cc1ncc(S(=O)(=O)NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1 842348017 ZLKZHFBIDNLUMX-PHDIDXHHSA-N 291.310 -0.078 5 20 CBBD Cn1cc(C[C@H]2CC(=O)N(CC[N+](=O)[O-])C2=O)cn1 899877989 NDUCMLMMVXMEHV-VIFPVBQESA-N 266.257 -0.386 5 20 CBBD O=C(N[C@H]1C[C@H](NCCn2cccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020139674 LEIWLARXVYUXCC-DDHJBXDOSA-N 293.327 -0.215 5 20 CBBD Cn1cc([C@H](CO)NC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 1116931917 IYLDHSVPDLWKNT-QMMMGPOBSA-N 280.244 -0.485 5 20 CBBD CC(C)N(C)C(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936979 ZQHXCNWUXUVHLX-NXEZZACHSA-N 286.332 -0.776 5 20 CBBD CCNC(=O)CNC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1200462104 SVUFYJFXAQGRPF-GHMZBOCLSA-N 298.343 -0.632 5 20 CBBD COCC[C@@H](CO)NC(=O)c1c([N+](=O)[O-])cnn1C 1321199081 IQUILRUHTHLWPJ-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCC[C@@H]1CO 1321871939 YDDUYINHOOKVDH-MRVPVSSYSA-N 269.261 -0.440 5 20 CBBD Cn1nnc2c1CC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C2 1346490962 FMTCGXPTMPNOAS-ZCFIWIBFSA-N 291.271 -0.266 5 20 CBBD O=C(O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1611471047 NGIWBLPKWUIUIL-VIFPVBQESA-N 254.198 -0.171 5 20 CBBD C[C@@]1(O)CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 185686951 CXSTWMWBZWKNLS-LLVKDONJSA-N 283.288 -0.042 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCC(F)(F)CO)c1 228745463 HNTPTRRNGKOYBA-MRVPVSSYSA-N 280.231 -0.631 5 20 CBBD COC(=O)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 349543002 PATYOHGDSSEBTQ-MRVPVSSYSA-N 285.260 -0.500 5 20 CBBD COC(=O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 356492463 VFROEFHNIUHMQR-UHFFFAOYSA-N 256.218 -0.379 5 20 CBBD Cn1[nH]cnc1=NC(=O)NCCn1cc([N+](=O)[O-])cn1 358936149 SANQROZSVYUCBX-UHFFFAOYSA-N 280.248 -0.837 5 20 CBBD Cn1nnc(CNC(=O)c2ccc([N+](=O)[O-])o2)n1 362942795 VXYWHTNDKNBFTC-UHFFFAOYSA-N 252.190 -0.359 5 20 CBBD CN(C)c1n[nH]c(NC(=O)c2c[nH]nc2[N+](=O)[O-])n1 515395692 VPVUPUKFXJEIIX-UHFFFAOYSA-N 266.221 -0.246 5 20 CBBD O=C(NCCc1nc[nH]n1)c1cc([N+](=O)[O-])n[nH]1 570056605 VPQYFTOHNLYBMQ-UHFFFAOYSA-N 251.206 -0.592 5 20 CBBD N[C@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 570569289 MPOXTXZITHQGRA-ZETCQYMHSA-N 272.286 -0.289 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)[C@@H](N)C[C@H]2C1 584124286 ABXSSGFWJGGGDF-YUMQZZPRSA-N 280.288 -0.924 5 20 CBBD CC(C)(CNC(=O)c1cc([N+](=O)[O-])n[nH]1)S(C)(=O)=O 586793808 XTRYCRPUCLRBJB-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD NCCN(Cc1ccc([N+](=O)[O-])cc1F)C[C@H](O)CO 595901715 IBIBJUOKSOSAPE-NSHDSACASA-N 287.291 -0.152 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN2C(=O)NC[C@H]2C1 602777225 CHJLWLGTYHWLCO-JTQLQIEISA-N 294.315 -0.191 5 20 CBBD COC(=O)C1=NO[C@@H](Cn2cnc([N+](=O)[O-])n2)C1 760188720 LXZMEJLLCIQVKE-RXMQYKEDSA-N 255.190 -0.496 5 20 CBBD C[C@@H](NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)C(N)=O 915281791 WOUGOZNJHKPKJE-SSDOTTSWSA-N 291.267 -0.066 5 20 CBBD CCNCc1cc(O)nc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1087257060 YBMMAYQYZSZCKY-RKDXNWHRSA-N 295.299 -0.427 5 20 CBBD Cc1nn(C)c(C(=O)NCC(=O)N(C)C)c1[N+](=O)[O-] 1317967709 XXKLNEHXSOENPG-UHFFFAOYSA-N 269.261 -0.545 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCN1CCOCC1 1317976220 TYICBFSTFRZLQW-UHFFFAOYSA-N 298.303 -0.975 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1ccc(O)nn1 1319841003 RKADSHAIHPUMHU-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD Cc1[nH]nc(C(=O)NCC2(O)CCOCC2)c1[N+](=O)[O-] 1324122785 ZAXYUFSXEYUBFS-UHFFFAOYSA-N 284.272 -0.102 5 20 CBBD C[C@H](c1nnc(N(C)CCN2CCOCC2)n1C)[N+](=O)[O-] 1339666750 IHZWRSZSRWCNTK-SNVBAGLBSA-N 298.347 -0.079 5 20 CBBD CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1N 122794780 WTXJNYPNFVXLGF-UHFFFAOYSA-N 252.230 -0.347 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@](F)(C(=O)O)C1 262201283 QXUIJTGAAORFBB-JTQLQIEISA-N 286.219 -0.184 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1ccc(N)c([N+](=O)[O-])c1 271276608 NCXCAZMACUZMMV-QMMMGPOBSA-N 269.257 -0.398 5 20 CBBD Cc1nn(CC(=O)N2CCNC(=O)C2)cc1[N+](=O)[O-] 273141362 UAPWUBBCFVLJAE-UHFFFAOYSA-N 267.245 -0.942 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@@H]1COC[C@H]1O 287230496 JGVUPTVMHLMKKH-RNFRBKRXSA-N 256.218 -0.850 5 20 CBBD COC[C@@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 354080927 AFAFLQYDUUDGRK-MRVPVSSYSA-N 287.276 -0.902 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1CCn2ncnc2C1 354667825 HMBBKSWPDPORPT-UHFFFAOYSA-N 290.239 -0.057 5 20 CBBD CO[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H](CN)C1 359210687 BJQGAFSNUKPFLG-MWLCHTKSSA-N 297.315 -0.244 5 20 CBBD CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 359475599 APCHSFYWRFZRPF-QMMMGPOBSA-N 269.261 -0.432 5 20 CBBD Cc1cc([N+](=O)[O-])cn(CC(=O)Nc2nn[nH]n2)c1=O 439269990 HCXFUZABEBLOCY-UHFFFAOYSA-N 279.216 -0.783 5 20 CBBD NC(=O)C(NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C(N)=O 490883976 BVCMIRLFCRRAPI-UTCJRWHESA-N 292.251 -0.937 5 20 CBBD COC(=O)[C@](C)(CO)NCCn1ccc([N+](=O)[O-])n1 595527416 OVUHFAPHFSLQPE-JTQLQIEISA-N 272.261 -0.695 5 20 CBBD CC1(O)CN(c2ncnc(N3CCOCC3)c2[N+](=O)[O-])C1 598604946 DIBUXZSJSLKFKI-UHFFFAOYSA-N 295.299 -0.208 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 600465887 RRXDAWNDGXCPEG-JTQLQIEISA-N 298.251 -0.046 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)Cn1ccc([N+](=O)[O-])n1 603942009 VHYDGLULSRCCDM-UHFFFAOYSA-N 283.288 -0.272 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CN(C)CCO1 619789089 FMBPRKUXCCVOBW-IONNQARKSA-N 283.288 -0.233 5 20 CBBD Cn1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)cn1 749079519 DWRSREDORGLONA-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 782881840 KVYCWJMAKIHUOA-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD CON(C)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 853875598 FLHKDMLJTQJJAF-UHFFFAOYSA-N 286.292 -0.416 5 20 CBBD O=C(NC1CN(C(=O)c2cocn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280314 OTFSPIAXMNQSRL-VXNVDRBHSA-N 280.240 -0.720 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](NCc2csc([N+](=O)[O-])c2)C1 1022633549 KRFZUCNENFRJQP-OCAPTIKFSA-N 298.324 -0.122 5 20 CBBD Cc1ccc(NCCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1094079344 BZTUKLPXUAZFGA-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD C[C@H](CS(C)(=O)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116854502 IJRCYXQZKMPUSA-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1116892925 KWAHCPNDDDYRAT-GFCCVEGCSA-N 295.299 -0.074 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1343974392 MURSLCNFOUBDRH-BRPSZJMVSA-N 266.257 -0.512 5 20 CBBD O=[N+]([O-])c1c(N2CC(N3CC[C@@H](O)C3)C2)ccnc1O 1350491093 WZKUBDSOUBPQRB-SECBINFHSA-N 280.284 -0.049 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]2C(=O)O)n1 1608122906 YJWYQWWXJBLWRX-YFKPBYRVSA-N 254.202 -0.373 5 20 CBBD Nc1nccc(C(=O)N[C@H](CF)C(=O)O)c1[N+](=O)[O-] 1608278399 YTPHSLHIZNBMSP-RXMQYKEDSA-N 272.192 -0.276 5 20 CBBD COC(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 43272076 UEAXCPWQTRFXAU-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCNCC1 43403903 WJXLSEPCGQVXMV-UHFFFAOYSA-N 254.250 -0.992 5 20 CBBD COc1cc(OCC(=O)N[C@H](C)C(N)=O)ccc1[N+](=O)[O-] 66018306 SCOZHKLJMCTXFR-SSDOTTSWSA-N 297.267 -0.028 5 20 CBBD CN(C)C(=O)[C@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 128389370 KYVYOGBORSRWFD-SECBINFHSA-N 295.299 -0.130 5 20 CBBD C[C@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 132961571 OZFZTGIYSMVMKZ-PSASIEDQSA-N 258.278 -0.487 5 20 CBBD CCc1nn(C)c(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 228598936 ZRJURFSZYCJXNL-ZCFIWIBFSA-N 257.250 -0.851 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)C2(C)C)c1[N+](=O)[O-] 264632264 BNVBAUZIMNGQQN-UHFFFAOYSA-N 295.299 -0.013 5 20 CBBD C[C@H]1CN(c2c([N+](=O)[O-])ncn2C)C[C@H](CO)O1 299957677 FTZRKCKRCVUCIY-JGVFFNPUSA-N 256.262 -0.086 5 20 CBBD Nc1ccc(N2C[C@@H](O)[C@H](CO)C2)nc1[N+](=O)[O-] 316220126 AWHBWIIXPMIDDZ-POYBYMJQSA-N 254.246 -0.639 5 20 CBBD COC(=O)C1(O)CCN(CCn2cc([N+](=O)[O-])cn2)CC1 330600590 HLCRTOMDIPTWNH-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 345563847 XSEWWOBWEPEJAD-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CSCc1nc(=N)[nH]c(=N)[nH]1 357009274 CIOWADNPQSUYOO-UHFFFAOYSA-N 296.316 -0.228 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)[C@@H]2C)c1[N+](=O)[O-] 408100631 ZLUIRQOMSPPCCB-ZETCQYMHSA-N 281.272 -0.403 5 20 CBBD CCC[C@H](O)[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 413501092 YMFNSVUSKSGDIM-SVRRBLITSA-N 271.277 -0.099 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCCC(N)=O 517767657 XCGDSHMPTMKSLS-UHFFFAOYSA-N 254.246 -0.071 5 20 CBBD COC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 556858898 BPIMCFXUWMJQJK-SECBINFHSA-N 258.234 -0.555 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](CO)CN2CCCC2)c1[N+](=O)[O-] 588867574 XLEWPKZLXYROJP-SECBINFHSA-N 297.315 -0.187 5 20 CBBD CNc1nccc(C(=O)N2CC[C@H](CO)C2)c1[N+](=O)[O-] 590444615 HNXHBTJMEMWJJF-QMMMGPOBSA-N 280.284 0.486 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@@H](c2nn[nH]n2)C1 619789413 ZZCYLZZTNRKOSB-ZCFIWIBFSA-N 292.259 -0.149 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OCCOCCO 781666657 UFOMHCNLJUAVDC-UHFFFAOYSA-N 271.229 -0.262 5 20 CBBD CNC(=O)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821633126 ZNQRPHMQUBVLOT-UHFFFAOYSA-N 292.259 -0.282 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC[C@H](O)C1 823621148 WZKYKSADOULMBL-LURJTMIESA-N 277.244 -0.259 5 20 CBBD CNC(=O)[C@H](O)CN=c1c(Cl)c[nH]cc1[N+](=O)[O-] 853534779 MFBQSZJEHRQUNT-SSDOTTSWSA-N 274.664 -0.416 5 20 CBBD O=[N+]([O-])c1cnccc1N1CCN2CCOC[C@@]2(CO)C1 1348336847 LQDXYBLICHMLAP-ZDUSSCGKSA-N 294.311 -0.127 5 20 CBBD CNC(=O)[C@@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173563616 CZVQRAWAACHZFR-QWRGUYRKSA-N 297.315 -0.637 5 20 CBBD C[C@]1(O)CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 185686931 CXSTWMWBZWKNLS-NSHDSACASA-N 283.288 -0.042 5 20 CBBD CC(C)(CC(N)=O)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 186210453 QGKVKOOMSVLLKO-VIFPVBQESA-N 285.304 -0.604 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@]1(O)CCOC1 229687379 GXDHDINOUPJTML-JTQLQIEISA-N 270.245 -0.941 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 298844067 CDHUQXHKIOBZGD-UHFFFAOYSA-N 276.274 -0.798 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)NCCn1ncnn1 338960617 MMIZAATWKJYVAL-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)NCCO 343110288 BQZHNRFKLJIWJO-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD NC(=O)c1nn[nH]c1NC(=O)Cc1ccccc1[N+](=O)[O-] 362421961 WAHFFIOOFMJCOW-UHFFFAOYSA-N 290.239 -0.007 5 20 CBBD Cn1nnc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)n1 362976461 KLOJMMZRHFWEIQ-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD C[C@]1(CO)CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427079616 YUWBQANRQIBWMA-GZMMTYOYSA-N 283.288 -0.146 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cccc([N+](=O)[O-])c2)CCOC1 521897634 HDMCKHPOPLASRK-LBPRGKRZSA-N 279.252 -0.031 5 20 CBBD NC(=O)CC1(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 572714249 ADGXGMGZVKTDAN-SNVBAGLBSA-N 297.315 -0.603 5 20 CBBD NCCN(Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)CO 595900404 FLTNDESSFKHUPE-LBPRGKRZSA-N 269.301 -0.291 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCn1cncn1 727049371 DDHUMOJBZOYHHC-UHFFFAOYSA-N 266.217 -0.374 5 20 CBBD COCC(COC)OC(=O)Cn1cc([N+](=O)[O-])cn1 766427811 SZZOXTVHCZVPIL-UHFFFAOYSA-N 273.245 -0.004 5 20 CBBD O=C(NCCn1cnnn1)c1cnc(O)c([N+](=O)[O-])c1 816289818 YJWFHNCYOLEFKJ-UHFFFAOYSA-N 279.216 -0.888 5 20 CBBD CC(C)OC[C@H](CO)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839743609 QPDQRINGAZWXLS-IVZWLZJFSA-N 260.290 -0.104 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ncc([N+](=O)[O-])cc1C 1100706280 YCBTZFATOGVYHG-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])s1 1324271012 JIESTYITYWPWGR-BYPYZUCNSA-N 259.243 -0.768 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN(C)C(=O)[C@@H]1C 1340867073 QPOIDUPQOFCCQX-QMMMGPOBSA-N 282.304 -0.258 5 20 CBBD CCNCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1349153153 NDOIWZSLKAWKDJ-UHFFFAOYSA-N 255.278 -0.024 5 20 CBBD CN(CC(N)=O)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591044487 PUGTXGBPZQIXHK-UHFFFAOYSA-N 291.271 -0.308 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1C(=O)O 1599918351 BIYXGBQGQUJPHO-JGVFFNPUSA-N 297.271 -0.245 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1CC(O)(C(=O)O)C1 1601329784 RECSSTKWWLKXON-UHFFFAOYSA-N 295.251 -0.335 5 20 CBBD O=C(N[C@H]1CCO[C@H]1C(=O)O)c1c[nH]nc1[N+](=O)[O-] 1601569596 HVZQAFUXNVGURH-NTSWFWBYSA-N 270.201 -0.710 5 20 CBBD O=C(O)C[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 1608689698 JWIVACHBKRSQDM-ZETCQYMHSA-N 296.239 -0.662 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCSC1=O 89681372 HKRQPAFCRXFKNY-SSDOTTSWSA-N 270.270 -0.060 5 20 CBBD COC(=O)[C@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 103134480 JUJZGGOJHPJLBN-MRVPVSSYSA-N 270.245 -0.377 5 20 CBBD Cn1cnc(CCNC(=O)c2cc([N+](=O)[O-])cnc2N)n1 230700062 IGKPRHNFLZBDIP-UHFFFAOYSA-N 291.271 -0.327 5 20 CBBD CCOC1CC(O)(CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 277711385 MTHCNHQJJFGMNM-UHFFFAOYSA-N 298.299 -0.163 5 20 CBBD CN(CCO)c1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1 301729882 RWZJDBMHEGCGFX-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCCNC1=O 330707513 UWAMMSFRPIHEAO-ZETCQYMHSA-N 267.245 -0.814 5 20 CBBD NC(=O)c1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 339966599 UAXAEOMBTMZAPP-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD CNC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 344901702 VSKDABQTFOZFFO-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)CCc1cccc([N+](=O)[O-])c1 353005535 RWNYLFDALDIBMT-SNVBAGLBSA-N 281.268 -0.510 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@H](O)C[C@@H]1CO 371642414 NLCRDCSDGQETKQ-RKDXNWHRSA-N 282.252 -0.132 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(NC(=O)C2CC2)C1 428209570 RENHJJWRGCXAFL-UHFFFAOYSA-N 293.283 -0.321 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 444340032 IOYNCMDDOJRGAW-RXMQYKEDSA-N 267.245 -0.501 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])C1(O)CNC1 595924393 DKHCRKNYZDKTQY-UHFFFAOYSA-N 251.242 -0.455 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])cn(CC2OCCO2)c1=O 740096702 ORMUUZJULSCMDE-UHFFFAOYSA-N 270.197 -0.172 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)C1(n2cnnn2)CC1 849997690 YTKOFNAJJRMDSF-UHFFFAOYSA-N 293.243 -0.490 5 20 CBBD COC(=O)NC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 856444831 BXVWKBFFXYECNK-RKDXNWHRSA-N 271.273 -0.001 5 20 CBBD COC(=O)NC1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 1324015688 JMLGLXUTEOLDHY-UHFFFAOYSA-N 268.233 -0.488 5 20 CBBD Cn1ncnc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592608236 RNXTWIHIDOGTIX-UHFFFAOYSA-N 276.220 -0.852 5 20 CBBD COC(=O)[C@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 48439786 JEVAKYHKQYRTHK-MRVPVSSYSA-N 282.256 -0.045 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 71270998 HFLXERFRZUWKNV-SECBINFHSA-N 290.297 -0.120 5 20 CBBD CC(C)[C@@H](O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 157657676 NZBCFHZYFLFZAK-QMMMGPOBSA-N 256.262 -0.076 5 20 CBBD CC(C)N(CCn1ccc([N+](=O)[O-])n1)CC(N)=O 176197718 IHTHPNVKEYVAQX-UHFFFAOYSA-N 255.278 -0.013 5 20 CBBD N[C@@H]1CC[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]21 185196998 YIWORVQUTBKBER-OPRDCNLKSA-N 279.300 -0.013 5 20 CBBD C[C@](O)(CO)CNc1nc(C(=O)O)ccc1[N+](=O)[O-] 235721381 ALJRCQBTXCDOQM-SNVBAGLBSA-N 271.229 -0.157 5 20 CBBD O=C1CN(CCNC(=O)c2cccc([N+](=O)[O-])c2)CCN1 272625330 AQBAZCWMMSALHG-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD CCN1CCN(C(=O)CNc2ncc([N+](=O)[O-])cn2)CC1 273591664 HIWCQOYQMFILGA-UHFFFAOYSA-N 294.315 -0.039 5 20 CBBD Cn1ncc(C(=O)NCCn2cc([N+](=O)[O-])cn2)n1 284540634 ASYGAHQHWUXORQ-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 284837639 BRWOOFDJJJRVOE-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1COCCO1 330559458 ANQFFIKSIVHZQE-JTQLQIEISA-N 284.272 -0.287 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])n[nH]1)NCc1ccco1 348630140 NLZRVJKDWIWYOJ-UHFFFAOYSA-N 293.239 -0.043 5 20 CBBD CCS(=O)(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 352899229 CBVGBGXOTQHARJ-LURJTMIESA-N 290.301 -0.129 5 20 CBBD CN(CCOCCO)C(=O)c1cc([N+](=O)[O-])n[nH]1 355850404 VSZYSXSIPPVEQM-UHFFFAOYSA-N 258.234 -0.601 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3C[C@H](O)[C@H](O)C3)nn12 433806048 OQJRABFTYCVENB-KNVOCYPGSA-N 265.229 -0.821 5 20 CBBD COC(=O)c1nc[nH]c1NC(=O)Cn1ccc([N+](=O)[O-])n1 550080969 YQBOEBYHRAECRT-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD C[C@H](CO)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 551576773 ZQFAWHPMGCOFTC-SSDOTTSWSA-N 275.286 -0.009 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CCOC1 566464789 KDVLREVLXSTEOZ-LLVKDONJSA-N 296.239 -0.930 5 20 CBBD CS(=O)(=O)NCCn1cc([N+](=O)[O-])cc(F)c1=O 592356884 KOBGIPWODQPPAO-UHFFFAOYSA-N 279.249 -0.555 5 20 CBBD Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(N)=O 597587604 ZNUJPUVHHZYJPB-JTQLQIEISA-N 281.268 -0.212 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](C)C(=O)O)c1[N+](=O)[O-] 740245391 WVGDKCFELRHZPQ-RXMQYKEDSA-N 256.218 -0.160 5 20 CBBD C[C@@H](COC(=O)c1ccn2nnnc2c1)[N+](=O)[O-] 851036372 INPMQISVQKZZOB-LURJTMIESA-N 251.202 -0.054 5 20 CBBD COC(=O)c1cnn(CC(=O)OC[C@H](C)[N+](=O)[O-])c1 860776044 AWMNEDLTULHPLA-ZETCQYMHSA-N 271.229 -0.122 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@H]3CC[C@@H](C2)N3)c1 923293101 NHDWHUSITPDERI-MDZLAQPJSA-N 295.343 -0.022 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 1342824316 IINHPAUYKIJZBI-ZETCQYMHSA-N 281.272 -0.403 5 20 CBBD C[C@@H](c1nnc(N2CCS(=O)(=O)CC2)n1C)[N+](=O)[O-] 1526643311 KXYKWJJMGURDDC-ZETCQYMHSA-N 289.317 -0.612 5 20 CBBD COC[C@](C)(NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)O 1599152202 HWHPPPRLPVWVJR-VIFPVBQESA-N 272.217 -0.463 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])cn1 174853277 FLCIFGNOEFWHAO-ZJUUUORDSA-N 284.272 -0.601 5 20 CBBD CN1C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 263741185 AOKBNOURNOUEKD-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CCNC(=O)[C@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 263942759 FSDHLAJCBGCUGD-YFKPBYRVSA-N 254.250 -0.097 5 20 CBBD CNC(=O)C(=O)NCCc1ccc([N+](=O)[O-])cc1 284859340 ICYOWGVCDABRBB-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1Cc1c([N+](=O)[O-])ncn1C 331283694 FEOUQRRENGVPIH-VHSXEESVSA-N 298.299 -0.173 5 20 CBBD CCN(CC(=O)OC)C(=O)Cn1cnc([N+](=O)[O-])n1 342442983 BEDBRWKNPJUDOJ-UHFFFAOYSA-N 271.233 -0.792 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCn2ncnc2C1 352271476 AKQGQEVTIMARKH-UHFFFAOYSA-N 290.283 -0.136 5 20 CBBD CN(CCC(N)=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 354545690 GQODTIBMWDBHTD-UHFFFAOYSA-N 284.276 -0.692 5 20 CBBD O=C(N[C@H](CO)[C@@H]1CCCO1)c1cc([N+](=O)[O-])n[nH]1 355459083 SVWSYQDZKAEXCY-SFYZADRCSA-N 270.245 -0.412 5 20 CBBD CC[C@@](C)(NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 770008459 YNKSOXWJAINTGH-LLVKDONJSA-N 283.288 -0.130 5 20 CBBD O=C(NCCn1cnnn1)c1ccc(O)c([N+](=O)[O-])c1 807921184 HCTANHNLCDTGLL-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD COC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CCCO1 839747820 FJXZZAGDLDTYBG-RGOKHQFPSA-N 258.274 -0.038 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 860849251 MYPIRTDRXNYVSY-SSDOTTSWSA-N 297.271 -0.059 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCCNC(=O)C(N)=O)n1 1094742022 LHCJMXTUXWCQEK-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD NC(=O)C(=O)NCCN(c1ccc([N+](=O)[O-])cn1)C1CC1 1101443806 RJQZGEFYDYNOII-UHFFFAOYSA-N 293.283 -0.440 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@H]1COC(=O)N1 1122970616 GHPWQNNABRPRKJ-ZETCQYMHSA-N 284.228 -0.167 5 20 CBBD C=CC(=O)NCCNC(=O)c1c([N+](=O)[O-])cnn1C 1319756430 OKRPRKHMFCZHBD-UHFFFAOYSA-N 267.245 -0.640 5 20 CBBD CN1C[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1341457062 UAQHDCZDRIOXFV-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1c([N+](=O)[O-])cnn1C 1346295835 RNSSPTQSOQTVJL-HTQZYQBOSA-N 284.272 -0.450 5 20 CBBD C[C@H](c1nnc(N2CCC[C@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1525462177 KDERNKMTYXBVAV-SFYZADRCSA-N 282.304 -0.146 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CCO[C@H]2C(=O)O)c1[N+](=O)[O-] 1600768502 VWXPVQHBRSFBES-IMTBSYHQSA-N 298.255 -0.391 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)O[C@@H](C(=O)O)C1CC1 1601390112 POAUNLAEEMRKIA-SSDOTTSWSA-N 270.201 -0.407 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 23327267 GIUIWIDHOGINPK-UHFFFAOYSA-N 296.283 -0.215 5 20 CBBD CNC(=O)[C@H]1CCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 33213442 FCXPISMSGQVHTD-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD CNC(=O)CN(C)C(=O)c1ccc(N)c([N+](=O)[O-])c1 49086050 UMMJONPWQPIZIZ-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD NC(=O)NC(=O)COc1cc(C=O)ccc1[N+](=O)[O-] 50517607 FPYMMSSWEWHHEX-UHFFFAOYSA-N 267.197 -0.019 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 104890736 JTWRBJZSSMHQGZ-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD C[C@@H](Nc1c([N+](=O)[O-])ncn1C)C(=O)N1CCOCC1 134479306 XEZDMGWFAFHEHE-MRVPVSSYSA-N 283.288 -0.013 5 20 CBBD N[C@@H]1CC[C@@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@H]21 185130956 GDIMCROPUZEUFC-FBIMIBRVSA-N 279.300 -0.013 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])o1 227043493 IJEALNLJRUINFL-RXMQYKEDSA-N 258.186 -0.549 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CNC(=O)C1 230415410 SBEYIYCVQNANKH-LURJTMIESA-N 264.241 -0.205 5 20 CBBD CN(C)CCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 266959535 HINNALHBODXTNS-UHFFFAOYSA-N 282.300 -0.224 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285303439 MGOIBRCFYJGANI-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD CC(C)[C@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 289472252 ZCLQSGFDRKNHDB-JQWIXIFHSA-N 299.331 -0.358 5 20 CBBD CCNC(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 301063671 CIQSVAVSGIFBQD-UHFFFAOYSA-N 267.245 -0.363 5 20 CBBD CCc1nn(C)c(N2CCO[C@H](C(=O)NC)C2)c1[N+](=O)[O-] 302046028 KRLSGSHGPHTELR-VIFPVBQESA-N 297.315 -0.158 5 20 CBBD NC(=O)c1ccc(N2CC[C@@](O)(C(N)=O)C2)c([N+](=O)[O-])c1 314834046 GEQACSQDWPEURH-LBPRGKRZSA-N 294.267 -0.880 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCCS2(=O)=O)c1 330718700 DXPCOFYVHDLMRO-UHFFFAOYSA-N 260.275 -0.173 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCNC1=O 340449081 CUAWTKDPKKTPIY-VIFPVBQESA-N 294.267 -0.897 5 20 CBBD NC(=O)c1ccc(N2C[C@@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 347409859 HHWFMFFKWDFMOC-BDAKNGLRSA-N 281.268 -0.374 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCn1cncn1 352632364 BJAJAMXOFCFTMM-UHFFFAOYSA-N 277.244 -0.208 5 20 CBBD CCNCCNS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 353218363 OADCFRVJMNAHQZ-UHFFFAOYSA-N 291.333 -0.301 5 20 CBBD O=C(NCC1CCN(CCO)CC1)c1cc([N+](=O)[O-])n[nH]1 354056739 MGCDNLMKOKJTSI-UHFFFAOYSA-N 297.315 -0.248 5 20 CBBD CN1CC[C@@](O)(CNc2ncc([N+](=O)[O-])c(N)n2)C1 358342517 SCFUJUXLAZRQKZ-SNVBAGLBSA-N 268.277 -0.555 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@](C)(C(N)=O)C1 358369085 YCUVXDGWVGPRCX-GFCCVEGCSA-N 295.299 -0.176 5 20 CBBD O=C(NC[C@H](O)COCC1CC1)c1c[nH]nc1[N+](=O)[O-] 554879272 QBGLGHJXTQKHDK-QMMMGPOBSA-N 284.272 -0.165 5 20 CBBD O=C1C[C@@H](NCCO)C(=O)N1c1cccc([N+](=O)[O-])c1 570859725 FPUMAARBZLHSCZ-SNVBAGLBSA-N 279.252 -0.191 5 20 CBBD NCC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(F)F 581885037 BQXLPUCCIXZUKV-LURJTMIESA-N 277.231 -0.110 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 595987764 XAJNUYLGABWECK-LURJTMIESA-N 270.201 -0.757 5 20 CBBD Cn1nnnc1CCNC(=O)c1cc([N+](=O)[O-])ccc1N 787214034 DYBTZTLRSYFLPR-UHFFFAOYSA-N 291.271 -0.327 5 20 CBBD C[C@H]1CNC[C@@H](C)N1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923331020 AFBTUYONKRXRRV-JFGNBEQYSA-N 283.332 -0.166 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccncn1 998190249 SKVSGPGFGJBIMD-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD CCN(C(=O)C(F)F)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1079185961 PINJCKHPRIJISO-HTQZYQBOSA-N 291.254 -0.024 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C(N)=O)C1 1116428298 MQVMYHVMOIMCIU-SSDOTTSWSA-N 281.272 -0.334 5 20 CBBD C[C@H]1CN=C(NC(=O)Cn2cnc([N+](=O)[O-])n2)S1 1325905206 YIUROXZTKFPKFX-YFKPBYRVSA-N 270.274 -0.206 5 20 CBBD O=C(NCC1OCCCO1)c1c[nH]nc1[N+](=O)[O-] 1328357388 FEBJJCDBPKTNFD-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD C[C@H](c1nnc(N2CCN3CCOC[C@H]3C2)n1C)[N+](=O)[O-] 1338207302 AHTXJCXBPIZFFV-NXEZZACHSA-N 296.331 -0.326 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 1344391402 HEXACHOOAYDLPA-VIFPVBQESA-N 298.251 -0.046 5 20 CBBD CNC[C@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1346014053 JZCMXPWAURWLHN-VIFPVBQESA-N 282.300 -0.272 5 20 CBBD NC(=O)c1ccnc(N2C[C@H]3CNC[C@@H]3C2)c1[N+](=O)[O-] 1347396312 SHEQRWOIWTXDTA-HTQZYQBOSA-N 277.284 -0.256 5 20 CBBD CN(CC(=O)O)S(=O)(=O)c1ncccc1[N+](=O)[O-] 1593723558 NGEOIQUXGWAHGR-UHFFFAOYSA-N 275.242 -0.305 5 20 CBBD CCOC[C@H](C(=O)O)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1596876084 SVJKBWKIWYIYPG-SSDOTTSWSA-N 286.244 -0.120 5 20 CBBD Cn1nnnc1CCNc1ncc(C(=O)O)cc1[N+](=O)[O-] 1601047154 YCNKMHOEVOOYGS-UHFFFAOYSA-N 293.243 -0.134 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCCO1 48320905 KJVYPLUCTWUWHB-HTQZYQBOSA-N 269.261 -0.130 5 20 CBBD COc1nc(NC(=O)CCn2cc([N+](=O)[O-])cn2)n[nH]1 179373337 SRFOUZAWPWJSRU-UHFFFAOYSA-N 281.232 -0.053 5 20 CBBD C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])C(N)=O 183591534 JLLORVBBNKYKRN-RXMQYKEDSA-N 253.218 -0.015 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)C2)n1 234576739 AWWAOLUKAWLMKR-DTORHVGOSA-N 283.240 -0.682 5 20 CBBD Nc1nc(N[C@H]2CCC(=O)NC2)ncc1[N+](=O)[O-] 264161272 UURGVNGQUNIHQK-YFKPBYRVSA-N 252.234 -0.343 5 20 CBBD O=C1NC[C@@H]2[C@@H]1CCCN2C(=O)c1n[nH]cc1[N+](=O)[O-] 337149267 QSBSHKGILCCSTP-NKWVEPMBSA-N 279.256 -0.332 5 20 CBBD CNS(=O)(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 352087199 KRYJXNFTKHCJEB-UHFFFAOYSA-N 289.317 -0.108 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC(O)(C3CC3)C2)c1 372689280 DACUBDPAYUXBPB-LLVKDONJSA-N 282.300 -0.391 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 425067295 AJLXOYULPNPOJY-ZETCQYMHSA-N 295.255 -0.945 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 548748265 ACLJMYWDVCGTRV-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H](CO)C2CC2)c1 565422049 LCMQNVNIFKNXAX-CMPLNLGQSA-N 284.316 -0.240 5 20 CBBD CNc1nccc(C(=O)N[C@H](CO)CCF)c1[N+](=O)[O-] 594373363 RQCPRMZFZYSTGM-ZETCQYMHSA-N 286.263 0.482 5 20 CBBD CN(CC(C)(C)N)C(=O)Cn1cc([N+](=O)[O-])cn1 595960464 FVVHJSJHNDOSCZ-UHFFFAOYSA-N 255.278 -0.013 5 20 CBBD O=C(NCCNc1ncccn1)c1n[nH]cc1[N+](=O)[O-] 611202147 FWMPFXLCSQIWSE-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD O=C1CC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)N1 798598936 MCFBDJQQIBRFAB-ZCFIWIBFSA-N 282.212 -0.860 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 825630718 PEMKYHYXNSMZGR-LDYMZIIASA-N 293.279 -0.025 5 20 CBBD O=C(O)N1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 832031689 XNQCMRDVKTWREC-JTQLQIEISA-N 299.287 -0.552 5 20 CBBD CC(C)N1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 839631848 MZMXGZOIKJIUML-IWSPIJDZSA-N 255.274 -0.223 5 20 CBBD CCOC[C@@H](C(=O)OC)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840393172 UUECDAQFGXBSNZ-HLTSFMKQSA-N 274.273 -0.312 5 20 CBBD O=[N+]([O-])CCNCC1(N2CCOCC2)CCOCC1 905283826 ILDQLUPAEBGOPY-UHFFFAOYSA-N 273.333 -0.266 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCCN(CCO)C2)C1 981764683 YKVNERIQRQWVCF-GHMZBOCLSA-N 283.328 -0.432 5 20 CBBD Cn1cccc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990259773 AXDNHQXIVZMXHW-MWLCHTKSSA-N 292.295 -0.369 5 20 CBBD Cn1nccc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990428411 ZYJKWAXTLDJJLF-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD Cc1ccnc(N[C@H]2C[C@H](NC(=O)C(N)=O)C2)c1[N+](=O)[O-] 1059393840 MSWZOVFHJKQPHX-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2c([N+](=O)[O-])cnn2C)C1 1320227637 DTHQAEULVMMKBQ-LLVKDONJSA-N 283.288 -0.875 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322774307 PSJBBJQLUDFJNG-QUBYGPBYSA-N 270.245 -0.412 5 20 CBBD O=C(NCCN1C(=O)CCC1=O)c1n[nH]cc1[N+](=O)[O-] 1324598466 BASPEEZVBPGCGC-UHFFFAOYSA-N 281.228 -0.803 5 20 CBBD Cc1[nH]nc(C(=O)NCc2cnnn2C)c1[N+](=O)[O-] 1330158858 XCYQZIGOUQIMMA-UHFFFAOYSA-N 265.233 -0.315 5 20 CBBD CC1(NS(=O)(=O)c2ncccc2[N+](=O)[O-])CNC1 1576545179 FJGFEXZYLLHXBF-UHFFFAOYSA-N 272.286 -0.370 5 20 CBBD Cc1nn(CCC(=O)N[C@H]2CNOC2)c(C)c1[N+](=O)[O-] 1579895720 RMQJZJUHEQGILY-VIFPVBQESA-N 283.288 -0.182 5 20 CBBD C[C@@H](/C=C\C(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1592202099 SLIZGXHWDOAYPC-GFNSNHMOSA-N 269.217 -0.668 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)N1CCC1 1592937895 UZNFWCQVWPGVJD-UHFFFAOYSA-N 278.232 -0.796 5 20 CBBD COC(CN(CCC(=O)O)CC[N+](=O)[O-])OC 1606675036 YGPPYZIMKNRMCB-UHFFFAOYSA-N 250.251 -0.341 5 20 CBBD COCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 52784360 ZADKVEJXEVKRNN-QMMMGPOBSA-N 286.244 -0.603 5 20 CBBD Cn1nnnc1Sc1ncc([N+](=O)[O-])c(N)n1 76266971 HUCZYUIEMXTUDK-UHFFFAOYSA-N 254.235 -0.358 5 20 CBBD CS(=O)(=O)c1ccc(NC[C@H](O)CO)c([N+](=O)[O-])c1 90281607 APPXKRXFRJQPSX-ZETCQYMHSA-N 290.297 -0.237 5 20 CBBD Cc1cc(=O)n(CC(=O)N2CCNC(=O)C2)cc1[N+](=O)[O-] 128438370 KGDPGYDDBBFWNP-UHFFFAOYSA-N 294.267 -0.977 5 20 CBBD NC(=O)NC(=O)COc1ccc([N+](=O)[O-])c(C(=O)O)c1 236211213 LMQFIYXESHRHHC-UHFFFAOYSA-N 283.196 -0.133 5 20 CBBD Nc1nc(N2CCC[C@@H](OCCO)C2)ncc1[N+](=O)[O-] 265181884 DXLPATVVLVMVFX-MRVPVSSYSA-N 283.288 -0.055 5 20 CBBD CC(C)[C@@H](N)CNC(=O)Cn1cc([N+](=O)[O-])cn1 269292444 UYCYRGIBYAFOJZ-VIFPVBQESA-N 255.278 -0.109 5 20 CBBD CC1(C)CNC(=O)CN1CCn1cc([N+](=O)[O-])ccc1=O 282742921 NHNVQTQRYYYZDX-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD Cc1nn(CC(=O)N2CCCC[C@H]2C(N)=O)cc1[N+](=O)[O-] 344774747 DJPBNPCFDVDILH-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@H](O)C[C@@H]1CO 371525399 MNNGAMLPEFDMCR-NXEZZACHSA-N 295.295 -0.039 5 20 CBBD CCn1cc(S(=O)(=O)N2CC(C)(O)C2)c([N+](=O)[O-])n1 407983726 RLASZCXVHBFLAX-UHFFFAOYSA-N 290.301 -0.434 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 547841992 DBVHFBYPLPLCPW-UHFFFAOYSA-N 267.245 -0.758 5 20 CBBD CNC(=O)CN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 581259348 HKWXCODSIXLXHX-UHFFFAOYSA-N 267.245 -0.610 5 20 CBBD CN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 584517527 QDDKCUHQGIZPRN-UHFFFAOYSA-N 253.218 -0.768 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCOC[C@H]1CCOC1 609463448 JUTUHJOOULVPDD-JTQLQIEISA-N 298.299 -0.039 5 20 CBBD CNC(=O)CN(C)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 821632863 MHQDKWPIHDAZDQ-UHFFFAOYSA-N 292.259 -0.648 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCS(=O)(=O)C[C@@H]1C1CC1 854809232 PSYDCMCGGBTDQJ-OPRDCNLKSA-N 288.325 -0.313 5 20 CBBD O=C(NN1CCCC1=O)c1cnc(O)c([N+](=O)[O-])c1 1321227848 QEIZZYJAOFEPDQ-UHFFFAOYSA-N 266.213 -0.037 5 20 CBBD CCOCC[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1322880309 OTGQLTIJRMLWHH-SSDOTTSWSA-N 272.261 -0.322 5 20 CBBD Cc1cc(C(=O)NCC(=O)NC2CNC2)ccc1[N+](=O)[O-] 1574127125 JMLHLONRSDAEDQ-UHFFFAOYSA-N 292.295 -0.279 5 20 CBBD Cc1nc(N2C[C@@H](O)[C@H](CC(=O)O)C2)ncc1[N+](=O)[O-] 1777513935 FNVXEFWEMJKKCC-VXNVDRBHSA-N 282.256 -0.035 5 20 CBBD Cc1nn(C)c(NCCCS(N)(=O)=O)c1[N+](=O)[O-] 45084352 HEZDFHGGXYAQNT-UHFFFAOYSA-N 277.306 -0.273 5 20 CBBD CC[C@@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 161502054 FZFJBYNYCSQJDT-QMMMGPOBSA-N 271.277 -0.139 5 20 CBBD COC(=O)N(C)CC(=O)NCCn1cc([N+](=O)[O-])cn1 269228474 XBRWTBJXDXNZIC-UHFFFAOYSA-N 285.260 -0.394 5 20 CBBD C[C@H](O)C(=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273695599 BYXDWJLNQLWUMW-QMMMGPOBSA-N 281.272 -0.586 5 20 CBBD CNC(=O)[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 408167459 AIHWIPANUYCOHB-ZETCQYMHSA-N 269.261 -0.721 5 20 CBBD C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](CO)O1 559034951 WYDDHVALNSFPAI-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD C[C@H](O)CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 594064169 KZRRLDACWPUBBA-JOYOIKCWSA-N 284.316 -0.003 5 20 CBBD COCCONC(=O)Cn1cc([N+](=O)[O-])nc1C 748766063 DDWMLOHOOIQCJC-UHFFFAOYSA-N 258.234 -0.206 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(N)=O 760044319 YONJUAWCQYQKBP-LURJTMIESA-N 270.245 -0.837 5 20 CBBD C[S@](=O)CCN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 760548596 GYUUAJAQNNAJES-FQEVSTJZSA-N 299.356 -0.115 5 20 CBBD NC(=O)C1(C(=O)OCCn2cc([N+](=O)[O-])ccc2=O)CC1 761404347 PKAFAMVBPNUFSF-UHFFFAOYSA-N 295.251 -0.435 5 20 CBBD COC(=O)[C@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 843065199 KEFLGHSKCMDBLI-WDEREUQCSA-N 284.268 -0.248 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 863015520 CLJPCSBWHHPULO-MRVPVSSYSA-N 297.267 -0.169 5 20 CBBD CN(C(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 920519259 JRQRWIOVUKIZGC-UHFFFAOYSA-N 282.256 -0.045 5 20 CBBD NC(=O)CCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 1116464298 YMACAKURKMOQKH-UHFFFAOYSA-N 269.261 -0.437 5 20 CBBD Cn1nc(C(=O)NCCn2cc([N+](=O)[O-])cn2)ccc1=O 1319840610 HSKJCIDIECHLTA-UHFFFAOYSA-N 292.255 -0.685 5 20 CBBD CCOC(=O)[C@@H]1CNCCN1CCn1cc([N+](=O)[O-])cn1 1327205287 CGXCJAGOTDXYLY-NSHDSACASA-N 297.315 -0.372 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)NC2CNC2)cc1 1574441486 XQCDTTPJDUFXBB-VXGBXAGGSA-N 267.285 -0.450 5 20 CBBD CNc1c(C(=O)N[C@@H]2CNC[C@H]2O)cccc1[N+](=O)[O-] 1578754060 FIRVPALWMCIRFJ-PSASIEDQSA-N 280.284 -0.301 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C(=O)O 54310788 KAIMDYZQOUYTHZ-YFKPBYRVSA-N 269.213 -0.266 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1=O 174871858 GTVKBIGKJPRPMR-UHFFFAOYSA-N 253.262 -0.435 5 20 CBBD NC(=O)CN1CCN(c2ncc([N+](=O)[O-])s2)CC1 190336454 STYLGVCKOPDYBB-UHFFFAOYSA-N 271.302 -0.341 5 20 CBBD CNC(=O)C1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 274355495 JMTWALLWTXEXEQ-UHFFFAOYSA-N 278.268 -0.005 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1COC[C@H]1O 286100935 UAQZAFHYQQSVJK-RKDXNWHRSA-N 256.262 -0.517 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 345915622 NLAOSNRLIMDKKS-BDAKNGLRSA-N 295.299 -0.178 5 20 CBBD Cn1c(C(=O)N2C[C@@H](O)C[C@@H]2CO)ccc1[N+](=O)[O-] 347735681 RMEHIISGWDNKGA-SFYZADRCSA-N 269.257 -0.499 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 355097150 CUSDHLHKSHRLLF-MRVPVSSYSA-N 283.288 -0.544 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C1CC1 360753938 KAWHIEAZHNILEM-MRVPVSSYSA-N 254.246 -0.171 5 20 CBBD C[C@H]1C[C@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 385054515 WQUXHXXPMFQREJ-CBAPKCEASA-N 254.246 -0.227 5 20 CBBD COC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])n2C)CCOC1 446489749 CQWRMAJQKAGSGN-LBPRGKRZSA-N 297.267 -0.005 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@H]2CN(C)NC2=O)c1[N+](=O)[O-] 539782382 OBSUHKSEHJQHAK-ZETCQYMHSA-N 296.287 -0.655 5 20 CBBD CCCN(CC(=O)NC)C(=O)c1c[nH]nc1[N+](=O)[O-] 547756061 XAEUSGQCIUYTCG-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)c1cc([N+](=O)[O-])n[nH]1 586774570 KVCJHUYUHJCZCF-UHFFFAOYSA-N 269.261 -0.132 5 20 CBBD COCC(=O)N1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 590574628 OMMCHXLJSFDTPT-UHFFFAOYSA-N 295.299 -0.133 5 20 CBBD CNC(=O)CN1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 591136866 SQYCUYVHONKMSB-UHFFFAOYSA-N 297.290 -0.003 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2CC[C@H]1C2 597708026 FHIRWMIHRSOMKC-ZETCQYMHSA-N 251.246 -0.152 5 20 CBBD O=C(CCCn1cncn1)NCCn1cc([N+](=O)[O-])cn1 768946387 ARXIFFSFHPFFOP-UHFFFAOYSA-N 293.287 -0.021 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](c2nc(O)n[nH]2)C1 843876874 APVGWESXMGSNRW-BWZBUEFSSA-N 281.272 -0.119 5 20 CBBD O=[N+]([O-])CCN[C@@H]1CCN(CCN2CCOCC2)C1 905122691 TZMVFVIBIOZKFR-GFCCVEGCSA-N 272.349 -0.741 5 20 CBBD CCS(=O)(=O)N1CCN(CC[N+](=O)[O-])[C@H](C)C1 930479261 FUHFGHCOHZWUPI-SECBINFHSA-N 265.335 -0.381 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1 1059803786 CBJOSXYQUBYJCP-KNVOCYPGSA-N 279.256 -0.466 5 20 CBBD C[C@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)N(C)C 1320011433 AHECGBCOICLIPS-QMMMGPOBSA-N 297.267 -0.224 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H](CCO)C(F)(F)F 1339749285 UMVNPEGVWZLSHZ-RXMQYKEDSA-N 297.193 -0.384 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)c1cnc(C(=O)O)cn1 1589076742 BGKRXCCEJOIXBN-YFKPBYRVSA-N 255.186 -0.003 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H](C(=O)O)C1 1600918422 QTMKBFUCBBUGNU-LURJTMIESA-N 255.234 -0.497 5 20 CBBD C[C@@H](N)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 178688981 SEEBJRLZZFYXMZ-MRVPVSSYSA-N 268.273 -0.390 5 20 CBBD CO[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 267639536 IKCQFSKWNDMRBJ-QWRGUYRKSA-N 270.289 -0.127 5 20 CBBD Cn1nnnc1CNC(=O)COc1cccc([N+](=O)[O-])c1 275259608 QZNPXZKDWIOWAX-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD COC(=O)N1CC(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 275860084 FPVXSGOYLMBDAG-UHFFFAOYSA-N 296.239 -0.124 5 20 CBBD C[C@@H](CO)N(C[C@@H](C)O)C(=O)c1cc([N+](=O)[O-])[nH]n1 289216878 VQMUYDFBALSWMC-NKWVEPMBSA-N 272.261 -0.478 5 20 CBBD O=C(NCCNc1ncc([N+](=O)[O-])cn1)c1ccn[nH]1 302214315 IJAAVXIGEFGPCZ-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD C[C@@H]1CC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 331247869 UCCJMWFFCWPAAU-APPZFPTMSA-N 282.256 -0.453 5 20 CBBD NC(=O)c1cccc(N2CCNC(=O)C2)c1[N+](=O)[O-] 341819773 HLPGWIAFFYXKMS-UHFFFAOYSA-N 264.241 -0.370 5 20 CBBD Cn1c(C(=O)N2CCO[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-] 348028221 QQZNGAZDTYRQLM-MRVPVSSYSA-N 282.256 -0.740 5 20 CBBD C[C@@H](N)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 351829758 OUCPNSDKJRVRLX-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCc1nc[nH]n1 359023953 HCJVEVBTRDCEEO-UHFFFAOYSA-N 277.244 -0.106 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](O)COCC1CC1 359549931 FKONUEVKUBPXQR-JTQLQIEISA-N 298.299 -0.305 5 20 CBBD Cn1nncc1CNC(=O)c1cc([N+](=O)[O-])cnc1N 360694397 HYTKHVOWRCWFIC-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD NC1C[C@@H]2CC[C@H](C1)C2NC(=O)Cn1cnc([N+](=O)[O-])n1 567912580 QRPBHLFQHGFHPB-REMFIFCHSA-N 294.315 -0.182 5 20 CBBD O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 600217223 UIQJRORYSXOJMW-QWRGUYRKSA-N 284.243 -0.160 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H](CCO)C2CC2)c1 763060450 UMCGJSLDDLGMCE-NEPJUHHUSA-N 284.316 -0.097 5 20 CBBD O=C1CC[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)N1 798598935 MCFBDJQQIBRFAB-LURJTMIESA-N 282.212 -0.860 5 20 CBBD NC(=O)[C@@]1(O)CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C1 804645983 JDXIYLKXWZAVCZ-LLVKDONJSA-N 296.239 -0.071 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CNC(CO)CO)c1 843060349 UUHQLKGBKJVNNZ-NSHDSACASA-N 256.258 -0.429 5 20 CBBD CN(C(=O)C(F)F)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953460323 QNZOKQYSPGIKDS-RNFRBKRXSA-N 277.227 -0.414 5 20 CBBD O=C(NCC1CN(Cc2cnns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031662633 JTESLADJWBUOPI-NXEZZACHSA-N 297.340 -0.249 5 20 CBBD CNC(=O)[C@H](O)CN=c1c(C)c[nH]cc1[N+](=O)[O-] 1325256678 ZDYVXTGVXBINFE-MRVPVSSYSA-N 254.246 -0.761 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](C)O[C@H](C(=O)O)C2)c1[N+](=O)[O-] 1599968522 XUHPHCZCRBJUPY-FSPLSTOPSA-N 298.255 -0.060 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1C(=O)O 1603442217 BIYXGBQGQUJPHO-HTQZYQBOSA-N 297.271 -0.245 5 20 CBBD COCCN(CC(=O)O)Cc1ncc([N+](=O)[O-])n1C 1777209513 SHJAJUUORPTULV-UHFFFAOYSA-N 272.261 -0.139 5 20 CBBD Cc1nn(CC(=O)N2CCC[C@H](C(N)=O)C2)cc1[N+](=O)[O-] 181835271 ZGQDIFIYMLAXAL-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)Cn1ccc([N+](=O)[O-])n1 188486143 MLDCUCOWEFGXPM-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD C[C@H](O)CN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 189347555 LLWFTHMDOWGDKD-NSHDSACASA-N 283.332 -0.210 5 20 CBBD CO[C@H](C)CS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 195425989 ZJLBDAAQKGLSNQ-MRVPVSSYSA-N 292.317 -0.254 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 228747122 MIXSHMBGJAHROT-LLVKDONJSA-N 270.289 -0.035 5 20 CBBD CNCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 237375272 MEVMLHNWAQGPCV-UHFFFAOYSA-N 255.278 -0.138 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCSCC1 264844472 YGCNIWRIANSYIT-UHFFFAOYSA-N 299.356 -0.044 5 20 CBBD CN1CC[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)C1=O 267108755 WXDSTGVIMJULJJ-SECBINFHSA-N 267.289 -0.046 5 20 CBBD COC[C@@H](CCO)NC(=O)CCn1cc([N+](=O)[O-])cn1 269105497 ARUCAHDZWZXRAW-SECBINFHSA-N 286.288 -0.305 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1CO 276826387 JVFSDVDUGJBCPW-BDAKNGLRSA-N 268.273 -0.122 5 20 CBBD Cc1c(NC(=O)C(=O)N(C)CC(N)=O)cccc1[N+](=O)[O-] 299060371 ZMJJNYNXBNZLLT-UHFFFAOYSA-N 294.267 -0.215 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CN(C)CCO2)n1 331150242 AMIVRDJPELNMKW-VIFPVBQESA-N 297.315 -0.128 5 20 CBBD Nc1nc(N2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)ncc1[N+](=O)[O-] 343507903 OIMSUYWIFQLIAN-POYBYMJQSA-N 299.312 -0.410 5 20 CBBD Nc1nc(NCc2nnnn2CC2CC2)ncc1[N+](=O)[O-] 351547920 NBDYZRWWPZRGOM-UHFFFAOYSA-N 291.275 -0.024 5 20 CBBD Nc1nc(N2CCN3C(=O)OC[C@@H]3C2)ncc1[N+](=O)[O-] 378163404 YVTLAFGJAOUXIO-LURJTMIESA-N 280.244 -0.392 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc([N+](=O)[O-])cc1O 447634541 RJIIFLKZXCKDNA-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD O=C1CNC(=O)N1CCNc1cccnc1[N+](=O)[O-] 609595586 OGNTTZDFNWDELA-UHFFFAOYSA-N 265.229 -0.047 5 20 CBBD O=C(O)Cc1nc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 739909323 GSSZYWXOXRXJFI-UHFFFAOYSA-N 295.215 -0.825 5 20 CBBD O=C(NS(=O)(=O)c1cnccn1)c1ccc([N+](=O)[O-])[nH]1 758579826 WHMMCRJWFKRFEG-UHFFFAOYSA-N 297.252 -0.168 5 20 CBBD NC(=O)NCC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 1123234760 AIDGMAHETFXTSL-UHFFFAOYSA-N 295.299 -0.531 5 20 CBBD COCC[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)C(N)=O 1325952927 YZDZHERIDAUARS-SSDOTTSWSA-N 294.271 -0.060 5 20 CBBD CC(C)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1327889288 QBVJZYZJDAHUIQ-MRVPVSSYSA-N 285.304 -0.409 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc(CC(=O)O)cc1[N+](=O)[O-] 1610143526 XUEUZDCUSQDVQF-JTQLQIEISA-N 297.267 -0.259 5 20 CBBD NC(=O)c1cnc(NC(=O)Cn2ccc([N+](=O)[O-])n2)s1 128333368 OOYSHUUUZPCUCL-UHFFFAOYSA-N 296.268 -0.015 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)CC(=O)N1CCOCC1 174856271 PWKRVVYHFZHRSC-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc(N)cc2[N+](=O)[O-])CCO1 283737015 INYHEZHATRQGFZ-JTQLQIEISA-N 266.257 -0.133 5 20 CBBD CCCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])nc1C 346917741 GRUJOQBUTWMMHM-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1C 352273742 PUHGUCFCZFOPEM-UHFFFAOYSA-N 265.233 -0.315 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)N1CCOCC1 356498561 QTMSVULXVQTENT-SECBINFHSA-N 297.315 -0.221 5 20 CBBD C[C@H]1CC(=O)NCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 375844327 VGJXQIKPKVDCND-ONGXEEELSA-N 297.315 -0.637 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 401912712 MOLCGTMVKWYEOU-XPUUQOCRSA-N 283.240 -0.170 5 20 CBBD CO[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 515197249 RATDBQOUIMPTMX-MRVPVSSYSA-N 269.213 -0.181 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C[C@@H]1O 560633299 CFMHABDKEYNWGI-UWVGGRQHSA-N 296.283 -0.558 5 20 CBBD CO[C@@H]1COC[C@@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 584360841 SYWGRTJTZPYOCN-JGVFFNPUSA-N 282.256 -0.284 5 20 CBBD C[C@H](C(=O)NC[C@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1F 597584358 FSBPWHKPUJNTNO-WKEGUHRASA-N 299.258 -0.200 5 20 CBBD Cc1nn(CCC(=O)N2C[C@H](O)[C@@H](O)C2)c(C)c1[N+](=O)[O-] 600217131 OZWDKAQFDYWVCI-UWVGGRQHSA-N 298.299 -0.638 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCN1CC[C@H](O)C1 600805877 AXPKQVFGTRVKNM-NSHDSACASA-N 297.315 -0.636 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCOCCO)c1 740089274 COITYDGTYKRSHS-UHFFFAOYSA-N 272.213 -0.536 5 20 CBBD NC(=O)Cn1cc(C(=O)Oc2cccc([N+](=O)[O-])c2)nn1 742498685 SAOFGHIHALQUAK-UHFFFAOYSA-N 291.223 -0.109 5 20 CBBD CC[C@@H](OC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 781668393 SIXQHMDBQJBCAE-SSDOTTSWSA-N 268.229 -0.007 5 20 CBBD NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840378247 CKYXTOAKPWOBBZ-LURQLKTLSA-N 255.274 -0.188 5 20 CBBD COCCCS(=O)(=O)N1CCN(CC[N+](=O)[O-])CC1 929859234 NUMXPVFLVKTUCP-UHFFFAOYSA-N 295.361 -0.753 5 20 CBBD CN(C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1)C1CC1 1117563964 ANNJXSIUCWJXIY-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCNC1=O 1324648728 GZFQSPMBTFKHLM-SSDOTTSWSA-N 279.256 -0.587 5 20 CBBD Cc1nn(C)c(C(=O)NCC(C)(C)C(N)=O)c1[N+](=O)[O-] 1337779003 JTZITRTZSWMIRR-UHFFFAOYSA-N 283.288 -0.122 5 20 CBBD CNS(=O)(=O)CC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1340035521 QXGWSXBUVCBZHX-UHFFFAOYSA-N 299.308 -0.014 5 20 CBBD C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1343706067 OPCVSQLFXTVPST-RXMQYKEDSA-N 256.218 -0.221 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCCCO)c1=O 1345185248 WTEGHNINRLGUEK-UHFFFAOYSA-N 255.230 -0.372 5 20 CBBD COCOCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1349812246 QEFQZSXDRWZBAN-UHFFFAOYSA-N 273.249 -0.687 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1nnnn1C 1514769296 ONNKORKHEJDQDC-RXMQYKEDSA-N 280.248 -0.657 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1C[C@H]2COC[C@@]2(C(=O)O)C1 1594557585 BRQLPBGMQNITEC-CPCISQLKSA-N 282.256 -0.134 5 20 CBBD C[C@](O)(CO)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603690273 DZZMIDZVLQFOKC-LLVKDONJSA-N 294.271 -0.070 5 20 CBBD O=C(O)C1=NO[C@H](Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1608590151 CIHPDGLTVZLXDQ-LURJTMIESA-N 267.197 -0.014 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC(C)(C)O 75746096 GCXZQCZBCAFYFG-JTQLQIEISA-N 272.305 -0.145 5 20 CBBD CC(C)N(CCn1cc([N+](=O)[O-])ccc1=O)CC(N)=O 90511900 UOPJBDXJSLWCEQ-UHFFFAOYSA-N 282.300 -0.048 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 230691877 XVYKSIVTXPGARL-ZCFIWIBFSA-N 279.256 -0.468 5 20 CBBD NC(=O)NC(=O)OCCCn1cc([N+](=O)[O-])ccc1=O 264999794 MAKQMQQMBQOVSF-UHFFFAOYSA-N 284.228 -0.049 5 20 CBBD C[C@@](O)(CO)CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1 343059114 AUGJEJDTMPHCTH-LBPRGKRZSA-N 294.267 0.399 5 20 CBBD O=C(N[C@@H](CO)[C@H]1CCCO1)c1cnc(O)c([N+](=O)[O-])c1 344820803 HSDURFKMQJOILA-WCBMZHEXSA-N 297.267 -0.035 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)CN1CSCC1=O 354387680 OHTLARXXRXXGGB-UHFFFAOYSA-N 285.285 -0.200 5 20 CBBD CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 359475598 APCHSFYWRFZRPF-MRVPVSSYSA-N 269.261 -0.432 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC(C)(C)c1nn[nH]n1 360755162 ONQGXRJWQRGYFD-UHFFFAOYSA-N 280.248 -0.494 5 20 CBBD COC(=O)C1(O)CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 370340535 KYOJNEBLKRFBKB-UHFFFAOYSA-N 297.271 -0.529 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1COCCN1 423723044 KZHZCQZLUCVCAE-SNVBAGLBSA-N 291.267 0.398 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[C@@H]1N 429186843 VNAYICGDEIVECD-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@H](O)[C@@H](N(C)C)C2)c1[N+](=O)[O-] 515497640 YCXWADPGOZFNJH-IUCAKERBSA-N 297.315 -0.373 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1COC[C@H]1O 552242291 IQARKFWBKJPKEJ-NXEZZACHSA-N 269.257 -0.235 5 20 CBBD CNc1nccc(C(=O)N2CC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 574582192 DSHWIEQFZFRKEK-SSDOTTSWSA-N 293.283 -0.021 5 20 CBBD COC[C@@H](O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 577744398 LSLAYBJYPZDCGN-ZETCQYMHSA-N 284.272 -0.301 5 20 CBBD COC[C@@](C)(O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594365581 VOIIQFVQHSFDDH-LBPRGKRZSA-N 298.299 0.089 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 600458991 BLKBEXIAUFMSQN-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD COCCN1CN(CCn2c([N+](=O)[O-])cnc2C)CC1=O 602822969 HWJVWPOXDPYEOT-UHFFFAOYSA-N 297.315 -0.152 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619260324 WUMLZBXPJOAICJ-MRVPVSSYSA-N 281.272 -0.086 5 20 CBBD NC(=O)CONC(=O)Cc1ccc([N+](=O)[O-])cc1 777823264 HJAVQXHASHMZIF-UHFFFAOYSA-N 253.214 -0.330 5 20 CBBD O=C(NCc1nnnn1-c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-] 823477446 CCBFLXFFNLWQGI-NXEZZACHSA-N 288.267 -0.056 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CCCOCC1 1116707066 SDZNFBCYJHANRK-UHFFFAOYSA-N 297.315 -0.220 5 20 CBBD Cc1noc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1157761699 YIQHZAAKKCSVFO-RKDXNWHRSA-N 283.288 -0.361 5 20 CBBD O=C1OCCN1CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1593423046 SPVFIVZFVCIFIU-UHFFFAOYSA-N 294.231 -0.576 5 20 CBBD O=C(O)Cn1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1595148143 CIXJVCZTKIDUDD-RNFRBKRXSA-N 254.202 -0.429 5 20 CBBD O=C(NC[C@H]1CCO[C@H]1C(=O)O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601525072 GDAQTUHUFFXPMW-WCTZXXKLSA-N 258.230 -0.743 5 20 CBBD C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1604190144 DCICSMDONAIAQP-LURJTMIESA-N 289.269 -0.011 5 20 CBBD C[C@](CO)(NCc1cccnc1[N+](=O)[O-])C(=O)O 1604196004 MWCYOBKPOINPRY-SNVBAGLBSA-N 255.230 -0.085 5 20 CBBD Cn1cc(CNC2(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)nn1 1754514230 VMZVDCYBADGBCZ-NXEZZACHSA-N 294.315 -0.781 5 20 CBBD Cn1c(C(=O)N[C@@H](CO)C(=O)O)ccc1[N+](=O)[O-] 20215160 VUOTWFQRZUCRCB-YFKPBYRVSA-N 257.202 -0.891 5 20 CBBD COC[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 78343327 RRYLZUNVOHLIOW-ZETCQYMHSA-N 269.261 -0.181 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@H](CO)O1 190111411 YBLLSBAKEAUGCJ-NXEZZACHSA-N 270.289 -0.127 5 20 CBBD COCCN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1=O 271069980 MCJNUBCGVUUJQZ-UHFFFAOYSA-N 296.287 -0.738 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc([N+](=O)[O-])ccc1N 276196619 DIRAQECKOAHPMD-QMMMGPOBSA-N 269.257 -0.398 5 20 CBBD Cn1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1C(N)=O 341508626 RSOZEYCSGGODTQ-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD COCCCN(CCO)c1nccc(C(N)=O)c1[N+](=O)[O-] 357683013 GHBIUHAOFKYKRP-UHFFFAOYSA-N 298.299 -0.076 5 20 CBBD CNS(=O)(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 365272904 MZGCBJOQBQPHJG-IWSPIJDZSA-N 291.329 -0.808 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 425071002 JFHTYODNKANUME-ZCFIWIBFSA-N 295.255 -0.795 5 20 CBBD C[C@H](O)CN(Cc1c([N+](=O)[O-])ncn1C)[C@H](C)CO 443343111 GAFQRMPZXFSYJR-BDAKNGLRSA-N 272.305 -0.108 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])cn2C)C1 545244300 FHTSQHQREQCCFB-UHFFFAOYSA-N 266.257 -0.249 5 20 CBBD CNc1nccc(C(=O)N2CC[C@@H](CO)C2)c1[N+](=O)[O-] 590444613 HNXHBTJMEMWJJF-MRVPVSSYSA-N 280.284 0.486 5 20 CBBD C[C@@]1(C(=O)O)CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 595250875 OKECSAZRNNRGBU-RDDDGLTNSA-N 297.271 -0.054 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1OCCCO1 716314622 SNEMKWWSTHAEGE-UHFFFAOYSA-N 270.245 -0.330 5 20 CBBD Cn1nccc1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 762490962 XWMOOEBURAVLGM-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD Cn1c(C(=O)NC[C@H]2CC(C(N)=O)=NO2)ccc1[N+](=O)[O-] 793905594 WDPARLSIMBZZNX-ZCFIWIBFSA-N 295.255 -0.707 5 20 CBBD COC(=O)C[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCOC1 840425180 WOWBNHQIZBPART-LNLATYFQSA-N 286.284 -0.120 5 20 CBBD O=C(NC1CN(CC2CCOCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293769 RSIRMLVXFYMJJU-VXGBXAGGSA-N 283.328 -0.121 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CN)C1CC1 1326260813 QYUDHKMAJGEDFL-SSDOTTSWSA-N 253.262 -0.205 5 20 CBBD O=C(COc1cccnc1[N+](=O)[O-])N1CCNCC1 1349112279 JLDVDKUJXGCCMQ-UHFFFAOYSA-N 266.257 -0.200 5 20 CBBD CCc1nn(C)c(N2CC(O)(C(=O)O)C2)c1[N+](=O)[O-] 1597718320 OSXQWQJKUMKHOC-UHFFFAOYSA-N 270.245 -0.474 5 20 CBBD COC[C@@H](Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)OC 1605054440 DIWPFCJITDURCR-ZCFIWIBFSA-N 283.248 -0.367 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 103968382 PRTNQMWHEXJDJX-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD Cc1nc(NCCS(N)(=O)=O)ccc1[N+](=O)[O-] 161524338 QVHWIFLJXOCMRE-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD N[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 178323257 GEINCBOFPVVOOY-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD COC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 179322224 BGZZLPXGADRUEM-UHFFFAOYSA-N 268.229 -0.387 5 20 CBBD CNC(=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 275139669 PELMSPNGCVZNMV-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 343990928 QZFBNEJWERTOQP-UHFFFAOYSA-N 269.217 -0.762 5 20 CBBD CN(C)c1noc(Cn2ncc([N+](=O)[O-])c2N)n1 351914004 YBXMSRYOYSLWPW-UHFFFAOYSA-N 253.222 -0.129 5 20 CBBD COC[C@H](C(N)=O)N(C)C(=O)c1cccc([N+](=O)[O-])c1N 354613164 WQGWINLLQVBZHH-SECBINFHSA-N 296.283 -0.251 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H]3CNC[C@H]3C2)c1[N+](=O)[O-] 359417008 QXMHYJNZJGKUEB-YUMQZZPRSA-N 265.273 -0.082 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1=O 559277146 ZBYNXUXHZFRDDG-ZETCQYMHSA-N 292.251 -0.336 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 592477204 SLURAZXATHXFNB-WCBMZHEXSA-N 283.288 -0.634 5 20 CBBD CCC1(O)CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 597631121 HJNSTTLZHYLCOQ-UHFFFAOYSA-N 254.246 -0.075 5 20 CBBD O=C(NCc1nn[nH]n1)c1cc(O)cc([N+](=O)[O-])c1 613950740 LLSKYGZTVHTSJP-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD Cn1[nH]c(COC(=O)c2cccc([N+](=O)[O-])c2N)nc1=O 765494071 AGZOCQLSVCUKAC-UHFFFAOYSA-N 293.239 -0.044 5 20 CBBD O=C(NN1CCCNC1=O)c1cc([N+](=O)[O-])c[nH]1 783599595 HAUWXWCQOOWYDB-UHFFFAOYSA-N 253.218 -0.017 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CCNC[C@@H]3C2)c1 923515454 GZXMORMLAOZIDT-DMDPSCGWSA-N 295.343 -0.307 5 20 CBBD NC(=O)C(=O)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 949967087 LQRDKRRHYFBMQO-UHFFFAOYSA-N 292.295 -0.276 5 20 CBBD Cc1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)ncn1 1030293556 OASZZPMBSRGOHB-VXGBXAGGSA-N 291.311 -0.249 5 20 CBBD CC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062988812 DEDFXCZRSMKJJM-RKDXNWHRSA-N 255.274 -0.173 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nn1cnnc1 1116499309 DQKPSKJQLIJIOK-UHFFFAOYSA-N 264.201 -0.882 5 20 CBBD CN1CCC[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1118883867 LOMPGJIJBCDULQ-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD Cc1nn(C)cc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936423 GZGKBUFUASTDKO-GHMZBOCLSA-N 281.316 -0.400 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(n3cncn3)C2)c1[N+](=O)[O-] 1318473553 IKLXHFZULVZRKT-UHFFFAOYSA-N 291.271 -0.075 5 20 CBBD Cc1nn(C)c(C(=O)N[C@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1319851770 XFSFEPOBZNHPMY-LLVKDONJSA-N 298.255 -0.390 5 20 CBBD COC(=O)NC1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 1321271282 RZSSDAJSMCAZDI-UHFFFAOYSA-N 283.244 -0.193 5 20 CBBD O=C(O)[C@@H]1[C@H]2CN(C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]21 1610803985 VZAXCJBXVLFWKL-UKKRHICBSA-N 296.283 -0.585 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 154312867 CCGNGDVLUGPHII-UHFFFAOYSA-N 297.315 -0.012 5 20 CBBD CNC(=O)CCCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 178987662 KYYNYZWTKKNOGC-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD C[C@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cnc1N 230697490 ILCCPLHGWVRGBL-RXMQYKEDSA-N 267.245 -0.434 5 20 CBBD CS(=O)(=O)c1cc(C(=O)NCCO)cc([N+](=O)[O-])c1 337036160 HMPFJSVDAWMLLF-UHFFFAOYSA-N 288.281 -0.280 5 20 CBBD COCCN1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1=O 338338433 LYCIPHWBYDDOOF-UHFFFAOYSA-N 296.283 -0.178 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](CO)O[C@H](C)C2)c1[N+](=O)[O-] 347508357 AWHOIOOKXPLYIY-SVRRBLITSA-N 284.272 -0.152 5 20 CBBD CC[C@H]1C(=O)NCCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 357516442 RBUZPTSKFVVLGJ-QMMMGPOBSA-N 293.283 -0.197 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 443037008 NATAQSVIVWLPNO-CAHLUQPWSA-N 267.245 -0.428 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)N1 538681763 HMOGARNYVIIQTB-VIFPVBQESA-N 282.231 -0.191 5 20 CBBD CNc1nccc(C(=O)N(CC(N)=O)C(C)C)c1[N+](=O)[O-] 563546546 DQTCFRUIQBCEGZ-UHFFFAOYSA-N 295.299 0.367 5 20 CBBD CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)[C@@H](CN)C1 578235912 JEYUXNAOKCTFFL-QMMMGPOBSA-N 282.304 -0.957 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CN(C)CCO1 839710091 VDHAICXCPLOMBS-JLIMGVALSA-N 257.290 -0.513 5 20 CBBD C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839729748 DNXSOASMPMWLQW-GMTAPVOTSA-N 285.344 -0.045 5 20 CBBD CCn1nncc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292703 SVELXLROSRWPQZ-GHMZBOCLSA-N 294.315 -0.736 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ncc([N+](=O)[O-])cc1F 1100706075 LTMNIPJHNTVRCF-UHFFFAOYSA-N 299.262 -0.443 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CC(=O)NC2CC2)c1[N+](=O)[O-] 1115891356 XRIVQCLEORNBNN-UHFFFAOYSA-N 295.299 -0.013 5 20 CBBD COCCCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1124089079 RZZKWPXMQRWJIN-UHFFFAOYSA-N 299.331 -0.039 5 20 CBBD Cc1oncc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936444 IEFRKHRDAURPGD-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@]2(O)CCN(C)C2)c1[N+](=O)[O-] 1321134966 CBFPSCRNUWPDSQ-GFCCVEGCSA-N 297.315 -0.567 5 20 CBBD CC(=O)N[C@H](C)C(=O)OCCn1cnc([N+](=O)[O-])n1 1343994088 QAQPOPROKGTCAK-ZCFIWIBFSA-N 271.233 -0.746 5 20 CBBD O=C(O)CN(C(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 50162293 HNNFYAPKWYTGDP-UHFFFAOYSA-N 268.229 -0.133 5 20 CBBD COC[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CCO1 172618253 BBBKCFWNRPMTQR-JTQLQIEISA-N 298.299 -0.026 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCNC1 178392253 CRBUHRYIRSHQPL-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD NC(=O)C1=NO[C@H](CNc2ncc([N+](=O)[O-])cn2)C1 276295303 QNBIRTIQZYNWON-LURJTMIESA-N 266.217 -0.573 5 20 CBBD COC[C@@](C)(NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)OC 285607412 IYVVLHJLLZSVBR-SNVBAGLBSA-N 286.244 -0.374 5 20 CBBD COCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])ccc1=O 312722059 IOTBAUZUTCFUJE-LLVKDONJSA-N 285.300 -0.304 5 20 CBBD CCc1ccc(C(=O)N[C@H](CO)C(N)=O)cc1[N+](=O)[O-] 352993925 TWDDIAXJJRDDIT-SECBINFHSA-N 281.268 -0.267 5 20 CBBD CN(C)CCOCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 354066893 XYOMBBUTOOKTSD-UHFFFAOYSA-N 270.293 -0.621 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356763185 HBCAWHVVJQIUIN-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@H](CN)C2)c1[N+](=O)[O-] 358510771 MENRVFNOKLZRSM-SSDOTTSWSA-N 269.261 -0.574 5 20 CBBD C[C@]1(C(N)=O)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1 360258112 NYSXUECOQRSISB-LBPRGKRZSA-N 293.283 -0.210 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 425067291 AJLXOYULPNPOJY-SSDOTTSWSA-N 295.255 -0.945 5 20 CBBD NC(=O)[C@]1(NC(=O)Cc2ccc([N+](=O)[O-])cc2)CCOC1 571299275 YOYJCPAOMBGZGK-ZDUSSCGKSA-N 293.279 -0.102 5 20 CBBD CN(C(=O)Cn1nnnc1CN)c1ccc([N+](=O)[O-])cc1 575121044 ZSYYWDIGMACAQR-UHFFFAOYSA-N 291.271 -0.297 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCCO1 578866757 VOAYTIKPDFRSNK-VIFPVBQESA-N 296.283 -0.115 5 20 CBBD NC[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCCO1 592983499 WCQDGCNPLBZSHH-LLVKDONJSA-N 269.305 -0.159 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])cn2)[C@H](CO)C1 601980237 SRTZGJQGENSGEG-VIFPVBQESA-N 253.262 -0.503 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 763695928 FFOXXJYSZBLUOT-QMMMGPOBSA-N 283.240 -0.863 5 20 CBBD O=C(O)NCCC(=O)OCCn1ccc([N+](=O)[O-])n1 832605459 XSHBEUWQHOUFEF-UHFFFAOYSA-N 272.217 -0.008 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2csnn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020138781 ADEKSCFIUWLPMS-KHUVANEUSA-N 297.340 -0.060 5 20 CBBD O=C(NC[C@H]1CCCS1(=O)=O)c1n[nH]cc1[N+](=O)[O-] 1117994376 LOYBGASPRMRKAZ-ZCFIWIBFSA-N 288.285 -0.375 5 20 CBBD COC[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1336736863 MTEPIDAUVJTRNN-MRVPVSSYSA-N 284.272 -0.184 5 20 CBBD CCOC[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)CCO1 1339541645 KPSNQMCSXQQDIL-VIFPVBQESA-N 285.304 -0.167 5 20 CBBD C[C@H](/C=C\C(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1592202266 SXRCBDUCIRTSQV-YAJNLLPGSA-N 295.251 -0.098 5 20 CBBD CNC(=O)[C@@H](O)CNc1cc(C(=O)O)ccc1[N+](=O)[O-] 1598632908 USRZPRIVMQNSMS-VIFPVBQESA-N 283.240 -0.188 5 20 CBBD Cn1c(C(=O)N[C@@]2(C(=O)O)CCOC2)ccc1[N+](=O)[O-] 85846726 SSLYAEIZYPDAAH-NSHDSACASA-N 283.240 -0.093 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 110517069 JSXIKKBJYODLDS-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 129988201 SXTUWEBTNJZEPT-SFYZADRCSA-N 283.288 -0.057 5 20 CBBD Cn1c(C(=O)NC[C@]2(O)CCOC2)ccc1[N+](=O)[O-] 229686154 XFZAGFVSAUWEIY-LLVKDONJSA-N 269.257 -0.186 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1nnc[nH]1 230685739 TZSPKIVHHIWPOR-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@@H](O)[C@H](O)C2)c1 236532320 HNMSJWOGLJXCLW-NXEZZACHSA-N 288.281 -0.679 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1CO 276856197 PWQRRTNFMOPMRO-BDAKNGLRSA-N 268.273 -0.122 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 281232307 PJRXTXKBHWNHNU-ZETCQYMHSA-N 270.245 -0.189 5 20 CBBD COC(=O)C[C@@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1 344868926 BCNLCSLJYFFRRR-NSHDSACASA-N 298.255 -0.230 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[C@H](CO)O1 349614904 KJAMVBXRBICCMR-VHSXEESVSA-N 284.272 -0.553 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 436974546 ZMWIAXCHCOMMEN-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)N1CCO 450789757 JNUNMFHTTZXUBT-DTORHVGOSA-N 296.331 -0.142 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)CO)CC1 538702497 QRYTUZFPQLOEST-UHFFFAOYSA-N 296.283 -0.790 5 20 CBBD O=C(O)c1ccnc(N2CC[C@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 569728655 UCIPTXWVNPEVJV-APPZFPTMSA-N 297.267 -0.133 5 20 CBBD Cc1ncc([N+](=O)[O-])n1[C@@H]1CCN(CC(=O)O)C1=O 596015250 ZPSAQMJZSZWPPO-SSDOTTSWSA-N 268.229 -0.042 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 600460517 VFQCNFNDOZJPPI-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD CNC(=O)[C@@H](O)CNc1ncc(C)cc1[N+](=O)[O-] 758127563 WODJXZUUEVTGME-QMMMGPOBSA-N 254.246 -0.183 5 20 CBBD COC[C@@H](NC(=O)N=c1cc[nH]cc1[N+](=O)[O-])C(N)=O 791848750 JRGXJGZKCVAEQQ-SSDOTTSWSA-N 283.244 -0.967 5 20 CBBD C[C@@H](CN)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 842782850 YUQJNHKYIGGARZ-LURJTMIESA-N 260.275 -0.385 5 20 CBBD COC(=O)[C@@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843085908 DXUBHNXTSYMHBN-MNOVXSKESA-N 284.268 -0.248 5 20 CBBD NC(=O)CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1 1107087500 FJKWMNIXDNAOTF-OWOJBTEDSA-N 293.283 -0.051 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1cnco1 1132030305 PHCDNZFXMKSQGH-UHFFFAOYSA-N 294.271 -0.164 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCNC1 1333274050 XHRXRGYDZWTQNU-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD CC(C)[C@H](NC(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)O 1591876654 ADAKASVGCISVDY-BHNWBGBOSA-N 288.256 -0.580 5 20 CBBD CCCCN(CC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 49227066 ALSXINOIYYQACD-UHFFFAOYSA-N 283.288 -0.095 5 20 CBBD CN[C@H](C)CNC(=O)CCn1cc([N+](=O)[O-])cn1 261739982 MJRDITHTZNPBQK-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H](C)O 274802232 SOVQBBPNVOTBNL-LDWIPMOCSA-N 298.251 -0.047 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1COC[C@H]1O 342394622 CWQNRCPVBUXWAG-JGVFFNPUSA-N 270.245 -0.991 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H](C)C(=O)NC)c1[N+](=O)[O-] 346811602 RYJUKDGSZZRPBX-RXMQYKEDSA-N 269.261 -0.255 5 20 CBBD COCCOC[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 358685052 SIFDKXRFBMXKER-SECBINFHSA-N 286.288 -0.041 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CCCN(C)C2=O)c1[N+](=O)[O-] 359601301 HPYJZTNFFILTTK-SSDOTTSWSA-N 281.272 -0.023 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H]1CN1CCOCC1 367972763 DXWLFOXXAMDUBC-QJPTWQEYSA-N 283.328 -0.025 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC(O)(C(F)F)C1 425014727 CUZCMAVOZKGMRX-UHFFFAOYSA-N 262.172 -0.230 5 20 CBBD CNc1nc(C(=O)N[C@@H]2COC[C@H]2O)ccc1[N+](=O)[O-] 456427240 AXUHDFUHILGGFI-VXNVDRBHSA-N 282.256 -0.479 5 20 CBBD CNc1nccc(C(=O)NC[C@H](O)C(F)F)c1[N+](=O)[O-] 568778042 LQDRYMHHRUHVGM-LURJTMIESA-N 290.226 0.387 5 20 CBBD CC[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 577288536 SCTJXAHUJRMBHS-QMMMGPOBSA-N 285.260 -0.046 5 20 CBBD NC(=O)c1ccc(N2CC[C@@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1 582519193 INZYYXOYEMIDTM-JOYOIKCWSA-N 295.295 -0.127 5 20 CBBD Cn1nnnc1COC(=O)Cn1ccc([N+](=O)[O-])n1 733454553 WDKYWYWWSLDKCY-UHFFFAOYSA-N 267.205 -0.942 5 20 CBBD CS(=O)(=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 741108972 LSZNXDSSVGRPPA-UHFFFAOYSA-N 262.247 -0.743 5 20 CBBD CS(=O)(=O)[C@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 799949860 ZDNOKFKTYFBPNC-VIFPVBQESA-N 274.302 -0.132 5 20 CBBD C[C@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CCNC1=O 853173514 PLSVVBKAOLQFHP-LLVKDONJSA-N 282.256 -0.139 5 20 CBBD CN(C)CCCOC(=O)Cn1cnc([N+](=O)[O-])n1 919678495 WKFCWZUTMMNJKG-UHFFFAOYSA-N 257.250 -0.319 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H](N2CC[C@H](O)C2)C1 1261818839 JDFYHPIHNGKGGK-IUCAKERBSA-N 295.299 -0.401 5 20 CBBD CC1(O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1 89644527 OXFQSHBGNCLYIC-UHFFFAOYSA-N 253.214 -0.510 5 20 CBBD CNC(=O)[C@@H](CO)Nc1ncc(C)cc1[N+](=O)[O-] 302803605 VLUPXGLJUHDBPP-SSDOTTSWSA-N 254.246 -0.183 5 20 CBBD CN1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1=O 330420755 CZZSMGCMTQMSPF-MRVPVSSYSA-N 295.299 -0.127 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CNC(=O)C1 330730186 HZDUDPLZALBMCO-QMMMGPOBSA-N 281.272 -0.505 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc2n(n1)CCO2 355159277 IIZWBOTZXKHDOG-UHFFFAOYSA-N 292.255 -0.190 5 20 CBBD Nc1c([N+](=O)[O-])ccc(N2CCN(C(=O)CO)CC2)c1F 356198379 ZSFQGUGKSAQCSG-UHFFFAOYSA-N 298.274 -0.043 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CC[C@H](CO)O2)c1[N+](=O)[O-] 356542885 GOLSUXUUIZOMMC-JGVFFNPUSA-N 284.272 -0.104 5 20 CBBD O=C(O)c1ccnc(NC[C@@H](O)CO)c1[N+](=O)[O-] 385867657 YBTAPFFWHPCGTQ-RXMQYKEDSA-N 257.202 -0.547 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563369811 QIPIFBKDSMPEOZ-LURJTMIESA-N 281.272 -0.174 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 576597094 HUTKHMAOGNWKJH-LURJTMIESA-N 295.255 -0.633 5 20 CBBD C[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCNC1 595993119 VVBQHPWOULLUDA-GFCCVEGCSA-N 280.284 -0.375 5 20 CBBD C[C@]1(NC(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 597430901 BCTCZBGNDHJZDB-NSHDSACASA-N 282.304 -0.158 5 20 CBBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 779103411 HUMIOXSRKSKSBE-SCSAIBSYSA-N 254.202 -0.397 5 20 CBBD NC(=O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 804789444 JJGMWCIJYXIUQQ-ZETCQYMHSA-N 270.201 -0.239 5 20 CBBD CC(C)(CCc1noc(CN2CCNCC2=O)n1)[N+](=O)[O-] 843233397 IYNUHWNHDROTGV-UHFFFAOYSA-N 297.315 -0.011 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 844114809 LGQZKGNXFFNEKK-BZNPZCIMSA-N 272.257 -0.966 5 20 CBBD CCCN1CC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2 1053253468 KXMFQTGDRIUUMA-GHMZBOCLSA-N 283.328 -0.025 5 20 CBBD Cn1ncnc1C[S@](=O)CCn1cc([N+](=O)[O-])cn1 1253351926 BUVBZXYBCBRXQO-LJQANCHMSA-N 284.301 -0.131 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@](F)(CO)C1 1256719414 IPTAVNNZOVFVBJ-SECBINFHSA-N 258.209 -0.136 5 20 CBBD Cc1nn(C)c(C(=O)N(C)C2[C@@H]3CNC[C@@H]23)c1[N+](=O)[O-] 1342027010 KHCZOYVIDXIFDX-HTQZYQBOSA-N 279.300 -0.073 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC1[C@H]2CNC[C@H]12 1579877224 DUPPLSOVMDBQPV-IUCAKERBSA-N 279.300 -0.319 5 20 CBBD COC[C@@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1591452784 UDEGRMYXRBVXOY-LURJTMIESA-N 295.259 -0.411 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(CC(=O)O)CC2)c1[N+](=O)[O-] 1599967682 AILIBXOTKXGDFB-UHFFFAOYSA-N 297.271 -0.531 5 20 CBBD O=C(NCC1(NCC(=O)N2CCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1754514064 OUZOIXVSAKZJNA-NXEZZACHSA-N 296.327 -0.878 5 20 CBBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)NC(N)=O 28856257 PXMKFUUGQWQQBK-RXMQYKEDSA-N 296.239 -0.083 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCN(CC(N)=O)CC2)n1 120671235 RHZZZBKEQBTDSX-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCN1 179180190 LBNFFWFBRZETRG-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD C[C@H]1C(=O)N(C)CCN1CCn1ccc([N+](=O)[O-])n1 186993294 DIPAVCPMDDDMTG-VIFPVBQESA-N 267.289 -0.046 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 227866393 CGZKIWPBFKJOOL-QMMMGPOBSA-N 253.214 -0.829 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)CN1 237614669 ACUVQDZZCZTGAN-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H](C)CN1 237615756 HJLYDTPTBZYAMO-YUMQZZPRSA-N 268.277 -0.605 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCN3CCC[C@H]3C2)c1 246818827 CCJMQDKFHNTXMF-WCQYABFASA-N 295.343 -0.068 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)O1 268430551 ZBYIVYYKXDPQFA-SVRRBLITSA-N 282.256 -0.314 5 20 CBBD Cc1c(CC(=O)NCC(=O)NCCO)cccc1[N+](=O)[O-] 269610564 LTCYZXBVNYYMDG-UHFFFAOYSA-N 295.295 -0.330 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@H]1O 342426070 FNWYXCRPXZBYTM-DTWKUNHWSA-N 270.245 -0.991 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCC[C@@H]1C(N)=O 347100094 UBVILAHTOKNOBW-SSDOTTSWSA-N 281.272 -0.192 5 20 CBBD CN1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(=O)N1 349664749 HYLCKSHRLYBCRU-VIFPVBQESA-N 293.283 -0.532 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCNC1 428655962 OAOMKZRVUWBEFO-SECBINFHSA-N 267.289 -0.032 5 20 CBBD Nc1nc(N[C@@H](CO)[C@@H]2CCCO2)ncc1[N+](=O)[O-] 447811228 NAJZZKHBUIIWFH-XPUUQOCRSA-N 269.261 -0.081 5 20 CBBD C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[S@@]1=O 558743467 OFINZPUZAQSAHG-DMWPKQFHSA-N 272.286 -0.089 5 20 CBBD C[C@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 576148297 XQOHJZGVECULID-NSHDSACASA-N 267.289 -0.093 5 20 CBBD O=C1C[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2)NC(=O)N1 590425001 CSVQRSVZDJIXGW-VIFPVBQESA-N 292.251 -0.191 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)c1n[nH]cc1[N+](=O)[O-] 611200410 UQIDRSVSFSKOTI-UHFFFAOYSA-N 269.261 -0.132 5 20 CBBD COC[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C(N)=O 760059369 DUATWZUGKUMKCO-VIFPVBQESA-N 285.231 -0.036 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@H](C)OC1=O 808202540 NYYAQSIBQGGBFW-XPUUQOCRSA-N 282.256 -0.080 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCn1cnccc1=O 816273677 SYXKBKFGTUQJAK-UHFFFAOYSA-N 293.239 -0.409 5 20 CBBD O=C(O)C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 833220074 QZGRLKZHBITHEE-VIFPVBQESA-N 284.272 -0.033 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@H]2COCO2)c1[N+](=O)[O-] 861969075 KRJXPRCSXQPDFQ-LURJTMIESA-N 270.245 -0.017 5 20 CBBD O=C(N[C@@H](CO)C1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1321549816 FLOTXKNDPUMETP-QMMMGPOBSA-N 284.272 -0.165 5 20 CBBD CN(Cc1nncn1C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1322942961 RAGTUFOTTQJLRU-SNVBAGLBSA-N 295.303 -0.587 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 1339096623 XCLSQCGRRKAAEV-RKDXNWHRSA-N 298.299 -0.548 5 20 CBBD C[C@](CO)(NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)O 1592745411 ULDRWEOHMZMDPF-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD CC1(C(=O)O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1593807544 DQYJZUUTMJUTEN-UHFFFAOYSA-N 254.202 -0.135 5 20 CBBD O=C(NCCN1CCOCC1)c1cc([N+](=O)[O-])c[nH]1 52893619 ASPZVNXAWAMBER-UHFFFAOYSA-N 268.273 -0.015 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(F)(F)CO 183895759 AXRKEMJXLLANCC-UHFFFAOYSA-N 264.188 -0.465 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1OC 227049362 WUWGASCEFNYFMQ-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1OC 227049370 WUWGASCEFNYFMQ-SECBINFHSA-N 298.251 -0.133 5 20 CBBD O=C1CN2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]2CN1 229121883 FTALNKRFRAKBBG-VIFPVBQESA-N 290.235 -0.138 5 20 CBBD NC(=O)C[C@H](N)C(=O)NCCNc1ccccc1[N+](=O)[O-] 269585784 CGLIHFPXEUKTCL-QMMMGPOBSA-N 295.299 -0.674 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 284898721 GZNIRLIHAKOLSY-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD CCc1nn(C)c(NC[C@@H]2CC(C(N)=O)=NO2)c1[N+](=O)[O-] 289774395 WMOWLJQWNBSLFG-LURJTMIESA-N 296.287 -0.067 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCc1ccc(C(=O)O)o1 347404850 BMGYSQVQWSDEDS-UHFFFAOYSA-N 295.211 -0.206 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)c1cc([N+](=O)[O-])n[nH]1 353584236 FRTTUXPRZCACSL-RQJHMYQMSA-N 279.256 -0.189 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1CO 360857142 PWQRRTNFMOPMRO-DTWKUNHWSA-N 268.273 -0.122 5 20 CBBD COC(=O)C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 549202416 MQXGKVLECHTLSU-SSDOTTSWSA-N 298.255 -0.278 5 20 CBBD Cc1[nH]nc(C(=O)NCCNc2ccn(C)n2)c1[N+](=O)[O-] 572430216 FLANLDQPXPHLFZ-UHFFFAOYSA-N 293.287 0.202 5 20 CBBD Cc1noc(CN(C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 594054035 TVANFYOCUSVBMA-SNVBAGLBSA-N 296.287 -0.024 5 20 CBBD CNC(=O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCC1 610874591 QLVIPBLCCBHYEK-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD COCCS(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])n1C 732520728 KUQRALPLSKLHRM-UHFFFAOYSA-N 291.285 -0.361 5 20 CBBD Cc1nn(C)c(NCC(=O)N2CCN(C)CC2)c1[N+](=O)[O-] 734140819 BRCJNFPZNNJJQG-UHFFFAOYSA-N 296.331 -0.177 5 20 CBBD C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C(N)=O)C1 840425526 AOBOFLQREYNIGG-FNCVBFRFSA-N 255.274 -0.236 5 20 CBBD O=C(c1ccon1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010478121 LLQKDFHMRJGHFQ-PSASIEDQSA-N 294.267 -0.376 5 20 CBBD O=C(NC[C@H]1COCCO1)c1c[nH]nc1[N+](=O)[O-] 1116932295 MJKBDGFMEYRLSR-LURJTMIESA-N 256.218 -0.537 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1117951445 NGEQZSBWCZEGBM-RXMQYKEDSA-N 253.218 -0.735 5 20 CBBD NC(=O)C[C@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1318872568 OBDNEVVRRPWWRB-SECBINFHSA-N 295.299 -0.095 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@H]2C[C@@]2(CO)C1 1320882361 SXMZCTGAFWPCIH-LDWIPMOCSA-N 252.230 -0.228 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1CCNCC1 1332402967 ZFRWRFBSUZEOJO-UHFFFAOYSA-N 280.284 -0.375 5 20 CBBD Cc1c(NC(=O)C(=O)NCCO)cccc1[N+](=O)[O-] 128101078 VGPUTYQQAGNMHU-UHFFFAOYSA-N 267.241 -0.050 5 20 CBBD CC(=O)NC[C@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 172169125 XPKNMKPKHSVSDE-JTQLQIEISA-N 283.288 -0.414 5 20 CBBD C[C@@H]1CCNC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 186761173 WRQPJKCGNZPVNQ-KOLCDFICSA-N 294.311 -0.129 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228754490 QQKUZKDFJNLSKF-LLVKDONJSA-N 285.304 -0.780 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285817223 GPWVMDZOBSJADD-MRVPVSSYSA-N 282.304 -0.707 5 20 CBBD O=C(NC[C@H](O)C1CCOCC1)c1cc([N+](=O)[O-])[nH]n1 286702670 HSYWIZKZYPVIFE-VIFPVBQESA-N 284.272 -0.165 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1O)OC 295238222 DHFIQKLIYHZEEK-MRVPVSSYSA-N 299.239 -0.387 5 20 CBBD NS(=O)(=O)[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 339848974 YYNRHDLYMIGLNJ-QMMMGPOBSA-N 289.317 -0.846 5 20 CBBD CCN(CCOCCO)C(=O)c1cc([N+](=O)[O-])n[nH]1 355837950 QBIOLMLXHKMYFT-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C[C@@H]1COCCO1 598181562 MQKABVFZQZRYML-SNVBAGLBSA-N 298.299 -0.026 5 20 CBBD N[C@@]12CCC[C@@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 598670288 TVCFVRWCSLEROW-LDYMZIIASA-N 280.288 -0.474 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O 600241193 KUPKPOHAXKWUQM-APPZFPTMSA-N 295.251 -0.639 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC(=O)N1CCC1 746966712 DDIGCDSZMLDHFZ-UHFFFAOYSA-N 268.229 -0.433 5 20 CBBD CNC(=O)C1(C(=O)OCCn2ccc([N+](=O)[O-])n2)CC1 748125149 NWRDICJPDYATNE-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD CCOCC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 777044784 SUQPIPRXGVFTEX-UHFFFAOYSA-N 271.229 -0.060 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CN(C)CCO1 839710095 VDHAICXCPLOMBS-KYXWUPHJSA-N 257.290 -0.513 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)S1(=O)=O 839773973 KLSQWFGOBAGHDB-BZNPZCIMSA-N 276.314 -0.314 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NS(=O)(=O)CC(F)F 851360782 ZLWPVZDUTLLOTB-UHFFFAOYSA-N 298.227 -0.498 5 20 CBBD Cn1c(C(=O)NCCS(C)(=O)=O)ccc1[N+](=O)[O-] 918069665 BXFJLVAVAVGDEV-UHFFFAOYSA-N 275.286 -0.292 5 20 CBBD Cc1cc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n[nH]1 990364896 RIBTYMLLGLWDGM-PSASIEDQSA-N 293.283 -0.676 5 20 CBBD Nc1nc(NCCNC(=O)c2cnco2)ncc1[N+](=O)[O-] 1094019819 ZDCGJPADZNLFOP-UHFFFAOYSA-N 293.243 -0.203 5 20 CBBD CCCN(CCO)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1254144514 DYLZVMWVUFGTTP-UHFFFAOYSA-N 283.284 -0.013 5 20 CBBD NC(=O)CN1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 1318765450 FQFLWOHUSVNPKA-QMMMGPOBSA-N 295.299 -0.398 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nncn1C 1323879328 BDVKPETVAUCEDT-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD C[C@@H]1OCC[C@@]12CN(c1nnc(C[N+](=O)[O-])n1C)CCO2 1339667310 SUPKLNRYPAWFBC-JOYOIKCWSA-N 297.315 -0.024 5 20 CBBD CC1(CNC(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 1342619663 RDDQLQJTEMQODL-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H](CO)C(=O)O 1601329754 OOLHJTSLHMJFPD-QMMMGPOBSA-N 283.240 -0.432 5 20 CBBD NC(=O)c1cc(N2CC(O)(C(=O)O)C2)ccc1[N+](=O)[O-] 1608241375 KJEPXSMNEZPRLA-UHFFFAOYSA-N 281.224 -0.671 5 20 CBBD C[C@@H]1[C@@H](C(=O)O)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1609835957 UBQSFYMLSBGUNH-RQJHMYQMSA-N 283.244 -0.492 5 20 CBBD CCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 7020456 OSOYOXIWNQTLAX-UHFFFAOYSA-N 282.256 -0.991 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C[C@@H](C)O 177408575 VVOJPVPBKLBHCE-SSDOTTSWSA-N 256.262 -0.061 5 20 CBBD C[C@H]1CCNC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 186820312 BUCRDJPIUVKGFK-IUCAKERBSA-N 267.289 -0.095 5 20 CBBD C[C@H]1C[C@H](CN)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 261691224 INVLLAOXZOCQJC-DTWKUNHWSA-N 267.289 -0.013 5 20 CBBD COCCCONC(=O)Cn1ccc([N+](=O)[O-])n1 287843510 OHLVKPWPUOSCQK-UHFFFAOYSA-N 258.234 -0.124 5 20 CBBD CCn1nncc1C(=O)NCCn1cc([N+](=O)[O-])cn1 293850788 YUEMBVUINHKGJL-UHFFFAOYSA-N 279.260 -0.167 5 20 CBBD CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 299014421 VWRBKFKZYNEHCE-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD Cn1c(C(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1[N+](=O)[O-] 330544963 YMGHWLACJXEUEP-SSDOTTSWSA-N 287.297 -0.150 5 20 CBBD C[C@@H](CNCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 578619176 DBBKHRNPKBIRQR-QMMMGPOBSA-N 276.318 -0.186 5 20 CBBD Nc1nc(SCC2(CO)COC2)ncc1[N+](=O)[O-] 580571607 BFBIYNKZHSBCEH-UHFFFAOYSA-N 272.286 0.068 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1[C@H]2CC[C@H]1CNC2 597433978 XAYIYUAUGAVHIS-UWVGGRQHSA-N 294.315 -0.063 5 20 CBBD COc1cnccc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 597612533 YWYJAUSWAWLJQV-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD CN(C)C[C@H](CO)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 597652403 AZWZCKLFESDQBW-SECBINFHSA-N 299.331 -0.435 5 20 CBBD NC(=O)[C@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CCO1 611525716 SHBIOKQBAVULFD-SNVBAGLBSA-N 296.283 -0.640 5 20 CBBD O=C(OCC(=O)N1CCOCC1)c1ccc([N+](=O)[O-])[nH]1 729915406 MSGODJYVWBHJHH-UHFFFAOYSA-N 283.240 -0.062 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NS(=O)(=O)c1cc[nH]n1 796871885 DQPFRDIVACIWHP-UHFFFAOYSA-N 299.268 -0.225 5 20 CBBD C[C@H]1[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 806071945 CLZUEGCPGJTRDX-CBAPKCEASA-N 282.256 -0.046 5 20 CBBD CC(C)(CC(=O)O)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 826538448 RPBNIOWMQNGOSQ-SECBINFHSA-N 286.288 -0.005 5 20 CBBD CCCN(CC(=O)N(C)C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839714383 DJTXXXBKUDRYIH-RKDXNWHRSA-N 257.290 -0.022 5 20 CBBD NC(=O)C1=NO[C@@H](CNc2ccnc(O)c2[N+](=O)[O-])C1 853512851 NTEPQKKZMYLRTO-RXMQYKEDSA-N 281.228 -0.263 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21)C(F)F 976010137 BAVGOTPUHITGBU-CBQIKETKSA-N 289.238 -0.510 5 20 CBBD O=C(NC1CN(C(=O)c2ccsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991287222 QGKWZXMNWUJBST-VXNVDRBHSA-N 296.308 -0.251 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(C)OCCO1 1116442336 ROCMBTZNFQMTPL-UHFFFAOYSA-N 270.245 -0.179 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2 1580009699 YFHQXCUBROFUSF-CSMHCCOUSA-N 265.273 -0.049 5 20 CBBD O=C(O)C(=O)Cn1nc([N+](=O)[O-])nc1Br 1605881710 VWRDSENCCQDPEG-UHFFFAOYSA-N 279.006 -0.398 5 20 CBBD CCNS(=O)(=O)CCNc1c([N+](=O)[O-])ncn1C 68704675 XONCQXNIVAPPJL-UHFFFAOYSA-N 277.306 -0.321 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1CCN(C)C1=O 265691001 YASJIOZOFNFSIH-VIFPVBQESA-N 295.299 -0.211 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@H](CO)O1 299962556 LESXYHMDAANYGA-IONNQARKSA-N 254.246 -0.029 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNc2ncc([N+](=O)[O-])cn2)O1 302241168 XUQRBQGBHJZFHL-SFYZADRCSA-N 267.245 -0.170 5 20 CBBD CNC(=O)N[C@@H]1CCN(c2c([N+](=O)[O-])ncn2C)C1 341544248 JCOXCQWPWOPOBU-SSDOTTSWSA-N 268.277 -0.164 5 20 CBBD COC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])nn2C)CCOC1 359477471 BAEGIPQADJFSCN-NSHDSACASA-N 298.255 -0.610 5 20 CBBD Cc1c(CNC(=O)[C@@H](CO)NC(N)=O)cccc1[N+](=O)[O-] 360523674 BDBKERGVQZSDSF-SECBINFHSA-N 296.283 -0.451 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 362410230 JHWJTFJBSPQCKI-NSHDSACASA-N 299.239 -0.651 5 20 CBBD CN1C[C@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)OC1=O 496599427 INJXZMQEOKSWKG-SSDOTTSWSA-N 284.228 -0.215 5 20 CBBD CCN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 543591081 COPHISKHTAMGII-UHFFFAOYSA-N 281.272 -0.367 5 20 CBBD CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)[C@H](CN)C1 569972491 ZBWAYPBCRSQEKJ-SECBINFHSA-N 293.327 -0.108 5 20 CBBD Cn1nnnc1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1 588011840 XFEHGVMJAWPEPO-UHFFFAOYSA-N 293.287 -0.153 5 20 CBBD CCN1C[C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 593826002 QNKSRXZOBIMBCQ-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C[C@H]1COCCO1 598181551 MQKABVFZQZRYML-JTQLQIEISA-N 298.299 -0.026 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H](CO)[C@H](CO)C1 704475470 WQROIRXGGCOGBN-YUMQZZPRSA-N 269.257 -0.404 5 20 CBBD CNC(=O)c1ccc(N[C@H](COC)C(N)=O)c([N+](=O)[O-])c1 758304181 YISMDMZEMDVFNS-SECBINFHSA-N 296.283 -0.133 5 20 CBBD CNC(=O)NCCC(=O)OCCn1ccc([N+](=O)[O-])n1 795638945 BQGXSUZFOUDZBU-UHFFFAOYSA-N 285.260 -0.346 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)c1cn(C)c(=O)nc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n1ncc([N+](=O)[O-])c1C(=O)N1CC(CC(N)=O)C1 1256360791 KZTSVXDFFSNCQV-UHFFFAOYSA-N 267.245 -0.724 5 20 CBBD CNC(=O)[C@H](CO)NC[C@@H](O)c1cccc([N+](=O)[O-])c1 1326503826 WDZAYSNVSMJLRD-WDEREUQCSA-N 283.284 -0.675 5 20 CBBD CC1(C(=O)O)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1604501760 BLOBZTFLIJRJKB-UHFFFAOYSA-N 295.251 -0.310 5 20 CBBD CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 37564758 WIKRYONFYMKOME-UHFFFAOYSA-N 269.213 -0.424 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1 59514668 PWKXFVIJGDQSPJ-UHFFFAOYSA-N 252.230 -0.495 5 20 CBBD N[C@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 157741483 SWIXFCVWTUMONO-QMMMGPOBSA-N 253.262 -0.259 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 227868809 IXLKERXWLSASAT-MRVPVSSYSA-N 253.214 -0.829 5 20 CBBD O=C(O)CS(=O)(=O)CCn1cc([N+](=O)[O-])cn1 310359952 JRGUTRBLEZMZAC-UHFFFAOYSA-N 263.231 -0.709 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 341735605 KAJREKRQJANWKS-QMMMGPOBSA-N 292.251 -0.348 5 20 CBBD CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1COC[C@@H]1O 343616901 AUJQWGDKYJKUBR-MNOVXSKESA-N 281.268 -0.110 5 20 CBBD Cn1c(C(=O)NCCC(=O)NC(N)=O)ccc1[N+](=O)[O-] 343693868 ABUBWOQBCWORMB-UHFFFAOYSA-N 283.244 -0.752 5 20 CBBD CC1(C)COC(=O)[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 846652396 OVWXLPLPFNMJEK-LURJTMIESA-N 268.229 -0.001 5 20 CBBD O=[N+]([O-])CCNCCCN1CCN(c2ncccn2)CC1 905040521 MRNKIOJVOAIJRB-UHFFFAOYSA-N 294.359 -0.145 5 20 CBBD O=C(NC[C@H]1C[C@H](NCc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1086363224 IGXCDQWHMJWEAS-YJFSRANCSA-N 295.299 -0.281 5 20 CBBD CC(C)n1ncnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932170 KFEAHYHRAFKIMN-NXEZZACHSA-N 296.331 -0.270 5 20 CBBD CC(=O)NC[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1339549805 UDUOUAMVYPCBPG-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD CO[C@H](C(=O)O)C(=O)Nc1c([N+](=O)[O-])ncn1C 1593910873 CLNITYZWJQQRKN-BYPYZUCNSA-N 258.190 -0.634 5 20 CBBD O=C(O)[C@@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 1601851485 XBOWPYOZZZKSRN-VIFPVBQESA-N 282.256 -0.188 5 20 CBBD N[C@H]1C[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 36263981 XLALOFDZCLCXBP-BQBZGAKWSA-N 257.271 -0.027 5 20 CBBD O=[N+]([O-])c1nn(C[C@@H](O)CO)cc1Br 112798537 IPULSTZNRYGZBW-SCSAIBSYSA-N 266.051 -0.093 5 20 CBBD Cc1ccnc(NCC(=O)NCCO)c1[N+](=O)[O-] 268361185 WVWFYTDDARJKIS-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1c(N)cccc1[N+](=O)[O-] 273880455 QKCHGJYSGUEOMB-ZETCQYMHSA-N 269.257 -0.398 5 20 CBBD CC1(C)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 279690729 GBSAQVXVZXYOPY-QWRGUYRKSA-N 284.316 -0.145 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1ncnn1C 285539178 BSKQIBOOBVQKDX-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD O=C(CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)NCCO 343111829 OOAWFDSEVNYGSG-UHFFFAOYSA-N 285.231 -0.428 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCN([C@@H]2CCNC2)CC1 352495764 ONMSLSOQNNICLO-LLVKDONJSA-N 294.359 -0.192 5 20 CBBD CCn1cc(S(=O)(=O)NCC(C)(C)N)c([N+](=O)[O-])n1 353459423 TXQNQGCXSMRGLO-UHFFFAOYSA-N 291.333 -0.173 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])cnc2O)C1 358427196 VJFFTIBGWHCPTQ-LBPRGKRZSA-N 296.283 -0.508 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@H](O)C[C@H]1CO 371525403 MNNGAMLPEFDMCR-VHSXEESVSA-N 295.295 -0.039 5 20 CBBD CCOC(=O)N1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 496785516 NKPUOYTVGFBNAQ-IWSPIJDZSA-N 271.273 -0.001 5 20 CBBD CC(=O)NCCN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 520411427 WBZWPLHOANXOFM-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 593816254 VMTNEQKFGAWZDB-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD CCS(=O)(=O)C1CN(CCn2ccc([N+](=O)[O-])n2)C1 595519401 OVBVYEXKYVUGDK-UHFFFAOYSA-N 288.329 -0.090 5 20 CBBD CN(C[C@H]1COCCO1)c1nccc(C(N)=O)c1[N+](=O)[O-] 596457315 MBWNQBYRZIDVON-QMMMGPOBSA-N 296.283 -0.060 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cccc(O)c1[N+](=O)[O-] 600240333 FTACHEPKCPPSLP-SVRRBLITSA-N 295.251 -0.639 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCCOCCO 740237919 KGNVZRHQWMTLKS-UHFFFAOYSA-N 273.245 -0.267 5 20 CBBD CNC(=O)[C@@H](O)CNc1nc(C)ccc1[N+](=O)[O-] 758115767 WQCWKDAXGIGEMX-QMMMGPOBSA-N 254.246 -0.183 5 20 CBBD CCS(=O)(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 802910884 CNZMTHUBKTUNRI-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD O=C(O)C[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 833207281 CPFGGNIYGFYZTD-ZETCQYMHSA-N 283.244 -0.348 5 20 CBBD C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839686138 LEVBBTKQBUVKIH-JQCXWYLXSA-N 276.314 -0.314 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](N2CC[C@H](O)C2)C1 861720315 XVDNSIFNMFJXHP-LMLFDSFASA-N 269.301 -0.681 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@@H](O)C[C@H]1CO 886094303 PAJKXEKDAISWMK-UWVGGRQHSA-N 253.258 -0.083 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2csnn2)C1 1042705444 RAXIBSYVMSDMIX-NXEZZACHSA-N 297.340 -0.154 5 20 CBBD NC(=O)CN1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)C1 1318463211 YMOLDHXHMCHLNY-MRVPVSSYSA-N 296.283 -0.133 5 20 CBBD Cc1nn(C)c(-n2cnnc2[S@](C)=O)c1[N+](=O)[O-] 1318846810 FYGQXGBXUMUNIN-SFHVURJKSA-N 270.274 -0.045 5 20 CBBD O=[N+]([O-])c1ccnn1CCS(=O)(=O)N1CCNCC1 1574441318 SJXKLRXELHZBOQ-UHFFFAOYSA-N 289.317 -0.974 5 20 CBBD CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C(=O)O)C1 1606234533 MYXNCDXEAYVEOR-DJLDLDEBSA-N 271.273 -0.874 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(C(=O)O)n1)NC[C@H]1CCCO1 1608377035 KKJVBJYLSVEIKZ-SSDOTTSWSA-N 298.255 -0.215 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(C(=O)O)n1)NC[C@@H]1CCCO1 1608377037 KKJVBJYLSVEIKZ-ZETCQYMHSA-N 298.255 -0.215 5 20 CBBD COC[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 10452403 CLCGXPBDSPXASL-MRVPVSSYSA-N 269.257 -0.092 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1cc[nH]n1 40445025 YJRRROUNIXLSTA-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@](F)(C(=O)O)C1 262201286 QXUIJTGAAORFBB-SNVBAGLBSA-N 286.219 -0.184 5 20 CBBD Cc1nc(N2CCN(CC(N)=O)CC2)ccc1[N+](=O)[O-] 268455358 GUIUKJKSYLBDGT-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)CC(N)=O 302746610 SIJSLSXJNLBROC-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD CCCNC(=O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343227887 SMTSLFTZEDMECJ-UHFFFAOYSA-N 269.261 -0.036 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 352984705 FXVQPOLQBDHLJA-MRVPVSSYSA-N 292.251 -0.348 5 20 CBBD CN1CCO[C@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@H]21 355503142 FIBCMEMENGXPCT-ZJUUUORDSA-N 295.299 -0.517 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN=c1cc[nH]cc1 361361139 CBDDWZBTFOHEDA-UHFFFAOYSA-N 290.283 -0.013 5 20 CBBD NC(=O)c1cccc(N2CCN(CCO)CC2)c1[N+](=O)[O-] 439133615 METKWOIWFISBGG-UHFFFAOYSA-N 294.311 -0.192 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC(N)C1 581012316 DEEDAVCYTOOOJY-UHFFFAOYSA-N 254.250 -0.866 5 20 CBBD CN1CCOC[C@@H]1C(=O)Nc1c([N+](=O)[O-])cnn1C 591715388 HEERTLRZQJBNHM-MRVPVSSYSA-N 269.261 -0.403 5 20 CBBD C[C@@H](CN)N(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 592369376 UIWLJWHJIITMRP-ZETCQYMHSA-N 274.302 -0.043 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)CCF 593860859 AHKPTMNUAJUHPA-ZETCQYMHSA-N 260.225 -0.372 5 20 CBBD CNC(=O)COC(=O)CCn1cc([N+](=O)[O-])cn1 746596357 NHEHWBVRSWEFJJ-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NO[C@@H]1CCCCO1 749619199 UOFJPLUSTHXGOM-MRVPVSSYSA-N 271.233 -0.239 5 20 CBBD CNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N 786702107 GXXCTHJYFGUQEQ-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839717352 MCHINWCUAKUTPY-HTQZYQBOSA-N 258.278 -0.619 5 20 CBBD CCONC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 846661172 CTYOIQXHZNAHBJ-UHFFFAOYSA-N 284.228 -0.507 5 20 CBBD O=C(O)C1(O)CCN(c2ncc([N+](=O)[O-])cn2)CC1 1118283545 AYUKZHUHZYSXRW-UHFFFAOYSA-N 268.229 -0.199 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCS(=O)(=O)CC1 1318214368 WSYJOJIKVSFIRC-UHFFFAOYSA-N 260.275 -0.437 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC1(O)CCC1 1324266392 KMCFDSZMRLWOAD-UHFFFAOYSA-N 281.268 -0.212 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1(C(N)=O)CC1 1332491828 BWPJPYQPEFORMP-UHFFFAOYSA-N 267.245 -0.766 5 20 CBBD C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)C(=O)O 1604398600 TZTRAKRYMQNHQO-ZCFIWIBFSA-N 285.212 -0.233 5 20 CBBD C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 57929288 VQTKHKHJWINHDU-ZETCQYMHSA-N 294.267 -0.685 5 20 CBBD COC[C@@](C)(NCCn1ccc([N+](=O)[O-])n1)C(=O)OC 182597043 WTVHHXMQLJDEMJ-LLVKDONJSA-N 286.288 -0.041 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)O 262315052 UGAAZIWALMYGBJ-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 267200919 JRZPQFWMOZDHLY-QMMMGPOBSA-N 283.288 -0.368 5 20 CBBD CC(=O)N1CCN(C(=O)Cn2cc([N+](=O)[O-])c(C)n2)CC1 273058743 AYJXNAMFTHHTLQ-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD COCCN(CC(=O)OC)C(=O)c1cc([N+](=O)[O-])[nH]n1 285484280 IJAYSXRWBXWLGJ-UHFFFAOYSA-N 286.244 -0.421 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1CO 331261026 BOPFPFCHEUYQRI-HTQZYQBOSA-N 269.261 -0.584 5 20 CBBD COC(=O)CCCN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 343009420 RJIIQHVGMKPFNQ-UHFFFAOYSA-N 285.260 -0.402 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@H](NC(N)=O)C2)c1[N+](=O)[O-] 343067548 BNBFIVBWHIQHEO-LURJTMIESA-N 296.287 -0.237 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCCO)cc([N+](=O)[O-])c1 343111553 KLCLVLADPPQPGA-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNCC2)c1[N+](=O)[O-] 353084080 DYZXSEYUJWFIDD-UHFFFAOYSA-N 253.262 -0.318 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCn1cccn1 354446906 NZTYIQRCIKOFQR-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD COC(=O)[C@@H]1CC[C@H](C(=O)Nc2c([N+](=O)[O-])cnn2C)O1 362165410 FGHMYELFNZXZQJ-SFYZADRCSA-N 298.255 -0.013 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1N 429180351 XRNFMRHYRZHQMX-GXSJLCMTSA-N 294.311 -0.048 5 20 CBBD Cn1cnn(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1=O 570614781 GFNBPRQLSAXKAI-SNVBAGLBSA-N 294.267 -0.070 5 20 CBBD CN(CC(=O)N1CCOCC1)c1ccnc(O)c1[N+](=O)[O-] 596056211 ZNMUINDDRLSHIL-UHFFFAOYSA-N 296.283 -0.010 5 20 CBBD COCCN(C)C[C@@H](O)Cn1ccnc1[N+](=O)[O-] 601966314 ZFMMKLDKFPKXCQ-SECBINFHSA-N 258.278 -0.270 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCNC(=O)[C@H]1C 602772466 KEBXUHBBJUNCOG-MRVPVSSYSA-N 267.289 -0.080 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCCN(CCO)C1=O 613701487 YTKZTCCLIVDELT-MRVPVSSYSA-N 283.288 -0.277 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1c(F)cccc1[N+](=O)[O-] 714027974 BGGXWLCWOBOWAP-ZCFIWIBFSA-N 272.188 -0.091 5 20 CBBD C[C@@H]1[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 806071944 CLZUEGCPGJTRDX-APPZFPTMSA-N 282.256 -0.046 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 814042337 ICUBQVLYPVNRRS-KRTXAFLBSA-N 299.283 -0.085 5 20 CBBD CON(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 817663617 RDFWPLJELVZKCQ-UHFFFAOYSA-N 256.218 -0.328 5 20 CBBD CCNC(=O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 825470613 FILFQUWCUBJPQX-UHFFFAOYSA-N 292.259 -0.282 5 20 CBBD C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C(N)=O)C1 840425528 AOBOFLQREYNIGG-KDXUFGMBSA-N 255.274 -0.236 5 20 CBBD COC(=O)[C@@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 843085909 DXUBHNXTSYMHBN-QWRGUYRKSA-N 284.268 -0.248 5 20 CBBD O=C(N[C@H]1CCn2cncc2C1)[C@@H]1C[C@H]1[N+](=O)[O-] 857942553 XOMQDDROJOOKLK-FXBDTBDDSA-N 250.258 -0.021 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2C[C@@H]3CCNC[C@@H]3C2)c1 923515455 GZXMORMLAOZIDT-LOWVWBTDSA-N 295.343 -0.307 5 20 CBBD COC(=O)[C@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345222 KJUFOXUDORKJLS-MRVPVSSYSA-N 297.267 -0.318 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCc1nnnn1C1CC1 1116428275 ZPADLKHPYLDWPF-UHFFFAOYSA-N 292.259 -0.420 5 20 CBBD CC(=O)NCCN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1118285990 ZIXGNEFFDCMCAQ-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD O=C(CO[C@@H]1CCOC1)NCCn1cc([N+](=O)[O-])cn1 1319840467 BDQMJNVNONMDLO-SNVBAGLBSA-N 284.272 -0.287 5 20 CBBD O=C(CNC(=O)c1c[nH]nc1[N+](=O)[O-])NC1CC1 1321105202 MLHCRQFEPITQDQ-UHFFFAOYSA-N 253.218 -0.674 5 20 CBBD CNC(=O)C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1323149722 DGQBMWKGIBKHJB-UHFFFAOYSA-N 281.272 -0.084 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCC(N)=O 1324987174 UHHDAVAJWVVEKO-UHFFFAOYSA-N 283.288 -0.128 5 20 CBBD CNCCNC(=O)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1327546511 VDDXCVVPBDOIDX-UHFFFAOYSA-N 292.295 -0.227 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1342689710 BADGAGMGPADZQJ-ZETCQYMHSA-N 281.272 -0.369 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCC(=O)C2(C(=O)O)CC2)n1 1608122574 LSBCVXGRFWROOU-UHFFFAOYSA-N 297.223 -0.081 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C(N)=O 55214471 UAIDCGBGJQRAPK-RXMQYKEDSA-N 291.260 -0.114 5 20 CBBD O=C(CNC(=O)NCCn1cc([N+](=O)[O-])cn1)NC1CC1 151724679 UNIOPBSMOLNWJP-UHFFFAOYSA-N 296.287 -0.631 5 20 CBBD CCC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnn[nH]1 268254154 XOJRFAAVGIUBQD-SSDOTTSWSA-N 294.275 -0.038 5 20 CBBD COCCN(CC(=O)N(C)C)C(=O)c1n[nH]cc1[N+](=O)[O-] 270868886 NHLBWUGYQDVHFD-UHFFFAOYSA-N 299.287 -0.505 5 20 CBBD C[C@@H]1OCC[C@]1(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330865045 YTFFIMAEERPDAZ-XVKPBYJWSA-N 269.261 -0.130 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCO[C@@H](CO)C2)c1 331123114 CAPKIBOKQNXXSO-SNVBAGLBSA-N 256.262 -0.516 5 20 CBBD COCCN1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1=O 332678912 RYNBNRQOYXRCEB-UHFFFAOYSA-N 297.271 -0.783 5 20 CBBD CCc1[nH]nc(C(=O)N(C)CCC(N)=O)c1[N+](=O)[O-] 343523909 IUPZXXHNGLEDJC-UHFFFAOYSA-N 269.261 -0.172 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 355071935 RJTBCQAGPWRWCH-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD COC[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])OC 358239501 JNHWYVVGAKGMMC-ZCFIWIBFSA-N 258.234 -0.291 5 20 CBBD NC(=O)N[C@H]1CCN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 359018181 LJSHLVUJKUXBDO-ZETCQYMHSA-N 294.271 -0.314 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCNC1 428184412 MMPHIYSBOWEGOR-QMMMGPOBSA-N 266.257 -0.765 5 20 CBBD O=C1C[C@@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)CN1 436975933 AQLGVPPWOWQLNN-SSDOTTSWSA-N 265.225 -0.081 5 20 CBBD O=C(CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)NCCO 436977435 RLUCZTWKJOLGEX-UHFFFAOYSA-N 283.240 -0.861 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 447742192 OZMRYBPAHNJSNX-JMCQJSRRSA-N 296.283 -0.158 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 592477206 SLURAZXATHXFNB-WPRPVWTQSA-N 283.288 -0.634 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 600472782 ZTXWBOQMIYVKGJ-SSDOTTSWSA-N 285.256 -0.413 5 20 CBBD O=C(NC1CN(C(=O)c2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280178 NSUDVWLUNVRFIB-VXNVDRBHSA-N 280.240 -0.720 5 20 CBBD Cn1cc([C@@H](CO)NC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 1320004096 CUARDTBGKBLFMG-SNVBAGLBSA-N 294.271 -0.625 5 20 CBBD CCc1[nH]nc(C(=O)NCC2(CO)COC2)c1[N+](=O)[O-] 1320821207 SQGZOYYHWRJUSM-UHFFFAOYSA-N 284.272 -0.381 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1cccnn1 1320929714 WDWQNVUPZFVYHC-UHFFFAOYSA-N 289.251 -0.137 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1351639486 MYJZRAYDFCHMRU-QMMMGPOBSA-N 297.267 -0.224 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])ccc1=O)CC(=O)O 1594014617 RBPHJAQPNLBFNG-UHFFFAOYSA-N 299.283 -0.211 5 20 CBBD CCn1cc(CNCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1753188571 YLVMMMUZFPZMIQ-GHMZBOCLSA-N 296.331 -0.489 5 20 CBBD NC(=O)c1ccc(NC(CO)CO)c([N+](=O)[O-])c1 87752990 JAQWYAKTNSGPTQ-UHFFFAOYSA-N 255.230 -0.541 5 20 CBBD CN(C)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 133909800 PAMKEYUKJJFFIG-UHFFFAOYSA-N 270.293 -0.348 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(=O)O 262684958 CTYLFEPOGYKWDD-UHFFFAOYSA-N 256.218 -0.309 5 20 CBBD C[C@H](NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C(N)=O 340625590 YXBKRWWZFFPLIA-LURJTMIESA-N 295.251 -0.030 5 20 CBBD Nc1nc(N2CCC[C@@H]3C(=O)NC[C@H]32)ncc1[N+](=O)[O-] 358687192 TWTVHGDPXLLZBT-NKWVEPMBSA-N 278.272 -0.318 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC[C@@H]1CCNC1 429426012 MAWQANWLDRVPNO-JTQLQIEISA-N 294.311 -0.128 5 20 CBBD CCOC(=O)[C@](C)(O)CNc1ccc(N)c([N+](=O)[O-])n1 596198889 NCVMLZLOKMDFMT-LLVKDONJSA-N 284.272 0.298 5 20 CBBD NC(=O)[C@H]1CN(c2cccnc2[N+](=O)[O-])CCN1 603845109 PULSWCXNAOMNJG-SSDOTTSWSA-N 251.246 -0.747 5 20 CBBD CCOC(=O)/C=C\Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 755625237 CXBWKRPMCIGOAQ-ARJAWSKDSA-N 295.251 -0.025 5 20 CBBD NC(=O)NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1N 758957445 YWPJQBQYIDIVRO-UHFFFAOYSA-N 282.212 -0.471 5 20 CBBD Cc1[nH]nc(C(=O)Nn2c(O)nnc2O)c1[N+](=O)[O-] 816732924 BUZZKFNFVYOAIT-UHFFFAOYSA-N 269.177 -0.987 5 20 CBBD C[C@@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1 840673237 VGKLSBVTIVZAQQ-UTINFBMNSA-N 286.284 -0.122 5 20 CBBD COCCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093444702 PERRNWQITAVCDR-UHFFFAOYSA-N 284.276 -0.468 5 20 CBBD Cc1cc(NCCN(C)C(=O)C(N)=O)ncc1[N+](=O)[O-] 1101945070 ZDUQBDJKNFJORZ-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN(CCOC)CC1 1121698864 GSERONZRSYATHV-UHFFFAOYSA-N 298.347 -0.157 5 20 CBBD Cc1nn(C)c(C(=O)NCCC(=O)N(C)C)c1[N+](=O)[O-] 1251264465 VEBYVYDSXXTRSS-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD NC(=O)N[C@H]1CCN(c2ccnc(O)c2[N+](=O)[O-])C1 1327688861 RUISWGQHUZQPAD-LURJTMIESA-N 267.245 -0.058 5 20 CBBD C[C@@H](N)C1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1328479032 UYEXJWZDIRHTHM-MRVPVSSYSA-N 282.304 -0.228 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1344048351 XDNZVFAQNBIWQK-YFKPBYRVSA-N 253.218 -0.735 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCNC[C@H]1CO 1580876723 QRSYITFTZBHWFH-NSHDSACASA-N 282.300 -0.977 5 20 CBBD O=C(O)[C@H](CCC1OCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601644746 IXFMTMNUEPFDSZ-GJMOJQLCSA-N 288.256 -0.626 5 20 CBBD C[C@H]1CNCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 125627092 XFWDKEFPGLIUNT-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H](O)CO)s1 272838352 MFWOUTYNWBMIOA-RXMQYKEDSA-N 296.326 -0.175 5 20 CBBD CCN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1=O 273283178 JIJHVBXFFCCNCH-UHFFFAOYSA-N 266.261 -0.365 5 20 CBBD CNC(=O)C1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 274404087 SZUMATNUYQSLAN-UHFFFAOYSA-N 267.245 -0.556 5 20 CBBD COCCN1CN(CCn2cc([N+](=O)[O-])cn2)CC1=O 282536103 SCIDHXXMPKZSIB-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1 283585008 LEEZUXAWZVRICC-UHFFFAOYSA-N 282.231 -0.112 5 20 CBBD Cn1c(S)nnc1CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285544647 IHLGEECYZBHQMD-UHFFFAOYSA-N 297.300 -0.292 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCN(C)C1=O 330838664 IQSDSVCQHJOVHD-SECBINFHSA-N 295.299 -0.163 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1COC[C@@H]1O 342394639 CWQNRCPVBUXWAG-YUMQZZPRSA-N 270.245 -0.991 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC(=O)NC1=O 354603122 HSCJQOKDOWBALF-ZETCQYMHSA-N 292.251 -0.288 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 436957854 BELGLCWGAZDUTK-VIFPVBQESA-N 284.224 -0.436 5 20 CBBD CNc1nc(C(=O)NC[C@@](C)(O)CO)ccc1[N+](=O)[O-] 456046322 XMZZMCVGMRSUKL-LLVKDONJSA-N 284.272 -0.495 5 20 CBBD COC[C@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 525264744 LEGSBEFHJDRMAK-LLVKDONJSA-N 286.288 -0.387 5 20 CBBD CCC[C@@H](O)[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 565785242 OBLWQTXGBBQOHS-RKDXNWHRSA-N 298.299 -0.176 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)N1 593424539 JUIDIYBFIBXCKV-JTQLQIEISA-N 299.308 -0.097 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCCCC(=O)O)n1 600652552 WJPAXONRVIAAAT-UHFFFAOYSA-N 292.273 -0.529 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNOC[C@@H]2CCOC2)c1 819255685 CWSOKBDHWHPNSU-MWLCHTKSSA-N 286.288 -0.290 5 20 CBBD CCONC(=O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 846497173 MAHGPLPHDMUQHC-UHFFFAOYSA-N 256.218 -0.280 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C(=O)O1 848073012 HXTKYOUAXIDHLV-INEUFUBQSA-N 254.202 -0.248 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](F)C(=O)O)n1 863410327 ZVLVILVZYBWZLL-SCSAIBSYSA-N 296.236 -0.971 5 20 CBBD NC(=O)c1cc(N2C[C@@H](O)[C@@H](CO)C2)ccc1[N+](=O)[O-] 1118597169 VCPVXHHPRFRXAV-RDDDGLTNSA-N 281.268 -0.517 5 20 CBBD COC[C@@H](CO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1321062923 RHTBYYNGWKZHJV-ZCFIWIBFSA-N 258.234 -0.637 5 20 CBBD C[C@H](N)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1325826529 UAHCGSXWQQVXDO-VHSXEESVSA-N 294.311 -0.048 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CCOCCN1 1593466493 QLVSNPBPELMPQY-UHFFFAOYSA-N 292.259 -0.489 5 20 CBBD CC[C@@H](C)[C@@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1594908508 HATQTFWWOOQIHN-HZGVNTEJSA-N 285.260 -0.198 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@](C)(CO)C(=O)O 1600748320 LDYUDHKRAFIXRF-JTQLQIEISA-N 286.244 -0.948 5 20 CBBD O=C(NC[C@H]1CCO[C@H]1C(=O)O)c1n[nH]cc1[N+](=O)[O-] 1608460414 BSRRSBCNACKZKI-SVGQVSJJSA-N 284.228 -0.463 5 20 CBBD CNS(=O)(=O)c1ccc(N(C)CCN)c([N+](=O)[O-])c1 54419512 XYUTXJDJFKTULU-UHFFFAOYSA-N 288.329 -0.102 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC1CCN(CC(N)=O)CC1 60286185 QHGMSKZNAYZERH-UHFFFAOYSA-N 282.304 -0.310 5 20 CBBD Cc1cc(=O)n(CC(=O)N2CCOCC2)cc1[N+](=O)[O-] 96547981 QFIFCOQKEQWXFB-UHFFFAOYSA-N 281.268 -0.076 5 20 CBBD Cn1c(C(=O)N[C@H]2CCC(=O)NC2)ccc1[N+](=O)[O-] 110906604 GHCSJVXOQZRZII-ZETCQYMHSA-N 266.257 -0.058 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](CO)C(=O)O 164790665 BMMIQABCHJZIMF-MRVPVSSYSA-N 284.224 -0.221 5 20 CBBD N[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 179571550 HWPWIENAHLOGCD-VIFPVBQESA-N 253.262 -0.355 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)Cn2nnc(C3CC3)n2)c1 193416664 GQZCTVZLYCQCCX-VIFPVBQESA-N 279.260 -0.284 5 20 CBBD C[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1CO 248910798 IXPSBSOCJWHIOH-JLLWLGSASA-N 284.316 -0.145 5 20 CBBD COc1cc(OCC(=O)NCC(N)=O)ccc1[N+](=O)[O-] 264540743 QIZXEIKKWRSIFY-UHFFFAOYSA-N 283.240 -0.416 5 20 CBBD CN1C[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1=O 277715671 MJNXAHRZPYNOFH-SSDOTTSWSA-N 280.240 -0.344 5 20 CBBD C[C@@H](N)[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 351829397 BDSDGIPHAGDOFA-RKDXNWHRSA-N 267.289 -0.013 5 20 CBBD Cn1nnnc1CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 356915482 LQKLQWKCHZKEAQ-UHFFFAOYSA-N 288.223 -0.086 5 20 CBBD N[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 429083582 KLTJRBVZAFOQFG-QMMMGPOBSA-N 266.257 -0.684 5 20 CBBD Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)cc([N+](=O)[O-])c1 450618727 WDWUYRBJMZROCY-SNVBAGLBSA-N 278.268 -0.022 5 20 CBBD COC(=O)N(C)CC(=O)OCCn1cnc([N+](=O)[O-])n1 493073378 LZPJCMAIULGCIB-UHFFFAOYSA-N 287.232 -0.572 5 20 CBBD CNc1nccc(C(=O)N[C@H](C)C(N)=O)c1[N+](=O)[O-] 581201152 KUCLKEZHOWKFOZ-RXMQYKEDSA-N 267.245 -0.365 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(Cc2nc[nH]n2)CC1 593509103 SIJFNLKVCOESAB-UHFFFAOYSA-N 292.303 -0.231 5 20 CBBD Cn1nnnc1COC(=O)c1ccc([N+](=O)[O-])n1C 733426282 SXPXTOGSNCFESR-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2C(=O)NC[C@@H]2C1 892852102 VBYHAUKZIIXPME-SSDOTTSWSA-N 266.261 -0.458 5 20 CBBD CCN1CCCN(c2nnc(C[N+](=O)[O-])n2C)CC1=O 1262864880 SLVWDQKQKCYZMI-UHFFFAOYSA-N 282.304 -0.350 5 20 CBBD Cc1ccc([N+](=O)[O-])c(=O)n1Cc1noc(CN)n1 1326582797 RMIWETMDSAFJIX-UHFFFAOYSA-N 265.229 -0.045 5 20 CBBD O=C1N[C@H](CO)C(=O)N1CCOc1ccc([N+](=O)[O-])cc1 1332405382 VZNPZQKRBJBDEY-SNVBAGLBSA-N 295.251 -0.114 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](Cc2cnn[nH]2)C1 1578030044 NIHHTAXRWNPBIS-SZEHBUNVSA-N 265.273 -0.139 5 20 CBBD Cn1cc(CN2C[C@H](O)C[C@@H]2C(=O)O)c([N+](=O)[O-])n1 1600953125 MLQFHZWBAKIXBT-HTQZYQBOSA-N 270.245 -0.652 5 20 CBBD O=C(O)C[C@@H]1COCCN1Cn1nccc1[N+](=O)[O-] 1610764759 GNQDUMGUWFFBJS-MRVPVSSYSA-N 270.245 -0.076 5 20 CBBD O=c1c([N+](=O)[O-])cc(Br)cn1C[C@H](O)CO 122307242 MYCWPDJZSKZWIT-LURJTMIESA-N 293.073 -0.128 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 217687887 PHJBIDWDHGVXIN-VIFPVBQESA-N 268.225 -0.142 5 20 CBBD C[C@@H]1C[C@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262110490 ZZWFODCPXIXAMR-NXEZZACHSA-N 294.311 -0.048 5 20 CBBD COC[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)OC 273053671 XPSWEOMLLHJILZ-QMMMGPOBSA-N 272.261 -0.431 5 20 CBBD CCN1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1=O 278042900 LEJOPONBBATKFS-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD Cc1cc(OCC(=O)NC(CO)CO)ccc1[N+](=O)[O-] 280920133 XIJCXMGBKLYECX-UHFFFAOYSA-N 284.268 -0.249 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])[nH]n1)NCC1CC1 285916840 WLDUSRZKVGOMQO-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CC(=O)N(C)C1 299606174 DNZOEDAJIPERRK-QMMMGPOBSA-N 281.272 -0.553 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1O 330505499 KCMUTRGROXJNSI-HTQZYQBOSA-N 269.261 -0.584 5 20 CBBD Nc1noc(CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 437286288 NXMWWTKQEDWQED-UHFFFAOYSA-N 266.217 -0.139 5 20 CBBD NC(=O)Cn1ccc(Nc2ncc([N+](=O)[O-])s2)n1 443518818 UHOLWVBELQGDET-UHFFFAOYSA-N 268.258 0.477 5 20 CBBD COC(=O)NCC(=O)NCCn1cc([N+](=O)[O-])cn1 493710378 LZPJVFBDQZIMOY-UHFFFAOYSA-N 271.233 -0.737 5 20 CBBD COCc1n[nH]c(CNc2ccc(N)c([N+](=O)[O-])n2)n1 596435343 CTJHSMKUFIATLM-UHFFFAOYSA-N 279.260 0.449 5 20 CBBD COC(=O)COCCNc1c([N+](=O)[O-])ncn1C 599157374 XRVPYQAGTPDKBN-UHFFFAOYSA-N 258.234 -0.070 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 600471142 ZOANRDDRLZPFPB-SSDOTTSWSA-N 297.267 -0.169 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NS(=O)(=O)CC1CC1 733703325 YMEAVRXAWRDIBM-UHFFFAOYSA-N 288.285 -0.353 5 20 CBBD CS(=O)(=O)CCOCCNc1ncc([N+](=O)[O-])cn1 760549777 DZOPTTRQMDNSSL-UHFFFAOYSA-N 290.301 -0.142 5 20 CBBD CON(C)C(=O)CCNCCn1cc([N+](=O)[O-])cn1 819178009 YKCTWMDFZBQVTH-UHFFFAOYSA-N 271.277 -0.209 5 20 CBBD NC(=O)C(=O)NCCCNc1ccc([N+](=O)[O-])cn1 1094742277 QVEKHMLFJBFPKW-UHFFFAOYSA-N 267.245 -0.607 5 20 CBBD CCN(C)C(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1112835770 OKRQTKBRKKZVRE-GHMZBOCLSA-N 298.343 -0.726 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CCNC2)c1[N+](=O)[O-] 1118569134 BQYKUSQDMRHQMG-ZETCQYMHSA-N 253.262 -0.272 5 20 CBBD NC(=O)CC(=O)NCCNCc1csc([N+](=O)[O-])c1 1125080759 XNSSAPLFEXNZEQ-UHFFFAOYSA-N 286.313 -0.263 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])[nH]1 1321215337 BBNHLYFJHYVYSV-SSDOTTSWSA-N 271.229 -0.423 5 20 CBBD COc1ccc(=O)n(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1322471027 KREVIPVTSFQFLW-SECBINFHSA-N 295.255 -0.582 5 20 CBBD Nc1nccc(C(=O)NN2CCCC2=O)c1[N+](=O)[O-] 1327098593 ZMVFOKXXMRHBBZ-UHFFFAOYSA-N 265.229 -0.161 5 20 CBBD CC[C@@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1589524849 GMSHFWLPHKRLOC-QMMMGPOBSA-N 297.267 -0.017 5 20 CBBD O=C(O)[C@@H](CCC1OCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601644743 IXFMTMNUEPFDSZ-BWZBUEFSSA-N 288.256 -0.626 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CF)C(=O)O 1608379714 RTUKCHXTYZFUKW-YFKPBYRVSA-N 260.181 -0.670 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cn1 1610683719 YKXNQCXAFFGGHR-SSDOTTSWSA-N 255.186 -0.835 5 20 CBBD CO[C@]1(C(=O)O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 1777155785 FYQBUYUQNTZCLR-SNVBAGLBSA-N 283.244 -0.353 5 20 CBBD CNCC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40835090 GQDDXHGWULPRFP-UHFFFAOYSA-N 279.300 -0.142 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCOCC1 44667309 MRABUJGGXBBKTD-UHFFFAOYSA-N 283.288 -0.760 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 46825606 MGEXSZGATUMEOR-SSDOTTSWSA-N 269.261 -0.616 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CCCO)c1=O 73527947 VRRBFQCVVJOHGK-UHFFFAOYSA-N 256.214 -0.075 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(S(C)(=O)=O)CC1 137976757 IRJGJJKBMGZCSB-UHFFFAOYSA-N 289.317 -0.590 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NCC(N)=O 164847316 AUZXTWWUPIYMDD-UHFFFAOYSA-N 253.214 -0.182 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 284840897 BZHYZPJSUVCIJO-UHFFFAOYSA-N 269.261 -0.086 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@H](O)C(N)=O 289585732 JAQYYGMREXKRHL-JTQLQIEISA-N 297.267 -0.052 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@@H](O)C1CC1 304788100 QBJUAQXSWKBRAO-NWDGAFQWSA-N 284.316 -0.145 5 20 CBBD CC(=O)NC[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 344432705 MBVXOVFTAMSBAV-MRVPVSSYSA-N 296.287 -0.692 5 20 CBBD COC[C@@](C)(O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 541907277 MVOIJSZYWZLGCG-NSHDSACASA-N 284.272 -0.069 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1=O 563399854 WNRSAOMVJDAYQO-SECBINFHSA-N 293.235 -0.213 5 20 CBBD CNc1nccc(C(=O)N2CC(N(C)C)C2)c1[N+](=O)[O-] 571893875 CQYMPGXXUNYKRN-UHFFFAOYSA-N 279.300 0.418 5 20 CBBD O=C(NCCN1CCCC1=O)c1n[nH]cc1[N+](=O)[O-] 582912183 WMRQQKHLVQWYHS-UHFFFAOYSA-N 267.245 -0.330 5 20 CBBD C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 599532609 SEVOKZFEEVOTGL-UWJYBYFXSA-N 295.295 -0.041 5 20 CBBD CNC(=O)[C@@H](O)CNc1c([N+](=O)[O-])c(C)nn1C 757700836 DLKBXCYANSZMIC-LURJTMIESA-N 257.250 -0.844 5 20 CBBD CN(C)C(=O)[C@H]1CSCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840308489 UNXKKINKPKGSID-BWZBUEFSSA-N 273.314 -0.359 5 20 CBBD CC(F)(F)C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990053687 GUBSTTIWQFHKLV-RNFRBKRXSA-N 277.227 -0.366 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ncn(C)n1 1255390809 IXXVGJBSMJCXOZ-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2C[C@@]2(CO)C1 1320698935 NGCXXHULDVXFDA-CABZTGNLSA-N 280.284 -0.059 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)NCCC(=O)O 1600059447 JJYXVRHADTUQQL-UHFFFAOYSA-N 283.240 -0.344 5 20 CBBD Cc1nn(CCC(=O)NCCN)c(C)c1[N+](=O)[O-] 2538268 AOQUPQMYPWICQR-UHFFFAOYSA-N 255.278 -0.127 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccccc1[N+](=O)[O-] 22213039 JGGWAPKUWXCPMJ-ZETCQYMHSA-N 254.198 -0.230 5 20 CBBD CCCCN(CC(N)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 45909363 APXQFVUUMXWXMJ-UHFFFAOYSA-N 283.288 -0.095 5 20 CBBD CC(CO)(CO)NC(=O)COc1cccc([N+](=O)[O-])c1 126155644 MFSZDPVDUPCDRX-UHFFFAOYSA-N 284.268 -0.167 5 20 CBBD NS(=O)(=O)CCNC(=O)Cc1cccc([N+](=O)[O-])c1 134795220 MYBZVKWWMGWPJF-UHFFFAOYSA-N 287.297 -0.458 5 20 CBBD CN(C)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 193148403 FYJFDNNAMWVLRI-UHFFFAOYSA-N 254.246 -0.013 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 227885034 AALLDHUNPXZSLO-UHFFFAOYSA-N 253.218 -0.952 5 20 CBBD COCCN(CCO)c1ncc([N+](=O)[O-])c(N)n1 267100350 WLJJOUBPHSMUQM-UHFFFAOYSA-N 257.250 -0.588 5 20 CBBD CN(C)C(=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274911944 UOZRNHQAHXVRGQ-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 316934351 XBCXAQPOUHZQBR-XPUUQOCRSA-N 283.240 -0.523 5 20 CBBD O=C(NC[C@H]1COCCO1)c1cc([N+](=O)[O-])cnc1O 342054431 GIHDSQJMASLJOQ-QMMMGPOBSA-N 283.240 -0.159 5 20 CBBD C[C@]1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCCNC1 342762061 UUKYQEYAPHGPPM-NSHDSACASA-N 282.304 -0.308 5 20 CBBD CN1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@@H]2C1 347653845 LSLZNPWBOVQSPI-IUCAKERBSA-N 279.300 -0.038 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1(C)C 356478850 MCCWSQGFJKPQDQ-UHFFFAOYSA-N 281.272 -0.321 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 514862063 ALTFYTYYXAJRPQ-RKDXNWHRSA-N 282.256 -0.284 5 20 CBBD Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])cn2C)n1 536655543 WQVSDHRTDNVLTD-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD O=C(NCC1CN(Cc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031662516 FTPZWWRUSHVJHG-NXEZZACHSA-N 281.272 -0.717 5 20 CBBD O=[N+]([O-])c1c(NC[C@H](O)Cn2ccnn2)ccnc1O 1118596894 SJOHAGDOTBBNTH-ZETCQYMHSA-N 280.244 -0.240 5 20 CBBD C[C@H](CCS(C)(=O)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1253838188 AGEIVSDSMJYRNL-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ncn(C)n1 1255390810 IXXVGJBSMJCXOZ-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD CN(Cc1nncn1C)C(=O)c1n[nH]cc1[N+](=O)[O-] 1327685129 JRKPYFYIAOMUKN-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H](c2nc[nH]n2)C1 1331997184 PBHHLLNSLCTOTG-QMMMGPOBSA-N 291.271 -0.075 5 20 CBBD O=C1NC(=O)N2CCN(c3ncc([N+](=O)[O-])cn3)C[C@@H]12 1342482319 FPIODLIVXQZVDG-ZETCQYMHSA-N 278.228 -0.875 5 20 CBBD O=C(O)[C@H]1CNCCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 1610747141 DQJJYFCUVTVHJH-MRVPVSSYSA-N 282.256 -0.188 5 20 CBBD CC(=O)N1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 44684320 DTTGEYGLQIYHFU-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD CN(CCn1cccn1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75722014 KBQSDJNKQWLULL-LBPRGKRZSA-N 294.315 -0.019 5 20 CBBD CSc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 227872004 MZDKTMUMJMMZOM-QMMMGPOBSA-N 299.308 -0.107 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CN2C[C@@H](O)[C@H](O)C2)c1 278799869 OOPSMFZSQKKHHL-IJLUTSLNSA-N 268.269 -0.334 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 311551474 LWSJEEXJJJOOIY-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCCCS(N)(=O)=O 336795994 OSQBXZSJPFZIPM-UHFFFAOYSA-N 277.306 -0.191 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)O1 339303363 MBYDSYOLJDXSKZ-OPRDCNLKSA-N 285.304 -0.344 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](CO)O1 408281702 WGDHVAQWTADZNC-SFYZADRCSA-N 284.272 -0.450 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCc1nc(O)n[nH]1 442739632 SFGFFKLIUYSROQ-UHFFFAOYSA-N 279.216 -0.476 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 548082306 NWFUXEGZMNHEKR-SSDOTTSWSA-N 267.245 -0.202 5 20 CBBD CN(CCN1CCNCC1)CCn1ccc([N+](=O)[O-])n1 592472304 VXNAOZNQFRESMM-UHFFFAOYSA-N 282.348 -0.372 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@H](O)[C@H](O)C1 762540970 IVEVVBOOAJTYRG-PHIMTYICSA-N 281.268 -0.504 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1c([N+](=O)[O-])cnn1C 783753291 DPPNSQBGVAVVJO-ZETCQYMHSA-N 281.272 -0.369 5 20 CBBD CCOCCONC[C@H](O)Cn1cc([N+](=O)[O-])cn1 819239565 MSGSPIBPHJVVHW-JTQLQIEISA-N 274.277 -0.290 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])Nn1c(O)nnc1O 820291452 HHAUZUVYCXTJGD-UHFFFAOYSA-N 294.227 -0.220 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C(=O)O 828442049 XCUXWYROEUFIOT-MIMYLULJSA-N 298.299 -0.195 5 20 CBBD C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])N1CCN(C)CC1 1319607630 OBSYNNDBDWQRTL-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD C[C@@H](N)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1325826530 UAHCGSXWQQVXDO-ZJUUUORDSA-N 294.311 -0.048 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1330551699 KNFSSCXRRSNPNT-ZMONIFLSSA-N 252.230 -0.372 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OC1(C(=O)O)CC1 1601384456 POECHNNSZIPGHH-UHFFFAOYSA-N 255.186 -0.048 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 135534243 AQHSEXVFMKCGGK-QMMMGPOBSA-N 283.240 -0.063 5 20 CBBD CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 180502613 XKLPNDREQHNJGI-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD C[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC(=O)N1C 282421412 QHTSWNQBDDPQFS-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)OC 291564837 OJHBPZLHQPHMHF-ZCFIWIBFSA-N 286.244 -0.374 5 20 CBBD C[C@@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCOC1=O 291927287 BRCKZMQUYWOMNZ-SECBINFHSA-N 254.202 -0.247 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(CO)C2)c1[N+](=O)[O-] 331446710 DKILAJQQJRORJG-UHFFFAOYSA-N 254.246 -0.055 5 20 CBBD CO[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1OC 332635091 JBAZWODBYBLDBK-DTORHVGOSA-N 284.272 -0.186 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@H](COC)C(N)=O)c1[N+](=O)[O-] 354558869 YXXWOTYNRPCVQF-SSDOTTSWSA-N 299.287 -0.547 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354765517 FWUDSVKRJCXQSO-ZCFIWIBFSA-N 282.260 -0.539 5 20 CBBD C[C@@H](CO)N(C[C@@H](C)O)C(=O)c1n[nH]cc1[N+](=O)[O-] 442696080 SJYXYQAAMVGHPM-NKWVEPMBSA-N 272.261 -0.478 5 20 CBBD CNC[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 577274735 LQAGOYVVJSQFDB-MRVPVSSYSA-N 255.278 -0.237 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594348046 PHECKKWXMJAPTO-JMCQJSRRSA-N 296.283 -0.158 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](CF)C(=O)O)n1 600665540 UYDHHZBSYAGYDP-SCSAIBSYSA-N 296.236 -0.971 5 20 CBBD Nc1c(C(=O)NN2CC(=O)NC2=O)cc(F)cc1[N+](=O)[O-] 743288412 VLRNTIXVIYLQNG-UHFFFAOYSA-N 297.202 -0.487 5 20 CBBD CC(C)(C(N)=O)C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 769695011 WCYDOEWIGXTRHY-UHFFFAOYSA-N 297.267 -0.189 5 20 CBBD CC[C@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842333352 IIMAVFKMFFNALD-RRKCRQDMSA-N 250.276 -0.104 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2COC(=O)C2)c1[N+](=O)[O-] 854556422 AWTGDXLKOOQWDG-YFKPBYRVSA-N 268.229 -0.074 5 20 CBBD CN[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923278150 PKYNDQYWSOAFOR-MWLCHTKSSA-N 269.305 -0.554 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](N2CC[C@@H](O)C2)C1 1117737929 XUVQGWJHZHOZTB-DTWKUNHWSA-N 295.299 -0.401 5 20 CBBD Cc1[nH]nc(C(=O)N[C@]2(CO)CCOC2)c1[N+](=O)[O-] 1254721301 PJCDDABPIQDUJX-JTQLQIEISA-N 270.245 -0.492 5 20 CBBD C[C@H](CN)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261492095 QVGXHEBRXARPHP-MRVPVSSYSA-N 268.273 -0.438 5 20 CBBD CC(=O)N1CC[C@H](CN(C)c2nnc(C[N+](=O)[O-])n2C)C1 1262864929 UXVQOITVKCAVRG-SNVBAGLBSA-N 296.331 -0.104 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1321893205 NWOVYPZGNMOTAR-RXMQYKEDSA-N 253.218 -0.735 5 20 CBBD COC[C@@H](CCO)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1326063901 JPYWUPYKYLEPMF-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN(C2CNC2)CC1 1580008910 GLHJGRAXKUKEAB-UHFFFAOYSA-N 294.315 -0.942 5 20 CBBD CN(CC(=O)N1CCCC1)C(=O)Cn1cc([N+](=O)[O-])cn1 44867953 WHUOTZMHSJOLKZ-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD CC(C)CNC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603074 ZBALIGSULIHNCN-UHFFFAOYSA-N 270.249 -0.332 5 20 CBBD NC(=O)CC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 49394717 MCKYOESCJUNVFS-UHFFFAOYSA-N 295.299 -0.095 5 20 CBBD CC(C)(CO)CNC(=O)Cn1cc([N+](=O)[O-])cn1 124335376 ZGXSRYDYAHGCBR-UHFFFAOYSA-N 256.262 -0.074 5 20 CBBD O=C1CCCC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 194369626 RQHYKWZGZUQQNT-SNVBAGLBSA-N 295.299 -0.034 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](O)C1CC1 331415918 CFXHZDFIZYWRNB-SECBINFHSA-N 268.273 -0.013 5 20 CBBD COC[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])OC 358239496 JNHWYVVGAKGMMC-LURJTMIESA-N 258.234 -0.291 5 20 CBBD CNC(=O)CN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 444828941 NEVGOQNSVWNUQV-UHFFFAOYSA-N 268.229 -0.487 5 20 CBBD COC(=O)N1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 490788410 VNEZNMRCTVPQJN-UHFFFAOYSA-N 297.271 -0.298 5 20 CBBD Cc1ncc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)c(N)n1 575019741 SPXCUOVRXXGDQN-UHFFFAOYSA-N 291.271 -0.212 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)C[C@H]2C)c1[N+](=O)[O-] 610242207 UKZIMFDGRUSTOH-SSDOTTSWSA-N 295.299 -0.013 5 20 CBBD COc1ncc(C(=O)OCCn2cnc([N+](=O)[O-])n2)cn1 749077041 VOSXQSKXBWVVPU-UHFFFAOYSA-N 294.227 -0.158 5 20 CBBD CN1C[C@@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 772765954 KFPCYKUQDWCMDA-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CO)[C@@H](O)C1 798998932 JTMPCABVJQLKFA-UFBFGSQYSA-N 295.295 -0.008 5 20 CBBD COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)C1 839717199 CBLQSRCVBNBKAG-GMTAPVOTSA-N 299.327 -0.253 5 20 CBBD CC(C)(COC(=O)CN1CCOCC1=O)[N+](=O)[O-] 851128607 AJAFCECFFZYWTK-UHFFFAOYSA-N 260.246 -0.556 5 20 CBBD NC(=O)CN1CCCN(c2cccnc2[N+](=O)[O-])CC1 919721613 LUBVUNHFSLPFQA-UHFFFAOYSA-N 279.300 -0.013 5 20 CBBD Cn1ccnc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030291635 DGDVUWPBOKUHGK-NXEZZACHSA-N 279.300 -0.614 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1 1059393668 CBJOSXYQUBYJCP-LJGSYFOKSA-N 279.256 -0.466 5 20 CBBD NC(=O)C(=O)NCCCNc1ccnc(O)c1[N+](=O)[O-] 1094742228 PUVYCKNGXFFWEI-UHFFFAOYSA-N 283.244 -0.901 5 20 CBBD CCN(CCO)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1116626566 YPESYPIXEOOYLE-UHFFFAOYSA-N 285.304 -0.628 5 20 CBBD C[C@H](C(=O)Nc1c([N+](=O)[O-])cnn1C)S(C)(=O)=O 1255525116 CAXFHOLVDBMYTG-RXMQYKEDSA-N 276.274 -0.300 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H](O)c2cnn(C)c2)c1[N+](=O)[O-] 1318909079 KVBIXQLKGQYVRE-MRVPVSSYSA-N 294.271 -0.177 5 20 CBBD C[C@H](O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1319949209 HHSWVWKPTPWNLJ-VHSXEESVSA-N 295.295 -0.014 5 20 CBBD C[C@@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCS(=O)(=O)C1 1323197905 UIAAZYKFECWGGQ-SECBINFHSA-N 288.285 -0.375 5 20 CBBD CC[C@@](COC)(NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)O 1605049635 OQKZJMXWUNRSSH-JTQLQIEISA-N 286.244 -0.073 5 20 CBBD O=C(O)[C@@H]1CC(=O)N(C2CCN(CC[N+](=O)[O-])CC2)C1 1605976575 DEHCOXVAFKRCGC-SECBINFHSA-N 285.300 -0.339 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC(=O)NCc1ccco1 53835070 VGQXPJGBIMXBEM-UHFFFAOYSA-N 294.227 -0.195 5 20 CBBD Nc1ccc(C(=O)NC(CO)CO)cc1[N+](=O)[O-] 132392804 HUZFMVFDODQIOZ-UHFFFAOYSA-N 255.230 -0.740 5 20 CBBD C[C@@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 132961369 OZFZTGIYSMVMKZ-WCBMZHEXSA-N 258.278 -0.487 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)O1 152448649 MBYDSYOLJDXSKZ-BBBLOLIVSA-N 285.304 -0.344 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[C@H](C)O 265552322 ZBBCZFJFEDOTQY-ZETCQYMHSA-N 256.262 -0.013 5 20 CBBD C[C@@H](O)CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H](C)CO 279150724 ZKWXOESKWDSAOT-HTQZYQBOSA-N 299.283 -0.101 5 20 CBBD C[C@@H]1CN(C)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330676329 UDNYLVBWJHRPJO-SNVBAGLBSA-N 294.311 -0.081 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1ccnc1 340052614 XDBQOZPRZOOLOV-UHFFFAOYSA-N 264.245 -0.196 5 20 CBBD COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(N)=O 343294379 YBUJTDPYEJTCKF-SSDOTTSWSA-N 284.272 -0.447 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(O)(C(F)F)C1 425015279 FADKHLPYTHTGRU-UHFFFAOYSA-N 276.199 -0.220 5 20 CBBD Cc1nc(NCCn2cc(C(=O)O)nn2)ncc1[N+](=O)[O-] 573566843 GAFKTZTYTHSZQW-UHFFFAOYSA-N 293.243 0.095 5 20 CBBD Nc1nc(NC[C@]2(OCCO)CCOC2)ncc1[N+](=O)[O-] 596423688 OIROOHSVWWARDJ-LLVKDONJSA-N 299.287 -0.453 5 20 CBBD COC(=O)[C@@H](C)OC(=O)Cn1cc([N+](=O)[O-])cn1 755956207 GRIVCBZXOYPKSI-ZCFIWIBFSA-N 257.202 -0.104 5 20 CBBD COCCOc1ccc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 848106565 LTOBYQGRGSRLEJ-NXEZZACHSA-N 296.283 -0.217 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CCOC1 848319543 LMDKIIYSGUTXGD-LBPRGKRZSA-N 294.267 -0.449 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(CO)CCOCC1 1319387956 IFVRMAVRKSTPKS-UHFFFAOYSA-N 298.299 -0.303 5 20 CBBD Cc1nncn1CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 1339397224 RHNHQKBEQBGSEA-UHFFFAOYSA-N 293.287 -0.184 5 20 CBBD Cc1nn(C)c(C(=O)N2CC(C(=O)O)C2)c1[N+](=O)[O-] 1594479902 ASHMMKVLDNPTSE-UHFFFAOYSA-N 268.229 -0.207 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1C[C@@H](C(=O)O)C1 1610677799 NUKIFUVZNJRKOG-OCAPTIKFSA-N 295.251 -0.264 5 20 CBBD CNC(=O)Cn1cc(C(=O)OC)cc([N+](=O)[O-])c1=O 41744383 BVGOMPGQWNDPDB-UHFFFAOYSA-N 269.213 -0.711 5 20 CBBD Cc1nn(C)c(N2CC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 52394022 ZWSTVMLXKYBQLJ-SSDOTTSWSA-N 253.262 -0.052 5 20 CBBD C[C@H](CO)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 122819935 SDHIEAMDQSAUIX-QMMMGPOBSA-N 271.277 -0.281 5 20 CBBD COC[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 159482436 ZHUKHGPHNOHNNL-SSDOTTSWSA-N 269.257 -0.086 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249616185 SUXYVRUSVAJWFD-FBIMIBRVSA-N 297.315 -0.734 5 20 CBBD CN1CC[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 330708097 MYIXBKOXUJHKAH-SECBINFHSA-N 267.289 -0.141 5 20 CBBD CN1CCO[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@@H]21 355503135 FIBCMEMENGXPCT-VHSXEESVSA-N 295.299 -0.517 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H]3CNC[C@H]3C2)n1 359284825 VDJNDVZNZBZLJC-UWVGGRQHSA-N 251.290 -0.058 5 20 CBBD CNc1nccc(C(=O)NCC(C)(C)C(N)=O)c1[N+](=O)[O-] 584240550 KXCGRCBKXXKJHJ-UHFFFAOYSA-N 295.299 0.273 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@H]([C@H](C)N)C2)c1[N+](=O)[O-] 592308922 PBTBEQLXPPPXTA-XPUUQOCRSA-N 283.288 -0.185 5 20 CBBD Nc1nc(NC[C@@]2(OCCO)CCOC2)ncc1[N+](=O)[O-] 596423702 OIROOHSVWWARDJ-NSHDSACASA-N 299.287 -0.453 5 20 CBBD CCN(CCO)S(=O)(=O)c1cccnc1[N+](=O)[O-] 611018639 ZEJFUVOVPGHFCC-UHFFFAOYSA-N 275.286 -0.007 5 20 CBBD C[C@@H](CC(N)=O)Nc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820235699 UIGAFRXYFURSKU-YFKPBYRVSA-N 292.259 -0.154 5 20 CBBD C[C@@]1(C(=O)O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 828024249 KHLLJHFWIJTWMN-CMPLNLGQSA-N 298.299 -0.051 5 20 CBBD COC(=O)[C@]1(F)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839696325 QJBSXWDVWPWMKD-XSSZXYGBSA-N 260.221 -0.235 5 20 CBBD CCNC(=O)NCCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842302468 SPFMGUNFLJZIJW-HTQZYQBOSA-N 259.262 -0.096 5 20 CBBD CS(=O)(=O)N[C@@H]1CCCN(CC[N+](=O)[O-])C1 929470722 GLXTYGDGUJSIAF-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD Cc1[nH]ccc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990732537 KBWYDZOGGIIQCJ-GHMZBOCLSA-N 292.295 -0.071 5 20 CBBD Cn1nccc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031661840 KEVSNZRFCKHUFT-VXGBXAGGSA-N 293.327 -0.367 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCNC2(CCC2)C1 1261495672 POFICBQBNWSCDI-VIFPVBQESA-N 294.315 -0.023 5 20 CBBD COC(=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319645120 DWYOVQUCDFMUHA-UHFFFAOYSA-N 256.218 -0.379 5 20 CBBD CCOC[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)CCO1 1339541644 KPSNQMCSXQQDIL-SECBINFHSA-N 285.304 -0.167 5 20 CBBD C[C@H](O)[C@@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1603694015 NAVLGOHTNLWCCH-FSPLSTOPSA-N 295.259 -0.677 5 20 CBBD O=C1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CN1 1609587201 IPHFAIMCFAQZFM-YFKPBYRVSA-N 290.243 -0.530 5 20 CBBD COc1ccc(S(=O)(=O)NCCO)c([N+](=O)[O-])c1 35610863 AAVXHOHSTGQICU-UHFFFAOYSA-N 276.270 -0.126 5 20 CBBD CN1CC[C@H](N(C)c2c([N+](=O)[O-])ncn2C)C1=O 77992039 IMKFQPOBIMXXIK-ZETCQYMHSA-N 253.262 -0.005 5 20 CBBD NC(=O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1F 127976422 RSUINGGNXNBIMG-UHFFFAOYSA-N 255.205 -0.122 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 195143966 JLKGCXNNFHLIRQ-RCOVLWMOSA-N 293.283 -0.174 5 20 CBBD NC(=O)N1CCC[C@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)C1 340921049 UCXASEHMKSNVMV-SSDOTTSWSA-N 295.303 -0.409 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 344212335 HCJYBMYWELOLTN-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD Cc1nnc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1C 345369962 BYSOQMFGEAWEMP-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD CCN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 352291658 BOUXYDBLGFBHSF-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD Cn1nnnc1CNC(=O)c1cccc([N+](=O)[O-])c1N 357102935 SDCSNUSZMFOCSI-UHFFFAOYSA-N 277.244 -0.370 5 20 CBBD CS(=O)(=O)N1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)C1 400185159 CJPMGZQBYJYVLX-ZETCQYMHSA-N 287.301 -0.169 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 494649164 QDINYSNUAZLUKT-ONGXEEELSA-N 298.299 -0.210 5 20 CBBD CC[C@@H]1CN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 563645574 FGGUXFZLCYBBMW-SECBINFHSA-N 282.304 -0.261 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(C)(C(N)=O)C1 584293444 IMLJTKAXDNSHEC-UHFFFAOYSA-N 267.245 -0.724 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 588864313 DGILCUSPXBJRDV-ZETCQYMHSA-N 257.246 -0.160 5 20 CBBD COCCOCCOC(=O)Cn1ccc([N+](=O)[O-])n1 729094387 CHUHJNYVIUGGIU-UHFFFAOYSA-N 273.245 -0.003 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCN1CCOC1=O 766650778 SNXIESQRQVJGTB-UHFFFAOYSA-N 284.228 -0.063 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)n1 820019532 YURSGHAJIOJNAK-UHFFFAOYSA-N 291.271 -0.150 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 854467334 FFXUPLLWXLPPOK-CMPLNLGQSA-N 297.311 -0.333 5 20 CBBD CC(C)[C@@H](O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411530 KCLHQOBKCHWWJA-NSHDSACASA-N 283.284 -0.110 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@H](N)C2)c1[N+](=O)[O-] 1327061008 XDKUPXDJSJZOGB-SSDOTTSWSA-N 253.262 -0.190 5 20 CBBD CC(C)(CCC(=O)NC1(C(N)=O)CCOCC1)[N+](=O)[O-] 1330941618 WMNQYBKXNUVXCV-UHFFFAOYSA-N 287.316 -0.027 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC1(C(N)=O)CC1 1332549716 RRXRLXVNMFPZSK-UHFFFAOYSA-N 281.272 -0.376 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnnn1C 1336157786 GFDKYRJOHHTHPJ-ZCFIWIBFSA-N 280.248 -0.808 5 20 CBBD NC(=O)c1cc(N2CCO[C@@H](C(=O)O)C2)ccc1[N+](=O)[O-] 1594648736 JKDUTEIOPWLARC-SNVBAGLBSA-N 295.251 -0.017 5 20 CBBD COCCN(C)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 41967701 XKNMQFGPPQZYNO-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD C[C@H]1CN(C[C@H](O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)O1 152448473 MBYDSYOLJDXSKZ-AEJSXWLSSA-N 285.304 -0.344 5 20 CBBD CC(=O)N1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174646547 QSAKHCJODNUABF-LBPRGKRZSA-N 297.315 -0.684 5 20 CBBD Cn1ccnc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 264362611 YVBYQKWMFLZALN-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD C[C@H]1CN(C)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330676328 UDNYLVBWJHRPJO-JTQLQIEISA-N 294.311 -0.081 5 20 CBBD CNC(=O)NC(=O)CN1CCc2ncc([N+](=O)[O-])cc2C1 332677388 KOBTXEHDAFGWRT-UHFFFAOYSA-N 293.283 -0.197 5 20 CBBD Cn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])n1C 345673647 CKNSWGAZDSLAKX-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD CC(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1 566284527 DHESJSDSTGATQW-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CNc1nc(C(=O)N[C@@H](CO)C(=O)OC)ccc1[N+](=O)[O-] 578244213 SWYBWSAEBUQLQE-ZETCQYMHSA-N 298.255 -0.705 5 20 CBBD C[C@@H](CO)CNS(=O)(=O)c1ncccc1[N+](=O)[O-] 594761149 GQOZYGPRZLQJLZ-SSDOTTSWSA-N 275.286 -0.104 5 20 CBBD CCN(CC(=O)NC)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 748838490 UMCVOQAMPZYUHF-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCN1CCOCC1 917526851 YTUBOOVMCMISOY-UHFFFAOYSA-N 284.272 -0.333 5 20 CBBD CN(CC(N)=O)C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 920449233 JJSTULMFSAJHMA-UHFFFAOYSA-N 291.267 -0.112 5 20 CBBD CN(C(=O)c1cocn1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953881487 MZNJPDGFYXXORW-PSASIEDQSA-N 294.267 -0.377 5 20 CBBD O=C(c1cnon1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1011114271 CRZZGSYVIXPGHC-VXNVDRBHSA-N 295.255 -0.981 5 20 CBBD O=C1C[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CCN1 1319267402 WBLPESULFJIGJW-MRVPVSSYSA-N 281.272 -0.566 5 20 CBBD Cn1cc(CN2C[C@H]3COC[C@@]3(C(=O)O)C2)c([N+](=O)[O-])n1 1574457439 ATWCQPCXPJUMPH-CABZTGNLSA-N 296.283 -0.139 5 20 CBBD O=C(O)CCCONC(=O)Cn1ccc([N+](=O)[O-])n1 1601994813 HUSZBGGEGFIOCV-UHFFFAOYSA-N 272.217 -0.296 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)C(=O)O)c1 1604382450 NOBJBTOTVKVMOX-UHFFFAOYSA-N 284.180 -0.803 5 20 CBBD CN1CCN(Cc2cn(C)nc2[N+](=O)[O-])C[C@@H](C(=O)O)C1 1606244476 JIVKZUCAAYREFX-JTQLQIEISA-N 297.315 -0.224 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)Cn1ccc([N+](=O)[O-])n1 50469667 LZSBYARSSHVMLO-LURJTMIESA-N 256.218 -0.229 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 55038817 QZVFJSFZXYMAGB-UHFFFAOYSA-N 283.288 -0.226 5 20 CBBD CNC(=O)c1ccc(NC(CO)CO)c([N+](=O)[O-])c1 97093811 LECGGAGXEDRLLO-UHFFFAOYSA-N 269.257 -0.281 5 20 CBBD CCN(C)C(=O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 218121302 FBIYHZPJTDUSHV-SNVBAGLBSA-N 285.304 -0.780 5 20 CBBD Cn1ccnc(NCCn2cc([N+](=O)[O-])cn2)c1=O 269080500 FFTIBXKVZXBBAL-UHFFFAOYSA-N 264.245 -0.003 5 20 CBBD C[C@H](CO)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 284804307 OUMRRMWTKFTDOE-SCZZXKLOSA-N 258.278 -0.535 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@]1(CCO)CCOC1 331348880 UHPAOCSOYWTDMW-LBPRGKRZSA-N 298.299 -0.243 5 20 CBBD CCNC(=O)NCCNC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] 351779294 AMFRKPGJLWQNED-UHFFFAOYSA-N 298.303 -0.071 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 354061268 NCEJJZMGUZLFLO-ZETCQYMHSA-N 281.272 -0.036 5 20 CBBD O=C(NCCNc1ncc([N+](=O)[O-])cn1)c1cnccn1 354578759 QURQMURXPMDPFP-UHFFFAOYSA-N 289.255 0.017 5 20 CBBD CNc1ccc(C(=O)N[C@@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 393930293 JULQKRQNHRNDSL-SECBINFHSA-N 293.283 -0.289 5 20 CBBD C[C@@]1(CO)CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427079617 YUWBQANRQIBWMA-KCJUWKMLSA-N 283.288 -0.146 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CCN1CCO 428144794 JNSJOGPDXGGDKO-VIFPVBQESA-N 297.315 -0.533 5 20 CBBD Nc1nccc(C(=O)OC[C@H]2CNC(=O)O2)c1[N+](=O)[O-] 496332683 WJTWTHWIZOCYEV-RXMQYKEDSA-N 282.212 -0.163 5 20 CBBD CCN(CC(N)=O)C(=O)c1ccnc(NC)c1[N+](=O)[O-] 553558662 NOPXGAXYNMRTCG-UHFFFAOYSA-N 281.272 -0.021 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H](CCO)C(F)F)c1 578651924 PSGNGLYKWNIPGG-RKDXNWHRSA-N 294.258 -0.242 5 20 CBBD C[C@@H](O)CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 594064153 KZRRLDACWPUBBA-BXKDBHETSA-N 284.316 -0.003 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])cn1 831170323 KGAQVLLTAQDARB-UHFFFAOYSA-N 297.223 -0.310 5 20 CBBD CC(C)(CCS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 846654347 HVJYMUPYJYQILC-HTQZYQBOSA-N 278.330 -0.019 5 20 CBBD C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C(=O)O1 848073016 HXTKYOUAXIDHLV-XINAWCOVSA-N 254.202 -0.248 5 20 CBBD CNS(=O)(=O)CCCNC(=O)CCC(C)(C)[N+](=O)[O-] 863430221 VHOJRLVNJDSRHM-UHFFFAOYSA-N 295.361 -0.123 5 20 CBBD COCCN1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1 1048812581 LHJISIVZOYYSAP-WRWGMCAJSA-N 283.328 -0.312 5 20 CBBD CNc1nccc(C(=O)N2C[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 1118317608 RLHPCHYLCBVUAY-APPZFPTMSA-N 296.283 -0.543 5 20 CBBD Cn1ncc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1157767494 OPVYJKOVEDVKGE-NXEZZACHSA-N 282.304 -0.924 5 20 CBBD CNC(=O)[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])nc1C 1253671885 RMRXNMNWFSQJGQ-ZETCQYMHSA-N 283.288 -0.259 5 20 CBBD CO[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1320651960 FEHPYDXUGNXBPB-MRVPVSSYSA-N 270.245 -0.227 5 20 CBBD Cc1nn(C)c(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 1323607705 ARRAVHAKRWBERB-UHFFFAOYSA-N 280.248 -0.947 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)CCn1cc([N+](=O)[O-])cn1 1326744396 CJGHUNVIPVWBQD-UHFFFAOYSA-N 279.260 -0.042 5 20 CBBD COC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2CC[C@H]1N2CC[N+](=O)[O-] 1598737106 HXRVSFTYTSZFAN-LURQLKTLSA-N 272.257 -0.400 5 20 CBBD CN(CC(N)=O)C(=O)CNc1ccccc1[N+](=O)[O-] 65867336 AOEWMQYPVXWLEI-UHFFFAOYSA-N 266.257 -0.050 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 107186485 MKILENFBAZSIIB-LLVKDONJSA-N 296.283 -0.617 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1C(=O)O 111248045 VSRGCRCMCSRHSK-YUMQZZPRSA-N 282.256 -0.030 5 20 CBBD O=C1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CCN1 159879954 QQPNDOOAODCEJV-UHFFFAOYSA-N 265.225 -0.128 5 20 CBBD Cc1cc(N2CCN(C(=O)CO)CC2)ncc1[N+](=O)[O-] 301833960 KAJISWHYNGGYRK-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1cccc([N+](=O)[O-])c1=O 344183802 UIMVKCQQFMJPHI-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD O=[N+]([O-])c1ccc(-c2noc(NC[C@H](O)CO)n2)cc1 436444725 ANLIXGHUJFDJPF-VIFPVBQESA-N 280.240 0.410 5 20 CBBD NCCN(CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)CO 595903636 ZCVPNMBVGQAMLK-ZDUSSCGKSA-N 283.328 -0.249 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 783762728 UQRODWZWQIGWOM-ZETCQYMHSA-N 294.267 -0.002 5 20 CBBD C[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1nnnn1C 787766495 FGVYPXNWVJELTG-YFKPBYRVSA-N 281.232 -0.230 5 20 CBBD NC(=O)C(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CC1 1110324702 WNDBAXUYXYIPSB-UHFFFAOYSA-N 279.256 -0.464 5 20 CBBD COc1cncc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936636 NLUCKAJRWPYCKO-NXEZZACHSA-N 295.299 -0.644 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NN1CC(=O)N(C)C1=O 1320525990 GYWCWZHNPYQDJH-UHFFFAOYSA-N 296.243 -0.975 5 20 CBBD CNC(=O)[C@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1329426495 FCVKEUXMLHPVTD-QWRGUYRKSA-N 283.284 -0.675 5 20 CBBD C[C@@H](CCO)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1346306924 PHEILLYOHZUWED-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD CC[C@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1604912425 GTOBLCPBYVDEOV-ONGXEEELSA-N 286.288 -0.005 5 20 CBBD O=C(N[C@@H](C(=O)O)C1CC1)c1n[nH]cc1[N+](=O)[O-] 1608384872 WXPMZGVXFROZOI-ZCFIWIBFSA-N 254.202 -0.089 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCS(=O)(=O)NC1CC1 25501993 VGVUKLKGXFNZQR-UHFFFAOYSA-N 289.317 -0.178 5 20 CBBD NC(=O)CCCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 42043705 UUMLEJMFTUZWMM-UHFFFAOYSA-N 294.267 -0.085 5 20 CBBD CNC(=O)CNC(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 48958648 OIRDUBLHVOKHLL-UHFFFAOYSA-N 294.267 -0.296 5 20 CBBD O=C1CN(C(=O)CNc2cccc([N+](=O)[O-])c2)CCN1 73449799 RPWAZDRMBXGALR-UHFFFAOYSA-N 278.268 -0.035 5 20 CBBD C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 90275666 MBIPTISCZSNHME-VIFPVBQESA-N 258.186 -0.247 5 20 CBBD COC(=O)[C@@H]1C[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 122256094 LZNRYVDBWMXEHA-DTWKUNHWSA-N 282.256 -0.283 5 20 CBBD COC(=O)[C@H]1CN(CCn2c([N+](=O)[O-])cnc2C)CCO1 133785222 TWAZMAAPNAZQCA-SNVBAGLBSA-N 298.299 -0.026 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 188974756 LFRANQYMJNHMNS-UHFFFAOYSA-N 287.297 -0.126 5 20 CBBD CNC[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 237236109 OLQVHHXEDPXRTG-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD CC(=O)NC1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 276263858 WZIGCKQUAKCWIV-UHFFFAOYSA-N 267.245 -0.862 5 20 CBBD O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1cc([N+](=O)[O-])[nH]n1 286033065 JHKYERRFFOEKJL-ZCFIWIBFSA-N 279.256 -0.189 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](C(N)=O)C(C)C)c1[N+](=O)[O-] 337324139 TZMFGFKNJANBMB-ZCFIWIBFSA-N 269.261 -0.134 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCC[C@H]1CCO 342997227 GTUZDCCAFMEPBY-VIFPVBQESA-N 283.288 -0.050 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(O)nn1 361958536 SNSOLOKSOCADQM-UHFFFAOYSA-N 291.223 -0.109 5 20 CBBD CN(C)S(=O)(=O)CCn1cc([N+](=O)[O-])cc(F)c1=O 514672851 VQSGZOCIBGJWFS-UHFFFAOYSA-N 293.276 -0.213 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] 571047634 GFSHBPJAWBSZOA-VIFPVBQESA-N 293.327 -0.190 5 20 CBBD O=[N+]([O-])c1cnn(CCNC2=C3OCCN=C3NC=N2)c1 591150674 GTFGHSFZOAERGF-UHFFFAOYSA-N 291.271 -0.390 5 20 CBBD CCC[C@@H](O)[C@H](CO)Nc1ccc(N)c([N+](=O)[O-])n1 596272486 HMQDWYLEZWCIQJ-DTWKUNHWSA-N 270.289 0.506 5 20 CBBD C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 610714623 ZZTGSHMQWFOHBW-WPRPVWTQSA-N 294.315 -0.215 5 20 CBBD O=C(O)C1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 819281169 MDXYUHWOJGVQMH-LLVKDONJSA-N 298.299 -0.051 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 832847722 QWEZUFWBXFRSDQ-JTQLQIEISA-N 284.228 -0.400 5 20 CBBD COC(=O)c1n[nH]cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840425043 GKPBPWRDQGLXCQ-INEUFUBQSA-N 254.202 -0.200 5 20 CBBD O=C(NS(=O)(=O)CC(F)(F)F)[C@@H]1C[C@H]1[N+](=O)[O-] 842313206 NLRRJIFAPPNYAL-QWWZWVQMSA-N 276.192 -0.340 5 20 CBBD Cc1noc(COC(=O)CN2CCOCC2=O)c1[N+](=O)[O-] 853916618 OCEQDDMQNYTKII-UHFFFAOYSA-N 299.239 -0.207 5 20 CBBD COC[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 886875963 YOFNPPFCPCPXIZ-SECBINFHSA-N 284.272 -0.335 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1 923285408 BJAWIUBBGPUIBC-GXSJLCMTSA-N 269.305 -0.554 5 20 CBBD COCC(COC)N1CCN(CC[N+](=O)[O-])CC1 930712967 QURISMRDQJAYOY-UHFFFAOYSA-N 261.322 -0.458 5 20 CBBD Cn1cnnc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022063732 JTZFROUGVMXKCD-UTINFBMNSA-N 294.315 -0.783 5 20 CBBD Cc1nc2c(n1CCO)CC[C@H](NCC[N+](=O)[O-])C2 1262489704 GPYUPMXBTAIIKY-JTQLQIEISA-N 268.317 -0.093 5 20 CBBD Cn1cc([C@H](CO)NC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 1319632447 WCTSXBMWHKMPTO-VIFPVBQESA-N 294.271 -0.625 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1(CCO)CC1 1324360553 UUMHPRLTLQNXMO-UHFFFAOYSA-N 255.234 -0.783 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC(C)(C(=O)O)C2)n1 1600970052 YTCYCVSCDVGJCV-UHFFFAOYSA-N 268.229 -0.125 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 48802630 KKLDSHQFNWTIIA-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cn1C 135529853 KPDSVZALJMWEPQ-JTQLQIEISA-N 297.267 -0.053 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 261936860 FKUWJIOUYLMURH-LLVKDONJSA-N 297.267 -0.018 5 20 CBBD CC(C)(O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 266589326 WTCCVOLQXUWWKQ-UHFFFAOYSA-N 269.257 -0.356 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H](O)C[C@H]1CO 274829147 RSVORMCKAUDIHQ-IUCAKERBSA-N 282.252 -0.132 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@@H]3CNC[C@H]3C2)c1 359276041 LRPYBUMXQAPDBD-UWVGGRQHSA-N 251.290 -0.058 5 20 CBBD Cc1c(CNC(=O)C(=O)N(C)CCO)cccc1[N+](=O)[O-] 360284369 FFVNMDBAXKQTDS-UHFFFAOYSA-N 295.295 -0.030 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 394068332 NDHULTHMVXEKQF-QMMMGPOBSA-N 267.289 -0.444 5 20 CBBD CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCNC1=O 442942806 NCQOAZITZBTWLP-LURJTMIESA-N 267.245 -0.332 5 20 CBBD COC(=O)NCC(=O)OCCn1cc([N+](=O)[O-])cn1 493073360 LTCZTYGNNMXPLN-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD COC[C@@]1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCN1 570962845 KCDUARWHWBDTFB-NSHDSACASA-N 283.288 -0.184 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CNC(CO)CO)c1 578651858 MDGMBNLMVCSAJN-NSHDSACASA-N 286.284 -0.723 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC(N2CC[C@@H](O)C2)C1 593249639 IKZIURHLQWNCNM-LLVKDONJSA-N 294.311 -0.176 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CCCNC2=O)c1[N+](=O)[O-] 619868208 ZVXBPIFBAHTZOF-SSDOTTSWSA-N 281.272 -0.118 5 20 CBBD COCCS(=O)(=O)NC(=O)c1cc([N+](=O)[O-])cn1C 732521409 ODBZZHNXZYYVKH-UHFFFAOYSA-N 291.285 -0.361 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@H]2C[C@@]2(CO)C1 783816883 ZORPWDWROORMQV-RNCFNFMXSA-N 293.279 -0.403 5 20 CBBD O=C(O)NCC(=O)NCCn1cc([N+](=O)[O-])cn1 832396711 CWYJJKCIARRJPS-UHFFFAOYSA-N 257.206 -0.825 5 20 CBBD C[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)C[C@H](CO)O1 893416338 IESJUYVZMQLHIF-HTQZYQBOSA-N 256.262 -0.086 5 20 CBBD C[C@H]1CNCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1119618490 LKLQTMOIKKCTTR-GXSJLCMTSA-N 269.305 -0.554 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@]1(C)CCOC1=O 1261223624 CADINTDXBIPKJY-SNVBAGLBSA-N 268.229 -0.236 5 20 CBBD CCCNC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1353862283 VHYXKFCTXKNUNJ-SSDOTTSWSA-N 283.288 -0.027 5 20 CBBD Cn1cc(CN2CCC([C@H](O)C(=O)O)CC2)c([N+](=O)[O-])n1 1600951766 LEFHSZVZBISSNF-JTQLQIEISA-N 298.299 -0.014 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCN2CCCC2)c1 54126946 NIDUJPAYLWKUEK-LBPRGKRZSA-N 283.332 -0.162 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H](CN)C1 122610815 OWSUKRLTPXJKFH-SECBINFHSA-N 267.289 -0.362 5 20 CBBD O=C(O)CNC(=O)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 159425342 RDZJKMGOLPVZOZ-UHFFFAOYSA-N 299.214 -0.336 5 20 CBBD CN1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)C1=O 266939010 PIDXJVXYDMQWLE-SNVBAGLBSA-N 267.289 -0.046 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCn2nnnc21 354454771 HAFCYXNTKRYFJI-UHFFFAOYSA-N 292.259 -0.395 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 360612476 JRJIVLOBWUWNRH-ZETCQYMHSA-N 285.256 -0.413 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC(CC(N)=O)C1 527025833 USJIGLYJXHBHRF-UHFFFAOYSA-N 266.257 -0.119 5 20 CBBD O=C1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CN1 543565776 MLVOTYLGFWKNQJ-MRVPVSSYSA-N 279.252 -0.022 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](O)C2CC2)c1[N+](=O)[O-] 553199071 MZLOVXRQOAQDIA-SECBINFHSA-N 280.284 0.532 5 20 CBBD CNc1nccc(C(=O)NC[C@@H]2COCCO2)c1[N+](=O)[O-] 580447448 IIICVZAJWRWMCO-MRVPVSSYSA-N 296.283 0.177 5 20 CBBD NC(=O)N[C@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1 588008762 YQORLRXHCDFIHM-QMMMGPOBSA-N 295.299 -0.084 5 20 CBBD Cc1nonc1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 735820050 CDMFDWUATMIHQV-UHFFFAOYSA-N 293.239 -0.236 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nn1c(O)nnc1O 816732908 ATHDSKBYBIPKMK-UHFFFAOYSA-N 280.200 -0.315 5 20 CBBD Nc1ccc(NC(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 823973249 FQUDNAVFOONQIJ-UHFFFAOYSA-N 297.271 -0.593 5 20 CBBD CCC(=O)N1CC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2 965376770 SVWSCRJTJFXHMR-NXEZZACHSA-N 297.311 -0.499 5 20 CBBD CCCNC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 1251188755 OLVKJJLHGXLLPB-UHFFFAOYSA-N 284.276 -0.781 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NC[C@@H]1CC(C(N)=O)=NO1 1324052287 ANMCZAPAYYHINR-ZETCQYMHSA-N 279.256 -0.238 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 1344390509 BFGBBPDKMUUYMF-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD Cc1[nH]nc(C(=O)N2CCOC[C@H]2CC(=O)O)c1[N+](=O)[O-] 1599968215 LXUQRPRAQOGFHV-SSDOTTSWSA-N 298.255 -0.058 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)O 1610615765 VZBYAPSVWUYAJG-BDINMYNLSA-N 280.240 -0.269 5 20 CBBD CCCN(CC(=O)NC)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173556335 GQEBADFMFMINHS-NSHDSACASA-N 299.331 -0.390 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)C(=O)[C@@H]1C 188489182 UIIGLMUKZHIQIM-QMMMGPOBSA-N 295.299 -0.211 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 217712129 CUKWUGGUAYELTC-VIFPVBQESA-N 268.225 -0.142 5 20 CBBD C[C@H]1CN(C)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 331256444 WKMZPVSXSYSIOG-JQWIXIFHSA-N 283.332 -0.212 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])nn1C 351781184 HUYAUPBSISWZHG-UHFFFAOYSA-N 284.276 -0.623 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@H](C)CN1 356926264 SQLGKBIEJOVXFQ-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](CO)[C@H](O)C1 564402041 SVHDYGUAUWNNAC-LDYMZIIASA-N 295.295 -0.008 5 20 CBBD O=C(NC[C@H]1CCCNC1=O)c1cnc(O)c([N+](=O)[O-])c1 590333257 JLQMAZBBQJKAEP-SSDOTTSWSA-N 294.267 -0.049 5 20 CBBD O=C(O)[C@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])s1 604398690 BMGAKDXJXSDROM-BYPYZUCNSA-N 296.282 -0.620 5 20 CBBD CC(C)(C(=O)N1CCCNC(=O)C1)n1cc([N+](=O)[O-])cn1 726779122 OQIFOSLBSBOCIZ-UHFFFAOYSA-N 295.299 -0.125 5 20 CBBD C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)NC(N)=O 746594574 GLZJXARECBKDQC-LURJTMIESA-N 299.243 -0.692 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C(=O)O1 808207842 KIWMQHJJTQHCJA-APPZFPTMSA-N 295.251 -0.423 5 20 CBBD C[C@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC(=O)N1 836853466 QFGWWBRZNQKNFH-QPUJVOFHSA-N 293.279 -0.025 5 20 CBBD CC[C@@]1(C)NC(=O)N(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839463226 AZUQLQRCPGQWAC-OXOINMOOSA-N 270.245 -0.597 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 854467335 FFXUPLLWXLPPOK-JQWIXIFHSA-N 297.311 -0.333 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@H]3NCC[C@H]3C2)c1 923360130 WIEXXRIYPPFYGV-UHTWSYAYSA-N 295.343 -0.164 5 20 CBBD CNCCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923377023 FBIWYWSWTRBEQA-LLVKDONJSA-N 271.321 -0.307 5 20 CBBD Cn1nncc1C(=O)NCCNc1ncccc1[N+](=O)[O-] 1093594124 YCUSOCFHEZCJEQ-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD CN(C)CCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1094089963 QREJPVWCKZHFEX-UHFFFAOYSA-N 297.319 -0.553 5 20 CBBD CCOC(=O)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319475314 SUMGOMLQLGYFMK-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD CCOCCNC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1340390278 RQASWTQXMZMVBT-UHFFFAOYSA-N 299.287 -0.940 5 20 CBBD CN1C(=O)CC[C@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 1344024893 WPTWVQBTEQHKAC-ZETCQYMHSA-N 283.244 -0.650 5 20 CBBD CN1CCN(CCCNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1344129512 NJXGSBVNYFQODP-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD O=[N+]([O-])Cc1nnc(N2CCOCC2)n1C[C@H]1CCOC1 1346829862 OQKGBUYOVMIWFB-SNVBAGLBSA-N 297.315 -0.072 5 20 CBBD C[C@@](NC[C@H](O)CO)(C(=O)O)c1cccc([N+](=O)[O-])c1 1593285410 DPKNWPABDZOZMK-JQWIXIFHSA-N 284.268 -0.163 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)O 1598333668 LJRFFAZMUZMENH-VIFPVBQESA-N 297.267 -0.164 5 20 CBBD CN1C[C@H](C(=O)O)N(Cc2cccnc2[N+](=O)[O-])CC1=O 1598565593 GQTUJVQJBVTFPR-SECBINFHSA-N 294.267 -0.283 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)NCCOCCO)c1 52925273 JGJAPUAJKMIZFZ-UHFFFAOYSA-N 290.297 -0.118 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1O 272619801 XXRUVCZWMFKYGG-UHFFFAOYSA-N 297.271 -0.304 5 20 CBBD O=C1CN(CCNc2ncccc2[N+](=O)[O-])CCN1 273003049 RMOVDOYRXOXDEM-UHFFFAOYSA-N 265.273 -0.167 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 339895154 VNJJJULIZFYCTO-VIFPVBQESA-N 281.272 -0.342 5 20 CBBD Cn1cnnc1CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 352913371 HNSUTFHTLNRBQN-UHFFFAOYSA-N 277.244 -0.138 5 20 CBBD CC(C)(C(=O)N1CCO[C@H](CN)C1)n1cc([N+](=O)[O-])cn1 358499745 RDIXQWFHRIEZKY-SNVBAGLBSA-N 297.315 -0.288 5 20 CBBD N[C@H]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCN2C1=O 519613890 LJSRUQLAUWBCJW-YUMQZZPRSA-N 293.283 -0.693 5 20 CBBD O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1c[nH]nc1[N+](=O)[O-] 554877774 PYJLXGAHGHOUJZ-ZCFIWIBFSA-N 279.256 -0.189 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C1=O 559277916 XNLICFHIUCXESG-ZETCQYMHSA-N 293.235 -0.213 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)C1(O)CNC1 595923718 ZGODQNFYMAFHPF-UHFFFAOYSA-N 280.284 -0.543 5 20 CBBD Nc1ccc(NC[C@@H](O)Cn2ccnn2)nc1[N+](=O)[O-] 596271627 RUZCQYSRQQVULX-SSDOTTSWSA-N 279.260 -0.364 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 863706508 LBQFIZVLZIWSBJ-RXMQYKEDSA-N 271.233 -0.544 5 20 CBBD O=C(NCCNCc1nc(C2CC2)n[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936579 MCBLRXAFLKHBNP-RKDXNWHRSA-N 294.315 -0.447 5 20 CBBD COCCC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253427272 CUOCPICDMFLZIY-UHFFFAOYSA-N 298.251 -0.095 5 20 CBBD C[C@H](CN1CCCC1=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1318013787 ZMGJDEDSRLLEND-MRVPVSSYSA-N 296.287 -0.687 5 20 CBBD O=C(NCCN1CC=CC1)c1n[nH]cc1[N+](=O)[O-] 1323177688 QMNCGIYTTABSJX-UHFFFAOYSA-N 251.246 -0.081 5 20 CBBD NC(=O)c1ccnc(N2CC(=O)N(C3CC3)C2)c1[N+](=O)[O-] 1330042609 VBFGEICAASHSMM-UHFFFAOYSA-N 291.267 -0.143 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCS(=O)CC1 1342652686 WYJRCBAIPWFZCD-UHFFFAOYSA-N 273.318 -0.357 5 20 CBBD CC(=O)NC[C@@H](C)OC(=O)Cn1cc([N+](=O)[O-])cn1 179260324 GZLYWRSHOHMUOL-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD O=C(c1cc(F)ccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236571971 IMVPOHUMMAGJCU-UWVGGRQHSA-N 270.216 -0.089 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286686251 FGNUCEOOUBJWTF-IONNQARKSA-N 298.255 -0.544 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@H](O)C(N)=O 289585737 JAQYYGMREXKRHL-SNVBAGLBSA-N 297.267 -0.052 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 340490610 AMPHRULJDXHYKW-MRVPVSSYSA-N 267.245 -0.862 5 20 CBBD CC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354096758 LMTUGHKAPBIPAN-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD Cn1c(C(=O)NCCN2C(=O)CNC2=O)ccc1[N+](=O)[O-] 354516511 USMSQOMTWYEKQV-UHFFFAOYSA-N 295.255 -0.785 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](C)O1 355843616 GYNWJYQUCJJERV-POYBYMJQSA-N 298.255 -0.280 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1[C@H]2CNC[C@H]12 366599686 OFEZKWGBFROZDT-YUMQZZPRSA-N 251.246 -0.875 5 20 CBBD O=C(CO)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 408374431 PAFIIOWTTAARGS-UHFFFAOYSA-N 254.246 -0.053 5 20 CBBD O=C1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CN1 436892853 LKJPPQGJQJGYCW-ZCFIWIBFSA-N 265.225 -0.081 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@H](O)CO 592430496 UVOYBECDTVDNPI-VHSXEESVSA-N 286.284 -0.723 5 20 CBBD NS(=O)(=O)c1cccc(NCc2cnn[nH]2)c1[N+](=O)[O-] 612660672 LMRPHZABXIPJJD-UHFFFAOYSA-N 298.284 -0.028 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C1=O 755739315 YOIHQFNQNOUHNE-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1CC(C)(C)O 839730667 HZLWVGOCVVATNI-GMTAPVOTSA-N 285.344 -0.045 5 20 CBBD CN(CCN(C)c1ccc([N+](=O)[O-])cn1)C(=O)CC(N)=O 1105348501 MMIANTXRRXZDLH-UHFFFAOYSA-N 295.299 -0.240 5 20 CBBD CC1(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)OCCO1 1116436680 BMZFVSIAFHSONE-UHFFFAOYSA-N 297.267 -0.364 5 20 CBBD CC(=O)N(C)CCOCCNc1ncc([N+](=O)[O-])c(N)n1 1127167927 RMXFUAUUCZXTSG-UHFFFAOYSA-N 298.303 -0.126 5 20 CBBD NC(=O)CCCCNC(=O)CCn1cc([N+](=O)[O-])cn1 1324843346 YDDRFLYFQHLYCP-UHFFFAOYSA-N 283.288 -0.047 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@H]2C[C@H]1C(=O)O2 1329109538 WSKCBIUTMKIOBH-RITPCOANSA-N 266.213 -0.532 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCSC1=O 1335973817 YSRXSSQUGZSWIM-ZETCQYMHSA-N 297.292 -0.095 5 20 CBBD C[C@H](c1nnc(N2CC[C@@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1343361002 SMDKQYJYQKTLGN-RNFRBKRXSA-N 268.277 -0.536 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N=S2(=O)CCNCC2)n1 1574225004 VDKQCSLROKAYEH-UHFFFAOYSA-N 287.301 -0.460 5 20 CBBD C[C@@H](O)[C@@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589995172 IVKIQMGFRGMMJY-RFZPGFLSSA-N 253.222 -0.087 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)cccc1N1C[C@H](O)[C@H](O)C1 1593466110 LYVNOPBPWPYGKL-DTORHVGOSA-N 292.255 -0.683 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2CCOC2)c1 38094673 PVIODNXTGGEGMR-MWLCHTKSSA-N 270.289 -0.222 5 20 CBBD COC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 68181077 VYKNGUPUXHBBMF-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N1CCOCC1 71526527 MNVLZAWWUUTEAZ-UHFFFAOYSA-N 281.268 -0.076 5 20 CBBD CC1(C)C(=O)NCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173753402 NNAZTLVVXOXBOL-SNVBAGLBSA-N 297.315 -0.637 5 20 CBBD C[C@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 192531453 IGWMGTGDZRIYAE-ZETCQYMHSA-N 257.250 -0.529 5 20 CBBD O=C(O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 238170228 SPVXNOKBJKBPOH-UHFFFAOYSA-N 256.218 -0.228 5 20 CBBD NC(=O)C1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCCC1 265172595 HKZJDQSFJZOGEL-UHFFFAOYSA-N 295.299 -0.047 5 20 CBBD NS(=O)(=O)c1cc(N2CC[C@@H](O)C2)cc([N+](=O)[O-])c1 265509682 ZIUHBNHOVJQLGE-SECBINFHSA-N 287.297 -0.187 5 20 CBBD CN(C[C@@H](O)CN1CCOCC1)c1ncc([N+](=O)[O-])cn1 273965814 OLRUQOLXFJGQSD-LLVKDONJSA-N 297.315 -0.486 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CCC[C@H]2O)c1 323256456 FUMLBYGDZAIJFK-GMTAPVOTSA-N 270.289 -0.345 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H](O)C1CCOCC1 330853185 RBWIYZBCHKHVLU-NSHDSACASA-N 298.299 -0.305 5 20 CBBD COCC[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 342818649 XUFWCORTROWLOW-RXMQYKEDSA-N 270.249 -0.731 5 20 CBBD O=C1CNC(=O)N1CCCn1cc([N+](=O)[O-])cn1 352289306 HVXQNFZPVQSBTN-UHFFFAOYSA-N 253.218 -0.267 5 20 CBBD O=C(N[C@H]1CCCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 352955771 JBOXMZRXVAJKRK-LURJTMIESA-N 288.285 -0.375 5 20 CBBD N[C@@H]1C[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CCN2C1=O 519613840 LJSRUQLAUWBCJW-HTQZYQBOSA-N 293.283 -0.693 5 20 CBBD Nc1nc(N2CCO[C@H](CC(=O)O)C2)ncc1[N+](=O)[O-] 578991871 HNWRALKPLZFIPU-ZCFIWIBFSA-N 283.244 -0.353 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1CSCN1 583753694 DLJGXDWLGPMYLG-MRVPVSSYSA-N 271.302 -0.430 5 20 CBBD NC(=O)CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 592509796 ABGLXHIAHITVNC-UHFFFAOYSA-N 267.197 -0.461 5 20 CBBD O=C(O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CCC1 594465702 JFRDVSGWNWTHHB-UHFFFAOYSA-N 283.244 -0.348 5 20 CBBD COC(=O)C[C@H](C)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839695646 JRIXRTACSSZLDT-HBNTYKKESA-N 299.327 -0.253 5 20 CBBD COC(=O)C(C)(C)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839729851 BBQZNTFOBYOSIC-NXEZZACHSA-N 299.327 -0.253 5 20 CBBD C[C@H](COC(=O)c1ccn2nnnc2c1)[N+](=O)[O-] 851036373 INPMQISVQKZZOB-ZCFIWIBFSA-N 251.202 -0.054 5 20 CBBD C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])S(C)(=O)=O 856435717 QBCLWLDYRBAQLV-RRKCRQDMSA-N 250.276 -0.799 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN[C@H](C)C1 911810022 KMIRRSOCRHCREI-MRVPVSSYSA-N 267.289 -0.080 5 20 CBBD CNC[C@@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923295024 QNDKWIONQJAMNW-JQWIXIFHSA-N 283.332 -0.164 5 20 CBBD O=[N+]([O-])CCN1C[C@H]2CC[C@H]1CN2CC[N+](=O)[O-] 930706786 ACNYSHZWPIOZRG-AOOOYVTPSA-N 258.278 -0.312 5 20 CBBD CN(CCN(C)c1ccccc1[N+](=O)[O-])C(=O)C(N)=O 1105543188 MVSOMGWGRZJLGN-UHFFFAOYSA-N 280.284 -0.025 5 20 CBBD CCNC(=O)CN1CCC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1227253393 ZJAVOBMSIALHPO-GHMZBOCLSA-N 298.343 -0.632 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCS(=O)(=O)CC1 1319601173 CWNWBMKOQRLZQF-UHFFFAOYSA-N 274.258 -0.812 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCNC1CC1 1329298524 HYUVPFDATHFCEG-UHFFFAOYSA-N 253.262 -0.190 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@@](O)(C(=O)O)C1 1601299675 FUVZVIPTAQMUAC-NSHDSACASA-N 298.255 -0.771 5 20 CBBD CCc1nnc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)o1 1604581233 LYTLDFKSHYRCPU-UHFFFAOYSA-N 291.231 -0.035 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1csc([N+](=O)[O-])c1 37563272 YXNHIJQTZFETGO-ZCFIWIBFSA-N 274.254 -0.080 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 50162262 GRTZRNNOUAXSFF-ZETCQYMHSA-N 270.245 -0.030 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 121203231 XDPWNWQMAQGEBC-MRVPVSSYSA-N 279.256 -0.468 5 20 CBBD CC[S@](=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 132754310 MJODRRAHPYPXCL-APBUJDDRSA-N 290.345 -0.490 5 20 CBBD CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 171730600 JIHSJGGQAYJVJV-VIFPVBQESA-N 269.261 -0.583 5 20 CBBD CC(=O)NC[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 174867599 LKZHGHOUYITZSB-LBPRGKRZSA-N 297.315 -0.372 5 20 CBBD CC(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 176189362 PUEANUCJNNPXCD-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD Nc1c(C(=O)N[C@H]2CNC(=O)C2)cc(F)cc1[N+](=O)[O-] 226799376 OYOTYOSIQZFQQZ-ZCFIWIBFSA-N 282.231 -0.066 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 227044154 ZAEFTRVWNSLJCM-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 262465013 IWDIVHYSXZSHPC-SECBINFHSA-N 298.255 -0.507 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCC(=O)NCCO 271381387 QYXVUWGUYUGQCW-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD CN(C)C(=O)CCNc1ncc([N+](=O)[O-])c(N)n1 301144288 FFLWYERFRMVHJJ-UHFFFAOYSA-N 254.250 -0.143 5 20 CBBD CCN1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1=O 332615031 DYJFEHRYPBQBOM-UHFFFAOYSA-N 267.245 -0.112 5 20 CBBD O=C1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CN1 353905791 DENGUZZNDSMZGX-MRVPVSSYSA-N 279.252 -0.022 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](O)C(F)F 355145007 ANXNTYFYVOOYME-ZCFIWIBFSA-N 278.215 -0.158 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C)C(=O)[C@H]2C)c1[N+](=O)[O-] 428570659 IGISVSPVJGPOTD-SSDOTTSWSA-N 281.272 -0.071 5 20 CBBD CC(C)(C)n1nnc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 594400597 ZMGQMHUOCSMISR-UHFFFAOYSA-N 294.275 -0.011 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCn2cncn2)c1 740090599 ZEHXJQJSPZWDKX-UHFFFAOYSA-N 279.212 -0.254 5 20 CBBD O=C(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NCCO 843072081 TWEUVTOFSAUUGL-LLVKDONJSA-N 283.284 -0.674 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@](C)(C(N)=O)C2)c1[N+](=O)[O-] 1116891758 VIGPUFWMDHKFHO-GFCCVEGCSA-N 295.299 -0.026 5 20 CBBD C[C@H](N)CNC(=O)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1118043549 PCTFTUAJEHKTRC-QMMMGPOBSA-N 292.295 -0.100 5 20 CBBD CNCCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1118135351 MYVYYYCIVAFFBJ-UHFFFAOYSA-N 254.246 -0.535 5 20 CBBD NC(=O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 1319262804 QJHDMZPVWLZCMV-UHFFFAOYSA-N 267.245 -0.827 5 20 CBBD NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1326298413 SJFRLZNYDSFSBP-VIFPVBQESA-N 280.284 -0.436 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCN2CCOC2=O)c1 1602299915 VWWFFFUHMTWPGK-UHFFFAOYSA-N 297.223 -0.093 5 20 CBBD C[C@@](CO)(NCc1cccnc1[N+](=O)[O-])C(=O)O 1604196003 MWCYOBKPOINPRY-JTQLQIEISA-N 255.230 -0.085 5 20 CBBD NC(=O)NC(=O)COC(=O)c1ccccc1[N+](=O)[O-] 3502455 QXBYOGRVZFKJQU-UHFFFAOYSA-N 267.197 -0.054 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 49864777 QSOKEDNYPZTKJT-SSDOTTSWSA-N 269.213 -0.152 5 20 CBBD CC(C)[C@@H](CO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 92394797 XTQCMHIDUSYWPG-WDEREUQCSA-N 272.305 -0.241 5 20 CBBD COCCN(CCO)C(=O)c1cc([N+](=O)[O-])cnc1N 230870979 NHEHAJFLPLRCLP-UHFFFAOYSA-N 284.272 -0.347 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N1C[C@@H](O)C[C@H]1CO 274854445 YWKVQNKSWNJYEW-UWVGGRQHSA-N 296.279 -0.072 5 20 CBBD Nc1nc(N2CC(=O)N(CC3CC3)C2)ncc1[N+](=O)[O-] 278592276 ABDYCIDONIJGLX-UHFFFAOYSA-N 278.272 -0.017 5 20 CBBD COC(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 284898724 GZNIRLIHAKOLSY-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD COCCN(C)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285169162 CKTIWIVGXJYHSN-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD COC(=O)c1cc(C)nc(N2C[C@@H](O)[C@H](O)C2)c1[N+](=O)[O-] 287539603 BNINZUDERHETDE-RKDXNWHRSA-N 297.267 -0.373 5 20 CBBD Cc1cc(NC(=O)NC(CO)(CO)CO)ccc1[N+](=O)[O-] 294224852 NIMQEVGOZYEHFZ-UHFFFAOYSA-N 299.283 -0.260 5 20 CBBD NS(=O)(=O)CCCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 311624955 AHQGWRWCSMPWPI-UHFFFAOYSA-N 290.301 -0.279 5 20 CBBD Nc1ccc(N2C[C@H](O)[C@@H](CO)C2)nc1[N+](=O)[O-] 316220134 AWHBWIIXPMIDDZ-SVRRBLITSA-N 254.246 -0.639 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@@H]1O 342367518 DMPQADWOSSBYCL-ZJUUUORDSA-N 298.299 -0.256 5 20 CBBD COC[C@@H](C(N)=O)N(C)C(=O)c1cccc([N+](=O)[O-])c1N 354613565 WQGWINLLQVBZHH-VIFPVBQESA-N 296.283 -0.251 5 20 CBBD CS(=O)(=O)N1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)C1 400185158 CJPMGZQBYJYVLX-SSDOTTSWSA-N 287.301 -0.169 5 20 CBBD NS(=O)(=O)c1cc(NC[C@@H](O)CO)cc([N+](=O)[O-])c1 436442953 FDTNQCMLXZXMQR-MRVPVSSYSA-N 291.285 -0.993 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1C(=O)CCC1=O 522242407 PLICZOMDVSDRMW-UHFFFAOYSA-N 294.267 -0.188 5 20 CBBD CCONC(=O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 846490629 IHTZZYPYSYMBFO-NSHDSACASA-N 297.267 -0.188 5 20 CBBD CN1CCC(CNCC[N+](=O)[O-])(N2CCOCC2)CC1 905286662 PIZQJKOFXLRDMB-UHFFFAOYSA-N 286.376 -0.351 5 20 CBBD CC(=O)N(C)C1CN(Cc2c([N+](=O)[O-])ncn2C)C1 1042384013 IMRPFGMDPPWCLA-UHFFFAOYSA-N 267.289 -0.009 5 20 CBBD CC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1069919947 NFHPTWQHFFASEO-NXEZZACHSA-N 285.300 -0.547 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1C[C@H]2CC[C@@H]1O2 1328641161 ZDLDNKOPLHBNLN-PRJMDXOYSA-N 267.245 -0.378 5 20 CBBD O=C(O)[C@@H]1C[C@H](F)CN1C(=O)Cn1cnc([N+](=O)[O-])n1 1602196883 SCKYWWGHIXCFJW-WDSKDSINSA-N 287.207 -0.790 5 20 CBBD O=C(NCCO)C(=O)Nc1cccc([N+](=O)[O-])c1 5251516 AHZAHGFGAMSAEI-UHFFFAOYSA-N 253.214 -0.358 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 42696054 WVKYCSQYQSVGGZ-ZETCQYMHSA-N 270.245 -0.030 5 20 CBBD Cn1cc([C@H](O)CNc2ncc([N+](=O)[O-])c(N)n2)cn1 266296158 XPWQKIXIQGXBEX-MRVPVSSYSA-N 279.260 -0.154 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 330566657 LPIDTNRMDBPUQX-UHFFFAOYSA-N 283.288 -0.075 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCn3c(O)nnc3C2)c1 332226652 KQUHOPJPKYOQLD-UHFFFAOYSA-N 279.260 -0.396 5 20 CBBD COC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 338648645 JABLBOHOFAPFFQ-SSDOTTSWSA-N 270.245 -0.691 5 20 CBBD CC(C)[C@](C)(NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 341947516 SGJFGVLLBFNMSH-JTQLQIEISA-N 269.261 -0.052 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](N)CC(N)=O 353440966 OIJZSZQYEODUEP-SECBINFHSA-N 296.283 -0.578 5 20 CBBD COC(=O)[C@@H]1COCCN1Cc1c([N+](=O)[O-])ncn1C 370035729 GLOXTLNWJVFXSZ-VIFPVBQESA-N 284.272 -0.298 5 20 CBBD CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CCNC1=O 442924478 KJEQSQDKHKRLHI-ZETCQYMHSA-N 281.272 -0.023 5 20 CBBD Nc1nc(SCCOCCO)ncc1[N+](=O)[O-] 573386529 DWFDNDZZHLLQIZ-UHFFFAOYSA-N 260.275 0.068 5 20 CBBD C[C@]1(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])CCC(=O)N1 576051284 CHEZJJDKQDIHOC-GFCCVEGCSA-N 293.283 -0.030 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@@H]21 599083012 GOGLFBVNHZVWFR-QMSLJYSESA-N 264.289 -0.037 5 20 CBBD CN(CC(N)=O)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 736789281 VZHSBDGXFGVSGZ-UHFFFAOYSA-N 278.232 -0.909 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])cn(CCn2cncn2)c1=O 740095610 KBVWUQRKQRMMNN-UHFFFAOYSA-N 279.212 -0.254 5 20 CBBD NC(=O)c1ccc(C(=O)OCCn2cnc([N+](=O)[O-])n2)o1 747246536 UADWVNWDFDOGOK-UHFFFAOYSA-N 295.211 -0.265 5 20 CBBD COC(=O)c1cnn(CC(=O)OC[C@@H](C)[N+](=O)[O-])c1 860776043 AWMNEDLTULHPLA-SSDOTTSWSA-N 271.229 -0.122 5 20 CBBD C[C@H]1NC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1116145475 VQURAKSMRPPECA-HTRCEHHLSA-N 283.244 -0.908 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H](CO)CCF 1118271394 NHJAFLBVPRSGRB-LURJTMIESA-N 261.213 -0.977 5 20 CBBD O=[N+]([O-])c1ccc(N2CCN3CCOC[C@@]3(CO)C2)nc1 1262708233 VVXYJZMVXYYRRI-ZDUSSCGKSA-N 294.311 -0.127 5 20 CBBD CN[C@H]1CCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1332414170 TYHYVZQDZGRXNZ-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD CNC(=O)CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 1336702779 FBENNSGBPPSCPW-JTQLQIEISA-N 283.284 -0.330 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@H](O)C[C@@H]2C(=O)O)c1[N+](=O)[O-] 1597400283 XYNWRLFQZJSGQT-IYSWYEEDSA-N 298.255 -0.460 5 20 CBBD O=C(O)CC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1601930111 BLSCKNNWQNWESL-HTQZYQBOSA-N 272.257 -0.208 5 20 CBBD COc1ccc(S(=O)(=O)NCC(=O)O)cc1[N+](=O)[O-] 11804446 ZHUFUEKTEZVFET-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1F 43571255 CXIHXOOJGODFPL-SECBINFHSA-N 286.215 -0.002 5 20 CBBD O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[C@H](O)CO 105843472 NPOUCABRUGZBAY-ZETCQYMHSA-N 266.209 -0.456 5 20 CBBD Cc1cn(Cc2cc(=O)n(C)c(=O)n2C)nc1[N+](=O)[O-] 281192145 OOMAQRHLJJSAJB-UHFFFAOYSA-N 279.256 -0.455 5 20 CBBD CCc1[nH]nc(C(=O)N(C)CCOCCO)c1[N+](=O)[O-] 282223376 SUCOJLCIMQOLJV-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@H]1C 285820558 WJXDPPKRODUBKK-RKDXNWHRSA-N 297.315 -0.155 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1 298454077 IMURKATVRAKFJG-SECBINFHSA-N 268.248 -0.003 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 343933972 BJMXXKWXPLHXRJ-ZCFIWIBFSA-N 269.261 -0.228 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCCN(C)C1=O 359598685 NDUCJEGLBZKDSN-SECBINFHSA-N 295.299 -0.163 5 20 CBBD Cc1cnc(N2CCN[C@H](C(N)=O)C2)c([N+](=O)[O-])c1 361266446 SZPJJEIASVLELM-QMMMGPOBSA-N 265.273 -0.438 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1 444385612 ZOAFKPVNKOWDGH-SECBINFHSA-N 297.315 -0.533 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOC1 446621262 BBXBQTMFOLIQAG-LLVKDONJSA-N 283.240 -0.015 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@@H](C(N)=O)O1 531594759 HSZKKTNROREHIB-WPRPVWTQSA-N 296.283 -0.304 5 20 CBBD CO[C@@](C)(CO)CNc1ncc([N+](=O)[O-])cc1C(N)=O 594589686 PAWHMQAABCWBLQ-LLVKDONJSA-N 284.272 -0.102 5 20 CBBD NC(=O)c1cc(N[C@@H]2COC[C@H]2O)ccc1[N+](=O)[O-] 596257708 NVCWAZXJDRCQBI-PSASIEDQSA-N 267.241 -0.135 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 811835044 LWFCIHOHUZFPRY-ZETCQYMHSA-N 293.283 -0.244 5 20 CBBD CCOCCOC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839724989 PTRJBUMSIHIWOP-NXEZZACHSA-N 258.274 -0.085 5 20 CBBD CCn1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1126939262 VIJOXFJWGOMWMF-NXEZZACHSA-N 282.304 -0.831 5 20 CBBD COC[C@@H](O)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319638322 XBTVQLSODBIYKY-LURJTMIESA-N 258.234 -0.555 5 20 CBBD NC(=O)N1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1338289011 JBASANKGEHORSI-UHFFFAOYSA-N 296.287 -0.596 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1CCN1 1580579111 XHTQCIHSZACPAM-MRVPVSSYSA-N 266.257 -0.765 5 20 CBBD O=C1NCC2(CN(c3nccc(C(=O)O)c3[N+](=O)[O-])C2)O1 1602658976 MTNGBTWWEXZPBO-UHFFFAOYSA-N 294.223 -0.013 5 20 CBBD Cc1noc(CN(C)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1753049358 ZPXQMSACOBEDIH-RKDXNWHRSA-N 283.288 -0.409 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 48731297 HNDDREPJDULSHM-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](O)C(N)=O 228602111 YXNVWJHVEBAAGG-LURJTMIESA-N 257.250 -0.622 5 20 CBBD CCc1nn(C)c(N2C[C@@H](O)[C@H](O)C2)c1[N+](=O)[O-] 234174239 MXHFMYDVGHSKPC-HTQZYQBOSA-N 256.262 -0.568 5 20 CBBD CCN(CCO)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285948928 CGDXQPCDTGKZAN-UHFFFAOYSA-N 271.277 -0.638 5 20 CBBD Nc1nc(N2CCC3(CC2)CNC(=O)C3)ncc1[N+](=O)[O-] 342051637 UADDTRVPRQBZFX-UHFFFAOYSA-N 292.299 0.074 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[S@]1=O 353229710 LUKQFGDJLRCFHE-AHGSNSTDSA-N 272.286 -0.089 5 20 CBBD Cn1ccc(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 354759249 WHHZJUCYVKJSQR-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD CNC(=O)[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 355936831 BJCBEBAGBNGBGK-ZETCQYMHSA-N 269.261 -0.568 5 20 CBBD CN1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 358043088 SBMXYLSDEAWSMF-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CNC(=O)O2)c1=O 495935439 OBSGHGOTTVVMLS-ZETCQYMHSA-N 297.223 -0.349 5 20 CBBD O=C1CN=C(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)N1 542802750 LFLJXTWJQVXAFW-UHFFFAOYSA-N 264.197 -0.484 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@@H](CO)O1 566805366 HMMZANSHNZMHSO-SFYZADRCSA-N 296.283 -0.206 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCNC1 599920382 JHBUSJBFRNVXHG-MRVPVSSYSA-N 268.277 -0.548 5 20 CBBD CC(C)(C(=O)N1C[C@H](O)[C@@H](O)C1)n1cc([N+](=O)[O-])cn1 600216731 CRKZVWOSCCLFEK-IUCAKERBSA-N 284.272 -0.910 5 20 CBBD CO[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 600776407 OLZJAXNWTZPXIL-LJGSYFOKSA-N 255.234 -0.520 5 20 CBBD O=C1NC(=O)N2CCN(c3cccnc3[N+](=O)[O-])C[C@H]12 611509902 YCHYCRDGDCGYDX-MRVPVSSYSA-N 277.240 -0.270 5 20 CBBD CCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])n[nH]1 796430751 WNQIDYLQNQDZDI-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD O=C1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)N1 798589962 NYQVGKVPOMHJON-SSDOTTSWSA-N 282.212 -0.860 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@H](O)C2)c(-c2nn[nH]n2)c1 823640258 ZBAUDZKPGGFJDH-AOOOYVTPSA-N 292.255 -0.683 5 20 CBBD O=C(NCCN1CCSCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 839681628 WXRHTTQEOBRWPL-RKDXNWHRSA-N 259.331 -0.183 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 863710358 QXQXBRRKMQCBFO-RXMQYKEDSA-N 271.233 -0.544 5 20 CBBD O=[N+]([O-])c1c(N2C[C@@H](O)[C@H](CO)C2)ccnc1F 882443310 ZPSPUNMIOPQACI-POYBYMJQSA-N 257.221 -0.082 5 20 CBBD CNS(=O)(=O)C[C@H]1CCCN1CC[N+](=O)[O-] 930017903 LKBCKGOLKUREHA-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCn1cnnc1 1118708431 ABKMKWKHMTUDJZ-UHFFFAOYSA-N 292.255 -0.836 5 20 CBBD CN(CCOCCO)C(=O)c1c([N+](=O)[O-])cnn1C 1321717584 YBYYJPOEBDOBKV-UHFFFAOYSA-N 272.261 -0.591 5 20 CBBD C[C@H](CCCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1327121769 RBOLYYKSTPDXLD-SSDOTTSWSA-N 256.266 -0.570 5 20 CBBD CO[C@@H](CNc1ncc([N+](=O)[O-])c(N)n1)C(=O)O 1777244744 ZYQYSKQGMUJZDS-YFKPBYRVSA-N 257.206 -0.522 5 20 CBBD CC(C)CN(CC(N)=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75624272 QPKAMBIYBOAGIQ-LLVKDONJSA-N 299.331 -0.405 5 20 CBBD CC[C@H]1COCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 115310608 ILPIKDGSLYNLFG-QMMMGPOBSA-N 269.261 -0.176 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCNCC1 170319239 WUSDLLHPXUMFIO-UHFFFAOYSA-N 278.268 -0.035 5 20 CBBD COC[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 179437822 PYOBEBSRSHDOFK-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnc[nH]1 225065314 RRQFGGUFDPCVSW-ZCFIWIBFSA-N 265.233 -0.213 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 267812314 RMUWZMUEMJEQCA-ZETCQYMHSA-N 298.255 -0.360 5 20 CBBD CNC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CCO1 273054326 CAENPSHAHZQARQ-VIFPVBQESA-N 266.257 -0.059 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286439808 HXRSVIHCYCWOCN-LURJTMIESA-N 269.261 -0.086 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@@H](C(N)=O)C1 288124160 LZGJQQGGHJRASC-MRVPVSSYSA-N 283.288 -0.190 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])n1C 347557017 NFESFCZHRLUDTH-UHFFFAOYSA-N 283.288 -0.066 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)O1 347736679 RRLZWQGVDVHLEH-VXNVDRBHSA-N 282.256 -0.314 5 20 CBBD C[C@H]1CCN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 354006708 NCTFHCWMWNHADI-VIFPVBQESA-N 282.304 -0.261 5 20 CBBD Nc1nc(N[C@H](CO)[C@H]2CCCO2)ncc1[N+](=O)[O-] 447811225 NAJZZKHBUIIWFH-HTRCEHHLSA-N 269.261 -0.081 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CC(=O)N[C@H](C)C1 602840927 PGSYJVYZRFHKCG-MRVPVSSYSA-N 267.289 -0.080 5 20 CBBD Cc1nn(CN2CCO[C@@H](C(=O)O)C2)cc1[N+](=O)[O-] 821216902 SNRCHWQHPBJMHR-SECBINFHSA-N 270.245 -0.157 5 20 CBBD C/C(=C\COC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 825769327 NVZNKMJRESAGSL-QHHAFSJGSA-N 270.201 -0.240 5 20 CBBD CCOC[C@H](C(=O)OC)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840393174 UUECDAQFGXBSNZ-IWSPIJDZSA-N 274.273 -0.312 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NCCN1CC[C@@H](O)C1 894782787 ZRORAGZNRIWIST-MRVPVSSYSA-N 255.278 -0.193 5 20 CBBD CC(=O)NCCOCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1115162971 FRJSMMSKILYUTH-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1COCCO1 1115909991 LOWVTMSHTDWKEN-SECBINFHSA-N 284.272 -0.369 5 20 CBBD CNC(=O)C1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1116931519 BXCKYFVXHWDRTR-UHFFFAOYSA-N 281.272 -0.084 5 20 CBBD C[C@@H](C[C@@H](C)N)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118271016 SXNCMJCLCRUKMV-BDAKNGLRSA-N 282.300 -0.002 5 20 CBBD COC[C@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1254237303 DVNVUALORXHUNO-SNVBAGLBSA-N 272.261 -0.545 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1COCCO1 1323224602 NGEKJURSJFRINR-ZETCQYMHSA-N 270.245 -0.527 5 20 CBBD CO[C@@](C)(C(=O)O)C(=O)OCc1cn(C)nc1[N+](=O)[O-] 1604472825 GSIJLBYJOZGSKK-JTQLQIEISA-N 287.228 -0.139 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCCCNC1=O 65780043 QCXBLAZEYSBTTJ-SNVBAGLBSA-N 295.299 -0.034 5 20 CBBD C[C@H](O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 85989451 COPVZEAQFUHALB-WPRPVWTQSA-N 258.278 -0.487 5 20 CBBD CC[C@@H]1C(=O)NCCN1Cn1nccc1[N+](=O)[O-] 106855717 AOSYLQLBXNKTBX-MRVPVSSYSA-N 253.262 -0.041 5 20 CBBD CC(C)(O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 161523355 MMEDVWXNPCSSMC-UHFFFAOYSA-N 271.277 -0.139 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 354422535 DXZHMLFVETZWHW-RQJHMYQMSA-N 281.272 -0.038 5 20 CBBD CNC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 361919868 VGWLGJLCEWKIDC-UHFFFAOYSA-N 254.202 -0.829 5 20 CBBD CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 412549226 PXFJHOZGEQOQGF-HTQZYQBOSA-N 272.261 -0.430 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 425081763 GGSKLJVTDBZBSA-SSDOTTSWSA-N 294.267 -0.190 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 436739217 NWVMXKPSEPMZDK-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CC[C@H](O)C1 532775209 AKIJPNRRRNBAKJ-ZETCQYMHSA-N 273.270 -0.255 5 20 CBBD CCN(CCOCCO)C(=O)c1ccnc(N)c1[N+](=O)[O-] 563400442 KLTNLJNNZRTRIN-UHFFFAOYSA-N 298.299 0.043 5 20 CBBD O=C(Nc1nnc2nc[nH]n12)c1ccc([N+](=O)[O-])cn1 590379837 RDSCCZSJCIVEHA-UHFFFAOYSA-N 274.200 0.008 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1 591684179 CDYMBOVICPTXIH-SNVBAGLBSA-N 296.331 -0.799 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 592477203 SLURAZXATHXFNB-SCZZXKLOSA-N 283.288 -0.634 5 20 CBBD CNc1nccc(C(=O)N2CCOC[C@@H](O)C2)c1[N+](=O)[O-] 594366775 JNKDXTNDUJUAQP-QMMMGPOBSA-N 296.283 -0.135 5 20 CBBD CC(C)(CCC(=O)NC[C@H]1CN2CCN1CC2)[N+](=O)[O-] 827167459 XNHSBWFRNZMAIQ-NSHDSACASA-N 284.360 -0.062 5 20 CBBD CON(C)C(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 831837006 UZSBFSYXBCRTTQ-UHFFFAOYSA-N 285.212 -0.526 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H](C)CS(C)(=O)=O 839680064 CVWWOGJMQWWCIF-IWSPIJDZSA-N 278.330 -0.067 5 20 CBBD CCN(CCCNC(=O)C(N)=O)c1ncccc1[N+](=O)[O-] 1095960849 CIBONFGHPAHWSD-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCN(C)C(=O)C(N)=O)n1 1101935418 QXZRMLBGWXYXOR-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCCS(=O)(=O)CC1 1318680292 UQGCPSPNTDFZTH-UHFFFAOYSA-N 274.302 -0.047 5 20 CBBD CNC(=O)Cc1noc(-c2c([N+](=O)[O-])cnn2C)n1 1319649735 QPEHETUKUQYGSB-UHFFFAOYSA-N 266.217 -0.333 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@H](n2cccn2)C1 1324370208 KPFHZXDISCIZRA-SECBINFHSA-N 291.271 -0.144 5 20 CBBD COC[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1336736864 MTEPIDAUVJTRNN-QMMMGPOBSA-N 284.272 -0.184 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])ncn2C)C[C@H](C(=O)O)C1 1598619847 MVTXOISLRJQRKT-MRVPVSSYSA-N 283.288 -0.219 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](CF)C(=O)O)c1[N+](=O)[O-] 1600768229 LJBULZALIJWZGF-YFKPBYRVSA-N 274.208 -0.211 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H](CN)C1 122611053 OWSUKRLTPXJKFH-VIFPVBQESA-N 267.289 -0.362 5 20 CBBD CNC[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 179170182 JNDAKVDYQBEPHK-MRVPVSSYSA-N 255.278 -0.237 5 20 CBBD COC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 234843420 MSHALYQRCXXJEO-SSDOTTSWSA-N 257.246 -0.330 5 20 CBBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 236571909 DVSULVWCVKAPAV-UWVGGRQHSA-N 270.216 -0.089 5 20 CBBD COCCNCCNC(=O)CCn1cc([N+](=O)[O-])cn1 237276273 SOQUSFDRDRTDSJ-UHFFFAOYSA-N 285.304 -0.466 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cccc([N+](=O)[O-])c1N 271275640 MXRAJTFYWVJCHW-ZETCQYMHSA-N 269.257 -0.398 5 20 CBBD NS(=O)(=O)c1cccc(N2CC[C@H](O)C2)c1[N+](=O)[O-] 272547707 QXDLYLYSERCHRS-ZETCQYMHSA-N 287.297 -0.187 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)CO 339625930 GDUIZOIPEKVSIF-ONGXEEELSA-N 272.305 -0.145 5 20 CBBD CN(CCO)C(=O)NCCn1cc([N+](=O)[O-])cn1 349151590 ZFSWWZRYDMGNNI-UHFFFAOYSA-N 257.250 -0.575 5 20 CBBD C[C@@H](O)CN(CCO)CCn1cc([N+](=O)[O-])cn1 351939901 XQZRSNRPWBOMDF-SECBINFHSA-N 258.278 -0.534 5 20 CBBD O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1nn[nH]n1 357553514 WDYPYFADBZBWNU-UHFFFAOYSA-N 256.609 -0.029 5 20 CBBD C[C@H](O)CCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 358929598 JEKDPFDHZHXUSB-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD CCS(=O)(=O)CCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 413574163 MZFYQRJOCZYNJS-UHFFFAOYSA-N 289.317 -0.374 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@@H](CO)[C@@H](O)C1 561784852 NAQOLDHVJGWQRK-JQWIXIFHSA-N 297.311 -0.568 5 20 CBBD CO[C@@H]1C[C@@H](C(=O)O)N(CCn2ccc([N+](=O)[O-])n2)C1 568067125 MXEDICLMCNDOBQ-BDAKNGLRSA-N 284.272 -0.035 5 20 CBBD CNC[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 595984920 XYRBWGXZASMMPL-MRVPVSSYSA-N 268.273 -0.519 5 20 CBBD Cc1nn(C)c(C(=O)NCCC(=O)O)c1[N+](=O)[O-] 740244701 UKPXDKSMYGIUGT-UHFFFAOYSA-N 256.218 -0.159 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCC(=O)N(C)C 744664610 KSRVDJLUVCRDTK-UHFFFAOYSA-N 270.245 -0.269 5 20 CBBD CNc1ccc(C(=O)N[C@@H](COC)C(N)=O)cc1[N+](=O)[O-] 760085400 XMCYGBJEASZINN-VIFPVBQESA-N 296.283 -0.133 5 20 CBBD Cc1nonc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 764283885 WUNDZGNAZFXFLA-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 854466272 ZWIRPKRHEZWDPD-SSDOTTSWSA-N 283.288 -0.776 5 20 CBBD O=C1N[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CCO1 860245714 KTQDGIIUGPZMCL-QMMMGPOBSA-N 283.244 -0.594 5 20 CBBD CN1C[C@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1=O 1116345282 OAJLXVZSDNHXTD-MRVPVSSYSA-N 294.267 -0.897 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 1118776344 DJOBNAFPBQZWRB-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD CCc1nnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1C 1126932294 QULRQZNLPYTRAK-RKDXNWHRSA-N 296.331 -0.752 5 20 CBBD CC(=O)NCCN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 1261501384 ZTJWKDUULXEYJX-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1317940666 NWQZCVMWYPUALS-SSDOTTSWSA-N 282.260 -0.947 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 1326995725 FQGTXRHCDCLGTM-HTQZYQBOSA-N 284.272 -0.558 5 20 CBBD COCC[C@@H](CO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1327011924 DKVIWQYTMKKXDI-ZETCQYMHSA-N 272.261 -0.246 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](S(C)(=O)=O)C1 1327046001 FOMKZFAITDCZEB-SSDOTTSWSA-N 274.302 -0.048 5 20 CBBD Cn1cnc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 1341539711 KNBKUMBJDTUHOU-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD Cn1nnc(Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)n1 1601040548 CDGCIZFEDUERLO-UHFFFAOYSA-N 280.200 -0.974 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCC(=O)O 47852563 HRVCTOPUOSKDIF-UHFFFAOYSA-N 254.202 -0.025 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOC[C@@]12CCOC2 194438284 BFJNASUARWOUQP-LBPRGKRZSA-N 296.283 -0.191 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@H](C)CN1 237442351 ACUVQDZZCZTGAN-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD NC(=O)NC[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 263955803 LUOYNUMBIMQFTC-SSDOTTSWSA-N 295.303 -0.148 5 20 CBBD CCc1[nH]nc(C(=O)N(C)CC(=O)NC)c1[N+](=O)[O-] 264566610 USDAOECXCDHATL-UHFFFAOYSA-N 269.261 -0.302 5 20 CBBD CN1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 330519479 PISRZJGOVZNMPD-SSDOTTSWSA-N 253.262 -0.001 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 344976048 MNGHCZUGJQLWKA-ZETCQYMHSA-N 296.287 -0.230 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 345915625 NLAOSNRLIMDKKS-RKDXNWHRSA-N 295.299 -0.178 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H](CO)O1 347667540 KSHLHHKNPJLVKJ-JGVFFNPUSA-N 284.272 -0.450 5 20 CBBD C[C@H]1c2nncn2CCN1c1ncc([N+](=O)[O-])c(N)n1 357744339 HRZPZGLWFATRRS-LURJTMIESA-N 276.260 0.140 5 20 CBBD COC[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)OC 357856848 URSQTYXHGKZURB-ZETCQYMHSA-N 272.261 -0.281 5 20 CBBD C[C@@]1(C(N)=O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 361558845 YUBKVHZLBZBGBT-LLVKDONJSA-N 267.289 -0.011 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccccc1[N+](=O)[O-] 440386358 PERACBBPOPHQGO-UHFFFAOYSA-N 280.240 -0.090 5 20 CBBD O=C(CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)NCCO 448273415 YFUYEFCPSXWGNO-UHFFFAOYSA-N 299.258 -0.499 5 20 CBBD COC(=O)NCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 496817064 HWSGKRXDFFVZAB-UHFFFAOYSA-N 283.244 -0.342 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C 530738137 ZEMYSCMAJSXHGB-ZCFIWIBFSA-N 254.246 -0.202 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 588865187 YJOMTDDQRPNXAM-ZETCQYMHSA-N 271.277 -0.721 5 20 CBBD CCN1CC[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 591765804 IUHGJWGZRPYNKR-QWRGUYRKSA-N 297.315 -0.637 5 20 CBBD CN(C)C[C@H](CO)Nc1nccc(C(N)=O)c1[N+](=O)[O-] 596242364 FVTRKAHVPPICSZ-SSDOTTSWSA-N 283.288 -0.577 5 20 CBBD O=C(O)CNC(=O)COC(=O)c1ccc([N+](=O)[O-])cn1 821531362 HGKRAQBBDXWJJS-UHFFFAOYSA-N 283.196 -0.653 5 20 CBBD CCCN(CC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 829473168 NCLVBYLXBDBVBL-JTQLQIEISA-N 286.288 -0.051 5 20 CBBD O=C(NC1CN(C(=O)O)C1)c1cc([N+](=O)[O-])cnc1O 831610121 IGCNYZYMDFNYOQ-UHFFFAOYSA-N 282.212 -0.213 5 20 CBBD NC(=O)CC(=O)NCCCNc1ncc([N+](=O)[O-])cc1F 1094345754 IBFFTMRQZKHTGF-UHFFFAOYSA-N 299.262 -0.078 5 20 CBBD O=C1N[C@H]2CN(CC[N+](=O)[O-])CC[C@H]2N1C1CCNCC1 1580855350 SVURZNYOZNDMEY-NWDGAFQWSA-N 297.359 -0.517 5 20 CBBD COC[C@](C)(CC(=O)O)NC(=O)c1cc([N+](=O)[O-])n[nH]1 1599147001 BYUHSBWIEBPMAI-JTQLQIEISA-N 286.244 -0.073 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1608632733 UVOGHGNXTICCPC-RXMQYKEDSA-N 254.202 -0.135 5 20 CBBD O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1n[nH]c(=O)[nH]1 92869684 KQLRPWHQBVZJEB-UHFFFAOYSA-N 289.207 -0.198 5 20 CBBD COCC(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 270762253 XZMCUQSZZYGJSY-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](C)C1 330601654 IMDLMORWBXKAMG-IUCAKERBSA-N 297.315 -0.155 5 20 CBBD NC(=O)N1CCC[C@@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)C1 340921062 UCXASEHMKSNVMV-ZETCQYMHSA-N 295.303 -0.409 5 20 CBBD CN1CCN(CCNC(=O)c2cc([N+](=O)[O-])cn2C)CC1 518763016 MCUXKRDPDMXSMV-UHFFFAOYSA-N 295.343 -0.090 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 549202010 RPMSERFAODEIBX-SVRRBLITSA-N 281.272 -0.038 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cccc([N+](=O)[O-])c2N)CCOC1 569940265 HQHNVNAYXJVJEI-LBPRGKRZSA-N 294.267 -0.449 5 20 CBBD O=C1CCC[C@@H](CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)N1 591763889 PVKQYONFNAFERJ-GXSJLCMTSA-N 297.315 -0.590 5 20 CBBD COCC(=O)N1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596081252 SFHQJRRSVIKJQL-UHFFFAOYSA-N 296.283 -0.010 5 20 CBBD C[S@](=O)CCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 781447906 OCTPBIJNFWPSAR-SFHVURJKSA-N 272.286 -0.088 5 20 CBBD O=C(NC[C@H]1COCO1)c1cnc(O)c([N+](=O)[O-])c1 861977506 HAUKIMWUTRMFFI-ZETCQYMHSA-N 269.213 -0.202 5 20 CBBD CN(C)C(=O)CC(=O)NCCNc1ncccc1[N+](=O)[O-] 1094160434 NMGPKXFFQGAQQH-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD COC(=O)Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1 1116300787 AXMTVONPJSKCSB-UHFFFAOYSA-N 257.158 -0.162 5 20 CBBD COCC[C@H](Nc1ncc([N+](=O)[O-])cn1)C(N)=O 1116579431 QEKWTVQJECHAQF-ZETCQYMHSA-N 255.234 -0.313 5 20 CBBD NC(=O)C(=O)NCCNCc1cccc([N+](=O)[O-])c1 1133205902 BUHRATDIFUMYKD-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD COCCNC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1200472627 SDWMWDZJQVMAAO-GHMZBOCLSA-N 271.317 -0.121 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@H]2C[C@@]2(CO)C1 1320586856 LCFVDTVKAHICJX-HQJQHLMTSA-N 266.257 -0.217 5 20 CBBD Nc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](O)C[C@H]1C(=O)O 1601215187 ZJVURJMBWSVQNG-XCBNKYQSSA-N 295.251 -0.163 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CCOC2)c1 131563707 KGSWCONSTOOJOI-WPRPVWTQSA-N 256.262 -0.469 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 189608580 NPZIZLIFECWEGZ-QWRGUYRKSA-N 298.299 -0.210 5 20 CBBD COC[C@@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 231616463 LNQXJXGJVKSNIG-VIFPVBQESA-N 272.261 -0.695 5 20 CBBD CN1C[C@@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 269019737 DPPNKDPCBSGEOW-QMMMGPOBSA-N 296.287 -0.679 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 272726179 ACXCDOJZXITLAW-QMMMGPOBSA-N 282.256 -0.490 5 20 CBBD COc1cc(C(=O)NC(CO)CO)cc([N+](=O)[O-])c1C 276836483 PEGNLIAVADBYIG-UHFFFAOYSA-N 284.268 -0.005 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 292479930 IHHNGLZXCKZLTK-BQBZGAKWSA-N 270.245 -0.230 5 20 CBBD CNC(=O)[C@H](CO)Nc1nc2sccn2c1[N+](=O)[O-] 302160986 PMNOMBRSSPUULU-YFKPBYRVSA-N 285.285 -0.177 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 345904896 CLOUGNRYSTTXEC-NXEZZACHSA-N 295.299 -0.178 5 20 CBBD COCCOC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 359483040 OEMLBLPTYYFPEJ-UHFFFAOYSA-N 284.272 -0.335 5 20 CBBD CNC(=O)CCN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 426980004 HETOVUCEKADNTA-UHFFFAOYSA-N 298.303 -0.431 5 20 CBBD COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)OC 561981192 LPMZJQVODYCHNA-VIFPVBQESA-N 283.240 -0.092 5 20 CBBD C[C@@H](CO)CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593550242 RUJDGECBDSALDT-SSDOTTSWSA-N 275.286 -0.104 5 20 CBBD Cn1[nH]c(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)nc1=O 765388488 DWGHLGFGARARMN-UHFFFAOYSA-N 293.239 -0.044 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCO1 769693193 ZKISRNAPEPGMEY-JTQLQIEISA-N 294.267 -0.497 5 20 CBBD Cn1c(C(=O)Nn2cnnc2O)ccc1[N+](=O)[O-] 782128562 YODPJTJOGFNOIR-UHFFFAOYSA-N 252.190 -0.386 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NOC[C@H]1CCOC1 788573586 GPLUGZIFKCHJER-QMMMGPOBSA-N 270.245 -0.124 5 20 CBBD CCNC(=O)CCOC(=O)Cn1cc([N+](=O)[O-])cn1 816113428 SBUSBEVBVYPKLG-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD Nc1ccc(NC(=O)N2C[C@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] 823926988 KACPMDUJTCDSKT-HQJQHLMTSA-N 296.283 -0.006 5 20 CBBD NC(=O)N1CCC[C@H]1COC(=O)Cn1ccc([N+](=O)[O-])n1 860979419 AZUYQUZVENFIEZ-QMMMGPOBSA-N 297.271 -0.122 5 20 CBBD C[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)C[C@@H](CO)O1 893416345 IESJUYVZMQLHIF-SFYZADRCSA-N 256.262 -0.086 5 20 CBBD C[C@@H]1C[C@@H](NCC[N+](=O)[O-])C(=O)N1c1cnn(C)c1 905146918 SWBMKHFKJYEZIX-PSASIEDQSA-N 267.289 -0.220 5 20 CBBD CC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN(CCO)CC1 1045437687 YPICSWWZZFFRIO-NXEZZACHSA-N 271.317 -0.385 5 20 CBBD O=C1NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@H]12 1322326274 VLUBNYAEUQDQST-ZCFIWIBFSA-N 294.223 -0.436 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CC[C@H]2O)c1 1334770334 HDMWISMRPQNTSG-IVZWLZJFSA-N 256.262 -0.735 5 20 CBBD C[C@@H](c1nnc(N2CC(=O)N(C)C[C@H]2C)n1C)[N+](=O)[O-] 1355414477 CSAUIIUVBDNEEI-SFYZADRCSA-N 282.304 -0.180 5 20 CBBD O=C(NCC1(C(=O)O)CC1)c1n[nH]cc1[N+](=O)[O-] 1608425916 DJSDQFNALVOTKM-UHFFFAOYSA-N 254.202 -0.088 5 20 CBBD O=C(O)[C@H](CO)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 22222459 MUBAAHWCWSQLES-LURJTMIESA-N 290.253 -0.681 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCCC[C@H]1C(N)=O 130360767 BLDZMQWDDBKXEZ-VIFPVBQESA-N 295.299 -0.034 5 20 CBBD NS(=O)(=O)N1CCN(c2ncc([N+](=O)[O-])s2)CC1 190312446 KJHYMRDMJQERQD-UHFFFAOYSA-N 293.330 -0.623 5 20 CBBD CC(C)[C@](C)(NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 288019640 SPTVELFUHZDKQF-JTQLQIEISA-N 269.261 -0.052 5 20 CBBD O=C(CO)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 330583332 SFGZBUDICUNNOU-UHFFFAOYSA-N 282.256 -0.800 5 20 CBBD Cn1c(C(=O)N2CCO[C@H](C(N)=O)C2)ccc1[N+](=O)[O-] 348028224 QQZNGAZDTYRQLM-QMMMGPOBSA-N 282.256 -0.740 5 20 CBBD COC[C@]1(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CCCN1 423634099 MKJCYFHQQAXYCF-LLVKDONJSA-N 283.288 -0.184 5 20 CBBD CS(=O)(=O)CCCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 424932389 BXYAJIPIRVAFCA-UHFFFAOYSA-N 290.301 -0.128 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCOC1 446631208 KJKOTXMKYMJZTL-LLVKDONJSA-N 283.240 -0.015 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H]1O 583033982 MHWHOQAXHNEDQZ-YUMQZZPRSA-N 269.261 -0.935 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nccc(N)n1 597720235 PAVDCVCWXDHKMU-ZETCQYMHSA-N 291.271 0.041 5 20 CBBD COC[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 760076538 MVAGOHUTPWBBMO-QMMMGPOBSA-N 282.256 -0.593 5 20 CBBD CC(C)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 839731233 NDHTYESUVBOONV-NXEZZACHSA-N 269.301 -0.022 5 20 CBBD CNC[C@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 843078597 QUMMENGPWZDQSM-RYUDHWBXSA-N 269.301 -0.202 5 20 CBBD CN(C)C(=O)OCCNC(=O)Cn1cnc([N+](=O)[O-])n1 855650997 GXQPHTSBPDHRGU-UHFFFAOYSA-N 286.248 -0.999 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@H]1CC(=O)N(c2cnn(C)c2)C1 860787389 KXOFESNLBDSJSX-BDAKNGLRSA-N 296.283 -0.019 5 20 CBBD O=[N+]([O-])CCNCCS(=O)(=O)N1CCSCC1 905098624 UNZPOLWIASYHBG-UHFFFAOYSA-N 283.375 -0.769 5 20 CBBD O=C(NC1CCN(CC[N+](=O)[O-])CC1)N1CCOCC1 930759325 OBOXENJWHCMZPD-UHFFFAOYSA-N 286.332 -0.231 5 20 CBBD CCCc1noc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936887 WDHFEIPCEWNKJB-RKDXNWHRSA-N 297.315 -0.107 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2CCNC[C@@H]2C1 1263216846 ZUUPLHGNERYEJE-VHSXEESVSA-N 279.300 -0.141 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H](O)C1CC1 1319864318 SPEJBGPAVOIBML-MRVPVSSYSA-N 254.246 -0.171 5 20 CBBD Cn1nncc1Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1 1324557001 SURDYELLFJUVPL-UHFFFAOYSA-N 280.200 -0.159 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](CC(N)=O)C1 1325236655 MLSTZMUJPIIZRZ-SSDOTTSWSA-N 281.272 -0.334 5 20 CBBD C[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1nncn1C 1325302683 GFTJMGLCYFOFAS-LURJTMIESA-N 279.260 -0.020 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCNC[C@@H]1CO 1358026001 CCMHSLSLMRYHGO-GFCCVEGCSA-N 279.296 -0.070 5 20 CBBD O=[N+]([O-])c1cc(NC[C@H](O)CO)ccc1-c1nn[nH]n1 1609601294 VWYUXWLLYWAJGH-ZETCQYMHSA-N 280.244 -0.460 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1610731776 AOSHLRVEYXRTHM-GMSGAONNSA-N 298.255 -0.772 5 20 CBBD NC(=O)NC(=O)COC(=O)COc1ccccc1[N+](=O)[O-] 6118970 HXMCJEUAMZPIFD-UHFFFAOYSA-N 297.223 -0.288 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 110517568 PCNHUPPPTLBZSD-ZCFIWIBFSA-N 252.230 -0.117 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CCCN1 178740751 WSATXCZYPZRISC-SECBINFHSA-N 267.289 -0.032 5 20 CBBD CCN(CCO)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 183952053 CPXPHMSYWMNUAB-UHFFFAOYSA-N 297.315 -0.384 5 20 CBBD CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230696113 MSOOGTKXLAIUPE-MRVPVSSYSA-N 281.272 -0.188 5 20 CBBD Nc1nc(NC[C@@H]2CN3CCN2CC3)ncc1[N+](=O)[O-] 269523557 WNJCKXLGYWDLCJ-MRVPVSSYSA-N 279.304 -0.621 5 20 CBBD O=[N+]([O-])c1ccn(CCN2[C@@H](CO)CC[C@@H]2CO)n1 286735306 BVFQCQLCIXKUOK-NXEZZACHSA-N 270.289 -0.391 5 20 CBBD O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])[nH]1 340456573 VIZKODIDOCQNMD-LURJTMIESA-N 273.270 -0.160 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1COC[C@@H]1O 352801306 JVAKOYWVQAIGFC-QWRGUYRKSA-N 283.284 -0.552 5 20 CBBD COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 360721857 MKMNKIPFGBDNPX-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD CN1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C(=O)N1 450608857 JQTKWFZHCCEEIJ-SNVBAGLBSA-N 296.258 -0.262 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](CO)OC[C@@H]2C)c1[N+](=O)[O-] 494681769 MILJGHMVXWVYGB-XPUUQOCRSA-N 284.272 -0.152 5 20 CBBD COC(=O)[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C1CC1 548955382 FFEZNAWLJIUAJB-SSDOTTSWSA-N 268.229 -0.001 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H](CO)[C@H](CO)C1 704473243 KOIYVPIAUMYULF-YUMQZZPRSA-N 270.241 -0.139 5 20 CBBD O=C1CC[C@@H](n2cc([N+](=O)[O-])ccc2=O)C(=O)N1 765830087 ZCEOPERAGCHBDU-SSDOTTSWSA-N 251.198 -0.266 5 20 CBBD C[C@H]1CN(CCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 840673555 SGVDBUHPKYABJV-IVZWLZJFSA-N 258.274 -0.085 5 20 CBBD CCOC(=O)[C@@H](COC)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842339677 VZSFZKSPEURONW-BWZBUEFSSA-N 261.230 -0.227 5 20 CBBD Cn1cc(N2C[C@@H](C(=O)OCCC[N+](=O)[O-])CC2=O)cn1 860922783 XQEIUJWYDBJXAM-VIFPVBQESA-N 296.283 -0.017 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C(N)=O)C1 862818930 ZNEISDSRJLVZHE-IZLXSQMJSA-N 279.256 -0.434 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CC(=O)NC2CC2)C1 1042704909 BDIIAENPHVTJTD-GHMZBOCLSA-N 296.327 -0.927 5 20 CBBD Cc1ccnc(NC/C=C\CNC(=O)C(N)=O)c1[N+](=O)[O-] 1107480731 RYEUYESYAQBKTL-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](N2CC[C@@H](O)C2)C1 1117737933 XUVQGWJHZHOZTB-RKDXNWHRSA-N 295.299 -0.401 5 20 CBBD CNC(=O)CNCC1(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1164490709 SRZXMGVSJVUWNG-NXEZZACHSA-N 298.343 -0.726 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)c1c([N+](=O)[O-])cnn1C 1328649130 UWZXXZSVJCRALC-MRVPVSSYSA-N 284.272 -0.184 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1C[C@H]2COC[C@@]2(C(=O)O)C1 1605561701 ODYAZUVOMPTGLC-CPCISQLKSA-N 282.256 -0.134 5 20 CBBD Cn1nnnc1Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1610619247 SWGSBXVFLYVFFF-UHFFFAOYSA-N 280.200 -0.974 5 20 CBBD NC(=O)c1ccc(N2CCN(CCO)CC2)c([N+](=O)[O-])c1 15209333 FTWLUCOBJPPEKU-UHFFFAOYSA-N 294.311 -0.192 5 20 CBBD COC(=O)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 174845848 ORAKYFGVKISQAB-JTQLQIEISA-N 284.272 -0.335 5 20 CBBD COC[C@](C)(NCCn1ccc([N+](=O)[O-])n1)C(=O)OC 182597066 WTVHHXMQLJDEMJ-NSHDSACASA-N 286.288 -0.041 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCCNC1=O 183455935 OHHMXTHXEDJQHI-VIFPVBQESA-N 293.283 -0.030 5 20 CBBD Cc1cc(=O)n(Cc2nnn(C)n2)cc1[N+](=O)[O-] 193092675 WGYNBVVRUXIJPA-UHFFFAOYSA-N 250.218 -0.363 5 20 CBBD CC(C)(C(=O)N1CCNCC1)n1cc([N+](=O)[O-])cn1 236691841 GGZQRMDKJXTTQI-UHFFFAOYSA-N 267.289 -0.042 5 20 CBBD C[C@]1(CN)CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 261791474 GNRYRCIEQNPWFK-CYBMUJFWSA-N 294.311 -0.046 5 20 CBBD CCN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 273315682 PXFVISGOGCWOEX-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CCS(=O)(=O)NCCCn1cnc([N+](=O)[O-])n1 338128089 LEPOJERUXQVROP-UHFFFAOYSA-N 263.279 -0.484 5 20 CBBD CNC(=O)N[C@@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 341530804 MFXBFBGQPHYMKO-SSDOTTSWSA-N 266.261 -0.108 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CN(C)NC2=O)c1 349672509 VXYWMDRVAWBEDM-SECBINFHSA-N 294.267 -0.322 5 20 CBBD COC(=O)[C@H](C)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 361636571 IFRPLTLIAVRURD-WPRPVWTQSA-N 286.288 -0.355 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592308401 LIUIEOGZDDNTNE-XPUUQOCRSA-N 269.261 -0.494 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 597653159 HKENUBMUSZMQEX-SSDOTTSWSA-N 283.288 -0.776 5 20 CBBD CS(=O)(=O)NC1CN(c2ccc([N+](=O)[O-])cn2)C1 599147004 IZYLBAWIOUCDOY-UHFFFAOYSA-N 272.286 -0.272 5 20 CBBD CN1CC[C@H]1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 712587281 RTRJIVZEZDXTSM-ONGXEEELSA-N 269.305 -0.554 5 20 CBBD Cn1cc(C(=O)OCCn2cc([N+](=O)[O-])cn2)nn1 808660460 NKNUFECOSKYPKA-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD NC(=O)[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1 839476296 IAQUTPZLNNXQCE-OPRDCNLKSA-N 263.253 -0.006 5 20 CBBD C[C@@H](CN(C)S(C)(=O)=O)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842349617 MYYYMMFUMVZGFT-XLPZGREQSA-N 280.302 -0.525 5 20 CBBD Nc1nc(N2CC[C@H](N3CCOC3=O)C2)ncc1[N+](=O)[O-] 853806848 OFDGUJAKOFPPNI-ZETCQYMHSA-N 294.271 -0.002 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@@H]1CC(=O)N(c2cnn(C)c2)C1 860787390 KXOFESNLBDSJSX-DTWKUNHWSA-N 296.283 -0.019 5 20 CBBD Nc1ccc(NC(=O)N2C[C@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 861203234 YYMJCOKCRUDJFF-UWVGGRQHSA-N 282.256 -0.254 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cncs1 990369727 XEXCJDHOEHSNPC-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD CCCC(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991279174 JKXIAPXFNOGHMB-RKDXNWHRSA-N 255.274 -0.221 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CC=CC1 1116431666 JAALIBUEXJPAKH-UHFFFAOYSA-N 265.273 -0.070 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CCS(=O)CC1 1338151903 BFWAVGSIFQXCJG-UHFFFAOYSA-N 287.345 -0.407 5 20 CBBD C[C@@H](O)[C@H](O)CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1589997629 TUVQSHXUVHUBES-LHLIQPBNSA-N 294.271 -0.072 5 20 CBBD CN1CC[C@H](n2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1604856396 XVMBMCHPSGHHLA-YFKPBYRVSA-N 278.232 -0.625 5 20 CBBD CNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 48812293 JBIJZSYMRZWVTF-LURJTMIESA-N 255.234 -0.958 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CN(CCO)CCO)cc1 62350983 AEUKUVROASZEFX-LBPRGKRZSA-N 270.285 -0.085 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 74122313 LJFBTUVLTQOEEU-SECBINFHSA-N 281.272 -0.342 5 20 CBBD CN1CC[C@H](N(C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 75752620 GCMHBXPWGNENKT-QWRGUYRKSA-N 297.315 -0.685 5 20 CBBD CN1C(=O)C[C@@H](Nc2ncc([N+](=O)[O-])cn2)C1=O 88779115 YUCSNHBCUPCDRZ-ZCFIWIBFSA-N 251.202 -0.446 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC[C@@H]1C 126297853 SUQFBNAAPWTEHE-QMMMGPOBSA-N 267.289 -0.080 5 20 CBBD Cc1ccn(CCNS(C)(=O)=O)c(=O)c1[N+](=O)[O-] 129691206 ZBZVBSHQUHBBQG-UHFFFAOYSA-N 275.286 -0.386 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 194332335 QPEFAIVBWKYYSM-LDYMZIIASA-N 295.299 -0.178 5 20 CBBD NC(=O)[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCO1 246234565 GUCCIYNYWNEUKK-VXGBXAGGSA-N 295.295 -0.186 5 20 CBBD O=C1CN(CCCNc2ncc([N+](=O)[O-])cn2)CCN1 273687684 AYOQELKAWOOLQK-UHFFFAOYSA-N 280.288 -0.381 5 20 CBBD NC(=O)[C@@H]1CN(c2ccccc2[N+](=O)[O-])CCN1 296495745 NVLGQIQSLPMYGM-QMMMGPOBSA-N 250.258 -0.142 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC(=O)N(C)C1 299731086 XZYSRJNHTFMQGX-SECBINFHSA-N 295.299 -0.163 5 20 CBBD C[C@@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])cnc1N 350095749 JNZWTVUYCVYWOY-ZETCQYMHSA-N 291.271 -0.018 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 351750568 YKQRBKZXIUTSAK-RXMQYKEDSA-N 268.229 -0.137 5 20 CBBD CN1CC[C@@H](N(C)Cc2c([N+](=O)[O-])ncn2C)C1=O 352659898 PMYDRXMIHWDTTQ-MRVPVSSYSA-N 267.289 -0.009 5 20 CBBD Nc1noc(CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 353516572 ZBADJMHTWBNPHY-UHFFFAOYSA-N 267.205 -0.744 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@H](O)C1 427671904 KTFPCPOLPFUIIM-VIFPVBQESA-N 254.246 -0.225 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3C[C@@H](O)[C@H](O)C3)nn12 433806049 OQJRABFTYCVENB-RNFRBKRXSA-N 265.229 -0.821 5 20 CBBD CO[C@@]1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CCOC1 549322169 ROOIQGRTBHIABV-SNVBAGLBSA-N 270.245 -0.147 5 20 CBBD CN(C(=O)c1ccnc(N)c1[N+](=O)[O-])[C@@H]1COC[C@H]1O 571224038 OWJSLZFDXWQLFH-HTQZYQBOSA-N 282.256 -0.596 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1C[C@H](C(=O)O)C1 579973572 CZNHBPUHADOMGD-LJGSYFOKSA-N 268.229 -0.229 5 20 CBBD CN(CC(C)(C)N)C(=O)Cn1ccc([N+](=O)[O-])n1 595960366 DELLNADEQMGGDD-UHFFFAOYSA-N 255.278 -0.013 5 20 CBBD Nc1ncc2c(n1)CN(C(=O)c1c[nH]nc1[N+](=O)[O-])CC2 598951368 UBUGBURWFFDTDD-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD COC[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 760076537 MVAGOHUTPWBBMO-MRVPVSSYSA-N 282.256 -0.593 5 20 CBBD C[C@H](COC(=O)C1CCC2(CC1)NC(=O)NC2=O)[N+](=O)[O-] 813103051 MKDMZIHNWILANP-OQNPIJIBSA-N 299.283 -0.037 5 20 CBBD COC[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C(N)=O 823950051 BAWGVMLCSSWZEB-QMMMGPOBSA-N 297.271 -0.201 5 20 CBBD COC(=O)C[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 840421059 SQOGQYJBZFCMAF-SOCHQFKDSA-N 272.257 -0.510 5 20 CBBD NC(=O)[C@@]1(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCOC1 847052790 GHNBIEDINLSPDI-WCQYABFASA-N 295.295 -0.138 5 20 CBBD Cc1nn(CC(=O)OC[C@@H](C)[N+](=O)[O-])c(=O)n1C 847714441 UJTJVHBVHMUFJJ-ZCFIWIBFSA-N 258.234 -0.901 5 20 CBBD O=C(N[C@@H](CO)CN1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 879993678 ZRRZVLCGOQGORV-OPRDCNLKSA-N 257.290 -0.776 5 20 CBBD CN(Cc1nncn1C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1117674546 JVVPUHCNMSYAHC-UHFFFAOYSA-N 291.271 -0.146 5 20 CBBD CC(C)(CNC(=O)c1c[nH]nc1[N+](=O)[O-])S(C)(=O)=O 1321752864 GDBBCVOUKKBEAR-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD NS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 71834309 DWCKCZJCKQFALF-UHFFFAOYSA-N 286.313 -0.080 5 20 CBBD Cc1cnc(N2CCN(CC(N)=O)CC2)c([N+](=O)[O-])c1 78627747 IPAXNVPAYOJXEA-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD C[C@@H]1C(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C(=O)[C@H]1C 176630348 XMANCOFWGLSFCC-OYNCUSHFSA-N 296.283 -0.207 5 20 CBBD C[C@H](O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 291305300 XDARBABZGUTKTI-QMMMGPOBSA-N 269.257 -0.404 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(=O)N[C@H](C)C2)c1[N+](=O)[O-] 295828693 CMGBGWPDGZZASV-ZCFIWIBFSA-N 281.272 -0.159 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CC(=O)N(C)C)c1[N+](=O)[O-] 330606020 NDNTUPRLDIKEPA-UHFFFAOYSA-N 269.261 -0.213 5 20 CBBD C[C@@H](NC(=O)COc1cccnc1[N+](=O)[O-])C(=O)N(C)C 339353366 VIEXYEITFIWTSN-MRVPVSSYSA-N 296.283 -0.039 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1COCCO1 356450287 BKGUNFCCAXGUJS-ZETCQYMHSA-N 270.245 -0.527 5 20 CBBD COCCN(C)CCNC(=O)c1cc([N+](=O)[O-])nn1C 356453284 ZJHPRXRRIQOTDE-UHFFFAOYSA-N 285.304 -0.364 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 443037012 NATAQSVIVWLPNO-VDTYLAMSSA-N 267.245 -0.428 5 20 CBBD CC1=NNC(=O)[C@@H]1CCNc1ncc([N+](=O)[O-])cn1 546886133 FYMMQYIHWUTUTB-MRVPVSSYSA-N 264.245 0.309 5 20 CBBD CNc1nccc(C(=O)N[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 561316216 OCBCIJPVGCREIP-QMMMGPOBSA-N 293.283 -0.008 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 592477269 UMGZFCBSQWJBSI-RKDXNWHRSA-N 283.288 -0.634 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 592910746 LORFNGZRMHGDRB-HTQZYQBOSA-N 297.267 -0.081 5 20 CBBD CO[C@H]1C[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 600761829 SLFMSWMOZRHMRC-LSJOCFKGSA-N 270.289 -0.081 5 20 CBBD C=CC(=O)NCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 732101597 IJHGXYKLWJPCJU-UHFFFAOYSA-N 267.245 -0.342 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1N(CCO)CCO 738358646 NVIAPEJNRKWOBF-UHFFFAOYSA-N 294.271 -0.434 5 20 CBBD Cc1[nH]nc(C(=O)NN2CCCNC2=O)c1[N+](=O)[O-] 779372002 MZYLORURWYWSIU-UHFFFAOYSA-N 268.233 -0.314 5 20 CBBD CN1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@H](CN)C1 834301548 LHLYVCHNKUCTFF-SNVBAGLBSA-N 293.327 -0.108 5 20 CBBD CCONC(=O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 845718572 SFNTZBQIZAOZMD-UHFFFAOYSA-N 283.244 -0.432 5 20 CBBD Cc1nnc(N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)n1C 880576163 SBHMXGBAIMOONA-NXEZZACHSA-N 294.315 -0.563 5 20 CBBD O=C(c1ncc[nH]1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1011099450 VCLWPSXGYDWOFG-RKDXNWHRSA-N 293.283 -0.641 5 20 CBBD COCCN1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1017544106 KXSYGOMJUDFXGL-WRWGMCAJSA-N 283.328 -0.027 5 20 CBBD Cc1oncc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292306 CBVYWEHDCIFXFW-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD CN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)CNC(N)=O 1101484507 WOEOWFVNHUVGKA-UHFFFAOYSA-N 296.287 -0.472 5 20 CBBD COC(=O)[C@H](C)OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116347375 JAXDGZXUSQQHLO-ZETCQYMHSA-N 284.224 -0.139 5 20 CBBD CCn1cnnc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1118012318 ZSDNLFQNHGWERE-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](CO)[C@@H](O)C1 1320788536 OQOGTDNAPDCTDW-ZJUUUORDSA-N 298.299 -0.699 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCC(N)=O 1323255642 DAVIAPWASACOMB-UHFFFAOYSA-N 269.261 -0.519 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCNC1 1333274051 XHRXRGYDZWTQNU-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD O=[N+]([O-])c1cnc(-n2cnc(-c3nn[nH]n3)n2)s1 1609603618 QWBUHTYEYOJRNS-UHFFFAOYSA-N 265.218 -0.188 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCOCC1 28812909 SNWVULZPSZHLBT-UHFFFAOYSA-N 253.214 -0.245 5 20 CBBD COCCOCCNC(=O)CCn1cc([N+](=O)[O-])cn1 67833031 LCOXPCMBNRQWQH-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD NC(=O)[C@H]1CCCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173504029 DTQWTBJGORLVGS-WDEREUQCSA-N 297.315 -0.508 5 20 CBBD N[C@H]1CC[C@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]12 185130905 GDIMCROPUZEUFC-GDPRMGEGSA-N 279.300 -0.013 5 20 CBBD NC(=O)COCCNC(=O)c1cccc([N+](=O)[O-])c1 268633727 MZXKSHJJJOKLJQ-UHFFFAOYSA-N 267.241 -0.174 5 20 CBBD O=C(NCCc1cccc([N+](=O)[O-])c1)NC(CO)CO 270505446 KQAKXTPTHILHJG-UHFFFAOYSA-N 283.284 -0.210 5 20 CBBD CN(CC(N)=O)C[C@@H](O)COc1ccccc1[N+](=O)[O-] 273030963 MSZMNAFUPVQLOC-SECBINFHSA-N 283.284 -0.248 5 20 CBBD COCC(=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 273124637 AGVOWAMPHWAYOI-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD O=C1CNC(=O)N1CCCn1cc([N+](=O)[O-])ccc1=O 339957274 IUFZIEMPMQOHNJ-UHFFFAOYSA-N 280.240 -0.302 5 20 CBBD COC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 548169271 XGEOLURPKFBDCZ-SNVBAGLBSA-N 272.261 -0.545 5 20 CBBD Nc1nccc(C(=O)NCC(=O)NCC2CC2)c1[N+](=O)[O-] 582249992 FYCAZLLLGKHTPO-UHFFFAOYSA-N 293.283 -0.172 5 20 CBBD C[S@](=O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 768523559 JIQAJINNCWEPDP-IBGZPJMESA-N 289.317 -0.531 5 20 CBBD Cc1cc(C(=O)COC(=O)Cn2cnc([N+](=O)[O-])n2)on1 777048970 ZQPBWWUMNGAKEW-UHFFFAOYSA-N 295.211 -0.091 5 20 CBBD CN(CCC(=O)O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 820579708 AWTCDWFAYNAMLX-UHFFFAOYSA-N 283.240 -0.310 5 20 CBBD CS(=O)(=O)N[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839528343 QLBVOSUOQITRLH-DJLDLDEBSA-N 291.329 -0.808 5 20 CBBD CC(C)(C(=O)N[C@@H]1COC(=O)C1)n1cc([N+](=O)[O-])cn1 854557367 NMHWKDXHKRTFRQ-ZETCQYMHSA-N 282.256 -0.042 5 20 CBBD O=C(NCC1CN(C(=O)C(F)F)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001805898 LIODUFSSTAQJKN-RNFRBKRXSA-N 277.227 -0.509 5 20 CBBD Cn1ccc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1031661736 GHAVLWHSJXRLMX-VXGBXAGGSA-N 293.327 -0.367 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ncn(C)n1 1325055362 PIXQWSFHOPQIEH-UHFFFAOYSA-N 265.233 -0.133 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@@H]2COCO2)c(-c2nn[nH]n2)c1 1593485044 OWJHTUIVEDILQV-SSDOTTSWSA-N 293.243 -0.045 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@H]2COC[C@@]2(C(=O)O)C1 1595280007 IAWDUVUDZOCLSM-KGFZYKRKSA-N 296.239 -0.509 5 20 CBBD NCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 2599511 UIKQTHWTYLJSTN-UHFFFAOYSA-N 292.295 -0.162 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1c1c([N+](=O)[O-])ncn1C 8318674 CTUMWFMTICVNNG-RQJHMYQMSA-N 270.245 -0.559 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 44688549 GRKMYYULDDHPPR-JTQLQIEISA-N 295.299 -0.130 5 20 CBBD COC[C@@H](C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 49179688 ITHYKEOYFFXMQA-ZETCQYMHSA-N 257.250 -0.415 5 20 CBBD CCCNC(=O)CN(C)C(=O)Cn1nccc1[N+](=O)[O-] 119728609 GVMDQNSCVYPNLS-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1=O 132173045 ZOAUABJZOYLRNA-UHFFFAOYSA-N 280.284 -0.470 5 20 CBBD NC(=O)NC(=O)CCNC(=O)Cc1ccccc1[N+](=O)[O-] 267866240 UGGSOYIMZKSWGP-UHFFFAOYSA-N 294.267 -0.162 5 20 CBBD O=C(NCCN1C(=O)CCC1=O)c1cc([N+](=O)[O-])[nH]n1 285535390 PMZCVZQECLRVDE-UHFFFAOYSA-N 281.228 -0.803 5 20 CBBD C[C@H]1CC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 331247870 UCCJMWFFCWPAAU-CBAPKCEASA-N 282.256 -0.453 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)NCCF 337029502 CRJHMHBRADDSMF-LURJTMIESA-N 287.251 -0.468 5 20 CBBD CNC(=O)NC1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 338165692 FQWVEYWDEOVMRV-UHFFFAOYSA-N 282.260 -0.918 5 20 CBBD CC(C)(CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 348437597 NZLBDJFAOXEBPE-UHFFFAOYSA-N 269.261 -0.439 5 20 CBBD CCn1ncnc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 355505311 XQJZAVWHHDMTCZ-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD CCC[C@@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 412549229 PXFJHOZGEQOQGF-JGVFFNPUSA-N 272.261 -0.430 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@H]1COCCO1 489907506 CZFZLWBDDPXCOU-JTQLQIEISA-N 299.287 -0.494 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1[C@@H]2CNC[C@@H]12 495112703 SLIDTJBEVLVWQU-HTQZYQBOSA-N 265.273 -0.566 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)c1c[nH]nc1[N+](=O)[O-] 547754492 RGZZOFTWMMUTIS-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1=O 551985647 HOCUUCLFRPPBJJ-UHFFFAOYSA-N 280.240 -0.626 5 20 CBBD O=C(NCCn1cccn1)c1c[nH]nc1[N+](=O)[O-] 559371954 IPUKQGIKWKJZTA-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 592923045 HGRIRGROVHOGDY-RNFRBKRXSA-N 298.255 -0.686 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NC(CO)CO 612556665 QWVNEULDFGSSAK-UHFFFAOYSA-N 255.230 -0.740 5 20 CBBD O=C(N[C@H]1CCOC1=O)c1cc([N+](=O)[O-])cnc1O 849213054 ZCDSQAGYMNQUQU-ZETCQYMHSA-N 267.197 -0.259 5 20 CBBD C[C@@]1(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 1323924315 ZRJCZKUSOXXSRR-GXSJLCMTSA-N 284.272 -0.553 5 20 CBBD CC(C)COC[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1346402330 FBKLIEUMJNZYNI-MRVPVSSYSA-N 286.288 -0.076 5 20 CBBD Nc1c([N+](=O)[O-])ccc(NCCO)c1-c1nn[nH]n1 1592758631 YZZSOFYYGFVUBH-UHFFFAOYSA-N 265.233 -0.239 5 20 CBBD O=C(N[C@H]1C[C@H](C(=O)O)C1)c1c[nH]nc1[N+](=O)[O-] 1594799638 QNQUZJSRPDQPPW-URHBZAFASA-N 254.202 -0.089 5 20 CBBD Nc1cc(N2CCO[C@@H](C(=O)O)C2)cc(CO)c1[N+](=O)[O-] 1605654739 NICJHPUXRMKSNE-SNVBAGLBSA-N 297.267 -0.041 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 1608601519 KPMHAEBWDQEOPT-BDAKNGLRSA-N 284.272 -0.441 5 20 CBBD O=C1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCN1 23421191 MWGILLHLIPMVTD-UHFFFAOYSA-N 265.225 -0.128 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H](C(=O)O)C1 62132934 VYJFEKRGWTUWJR-ZCFIWIBFSA-N 280.240 0.000 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H](C)N1 153312816 GWEJDZGKDBTGEH-YUMQZZPRSA-N 268.277 -0.605 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)O 167329214 UPUPIJCWNSDUJK-LURJTMIESA-N 271.229 -0.237 5 20 CBBD NC(=O)c1csc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 172504440 UWCPEWQSQNJNFN-UHFFFAOYSA-N 296.268 -0.015 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 194174387 ZJUCPOSCHZXYHU-OIBJUYFYSA-N 281.272 -0.568 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2O)C1=O 217315895 KFKOHBIGVATQDC-SSDOTTSWSA-N 293.235 -0.213 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 273431414 XJXLENOIMNQHPO-SSDOTTSWSA-N 284.224 -0.436 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286007946 HZTORYGFRUMSMN-HTQZYQBOSA-N 284.272 -0.070 5 20 CBBD C[C@H](C[S@@](C)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 345568521 LXOYTYVLFXXVAW-LWESTGQBSA-N 274.302 -0.326 5 20 CBBD Cn1nncc1CNC(=O)c1cc([N+](=O)[O-])cnc1O 360674535 OZBRWCKORRXHST-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CS(=O)(=O)N1CCC[C@@H](Cn2cnc([N+](=O)[O-])n2)C1 360709132 YTZKJPISBSUCLV-QMMMGPOBSA-N 289.317 -0.142 5 20 CBBD NC[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 428626031 KJMCJTQQEBHIDI-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD CNc1nc(C(=O)N2CC(=O)N[C@@H](C)C2)ccc1[N+](=O)[O-] 456188109 LCKZKSVXDIPMAY-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD CO[C@@H]1COC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 458336819 ALTFYTYYXAJRPQ-DTWKUNHWSA-N 282.256 -0.284 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)NC1CCCC1 604502987 ATVGVDQZPAISGT-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD CN1CC[C@@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)C1=O 772514977 USDYJHADATWVRO-SECBINFHSA-N 282.256 -0.187 5 20 CBBD C[C@H](COC(=O)[C@@H]1CC(=O)N(c2cnn(C)c2)C1)[N+](=O)[O-] 860777717 UDAFNYVAHUUWDY-RKDXNWHRSA-N 296.283 -0.019 5 20 CBBD COCC(=O)N(C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1066622521 AXTHBBUKVMDANT-NXEZZACHSA-N 287.316 -0.395 5 20 CBBD O=C(O)[C@H]1COCCN1CCn1cc([N+](=O)[O-])ccc1=O 1594958765 VSTPTUHAGRTTKU-SNVBAGLBSA-N 297.267 -0.458 5 20 CBBD COC[C@](C)(CC(=O)O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1599150159 VJCYVPUOQJXQKY-JTQLQIEISA-N 286.244 -0.073 5 20 CBBD O=C(O)C1(O)CN(c2nc3ccccn3c2[N+](=O)[O-])C1 1601725975 BBLKBZGUTPTCQT-UHFFFAOYSA-N 278.224 -0.122 5 20 CBBD CCOC(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 49448563 AJHCGQZOJXVNMU-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1 65322981 OFOBIBJLYKWSFI-JTQLQIEISA-N 295.251 -0.373 5 20 CBBD NC(=O)CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 81567395 QEACICACCMEIAR-UHFFFAOYSA-N 289.251 -0.004 5 20 CBBD CN1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285076693 MCBSDKLYQVMCSX-ZETCQYMHSA-N 253.262 -0.001 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 287174700 SJBWOYYHDBXJMI-WKEGUHRASA-N 270.245 -0.412 5 20 CBBD O=C1NC[C@H]2[C@@H]1CCCN2C(=O)c1n[nH]cc1[N+](=O)[O-] 337149259 QSBSHKGILCCSTP-BQBZGAKWSA-N 279.256 -0.332 5 20 CBBD CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@@H]1COC[C@@H]1O 343618336 FIXIXESSEPRKPS-SFYZADRCSA-N 279.256 -0.167 5 20 CBBD COCC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 344895253 PWGIABPHICPZMX-QMMMGPOBSA-N 297.267 -0.079 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 344939006 FGRYPDNHWFEJCR-LURJTMIESA-N 282.260 -0.539 5 20 CBBD C[C@H](N)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 351829760 OUCPNSDKJRVRLX-IUCAKERBSA-N 267.289 -0.013 5 20 CBBD O=C(CNC(=O)Cn1ccc([N+](=O)[O-])n1)NCC(F)F 361370876 VUKPJGPVAUEDNI-UHFFFAOYSA-N 291.214 -0.711 5 20 CBBD Cn1nnc(CNC(=O)c2cnc(O)c([N+](=O)[O-])c2)n1 428523543 GBMLXYNISBFVQV-UHFFFAOYSA-N 279.216 -0.851 5 20 CBBD Cc1c(CC(=O)N[C@@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 450609890 LXUYZOSIEUSGGW-SNVBAGLBSA-N 292.295 -0.093 5 20 CBBD COC(=O)[C@@H]1CNCCCN1CCn1ccc([N+](=O)[O-])n1 592489373 RPFFIGVKTHMCBP-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD COc1ccc(CN(CCN)C[C@@H](O)CO)cc1[N+](=O)[O-] 595901181 CYSJUKYMPLXIKL-LLVKDONJSA-N 299.327 -0.283 5 20 CBBD CONC(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 843769269 GIBCCRVIRGLAPR-UHFFFAOYSA-N 256.218 -0.659 5 20 CBBD Nc1nccc(C(=O)O[C@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 848787852 TVTCQTVTSJBKMK-LURJTMIESA-N 294.223 -0.466 5 20 CBBD CNC(=O)COC(=O)Cn1cc([N+](=O)[O-])nc1C 1115909116 WOBJTWABFZLPAT-UHFFFAOYSA-N 256.218 -0.611 5 20 CBBD COCC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)OC 1324251417 NZSMDGMDRHKAPB-ZCFIWIBFSA-N 286.244 -0.374 5 20 CBBD NC(=O)[C@@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 1326236788 NZUHRFVQWGAZKI-UWVGGRQHSA-N 269.257 -0.936 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@]2(O)CCCOC2)c1=O 1327016521 FVERWQKGXFSUEW-GFCCVEGCSA-N 297.267 -0.603 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC[C@H]1C1OCCO1 1350597755 HMGAUMRRTMZLLQ-QMMMGPOBSA-N 283.288 -0.067 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])N1CCNC[C@@H]1CO 1354593874 OXPMVBKHVGEVQH-LLVKDONJSA-N 279.296 -0.070 5 20 CBBD C[C@@H]1C[C@H](C(=O)O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1589269188 RPYHTZRDGMDTBJ-SFYZADRCSA-N 297.271 -0.245 5 20 CBBD Nc1c(C(=O)N2C[C@H](O)C[C@@H]2C(=O)O)cccc1[N+](=O)[O-] 1601207063 OGNSNFMCOADERG-HZGVNTEJSA-N 295.251 -0.163 5 20 CBBD Cc1ccc(C(=O)NCCS(N)(=O)=O)cc1[N+](=O)[O-] 40218733 NFHGDIUVIZZYTR-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD Cn1c(C(=O)N2CCO[C@@H](C(=O)O)C2)ccc1[N+](=O)[O-] 49864773 UTCVYWAXBJEXCG-MRVPVSSYSA-N 283.240 -0.141 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])N[C@@H]1CCSC1=O 89684864 OYSFKXILNPCONP-ZCFIWIBFSA-N 270.270 -0.060 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCN 237551140 RBVZTOFYBWRQKK-MRVPVSSYSA-N 280.284 -0.212 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CC(=O)O)c1[N+](=O)[O-] 262099678 IVSAGMPTJNCSGU-UHFFFAOYSA-N 256.218 -0.207 5 20 CBBD O=C(O)[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 262908556 CFXZDGPPEQPJCQ-SECBINFHSA-N 298.255 -0.507 5 20 CBBD CN(CC(=O)N1CCOCC1)C(=O)c1cc([N+](=O)[O-])[nH]n1 285116947 VHLQKMKMGRKKKD-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCCO 298247806 XASODAUZOHFLGD-UHFFFAOYSA-N 281.268 -0.177 5 20 CBBD CN1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 330496494 VCHMKAQQNPTTBM-UHFFFAOYSA-N 280.284 -0.470 5 20 CBBD C[C@H]1NC(=O)N(CCn2cc([N+](=O)[O-])ccc2=O)C1=O 342204229 GMOYTGHEPDANPP-SSDOTTSWSA-N 280.240 -0.303 5 20 CBBD CN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@@H]1O 342382054 QAXZXPMZXOCSAX-ZJUUUORDSA-N 284.272 -0.601 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN([C@@H]2CCNC2)CC1 343690133 MPAFWABBOKDDGM-SECBINFHSA-N 294.315 -0.562 5 20 CBBD O=C(NCCNc1cnccn1)c1cc([N+](=O)[O-])n[nH]1 350054825 QRDAOHVZOFYIBM-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD Cn1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)n1 356499874 VSZPBCKAXNYFBC-UHFFFAOYSA-N 250.218 0.314 5 20 CBBD O=C([C@@H]1COCCN1)N1CCc2ncc([N+](=O)[O-])cc2C1 424177447 UJUIRWUXRHBPDO-LBPRGKRZSA-N 292.295 -0.137 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1 575136629 FSYYAMNHMSMPNJ-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD COCCNCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 579955938 OTGDOEPRJDEMDT-UHFFFAOYSA-N 257.250 -0.716 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1C 743272077 MANSSKMJJGVFOF-ZYHUDNBSSA-N 283.332 -0.212 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1cc([N+](=O)[O-])n[nH]1 795849760 ADBUUNHFRSODGK-BDAKNGLRSA-N 295.299 -0.089 5 20 CBBD C[C@H]1CN(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C)O1 840673043 XDTBDZDMPSDHJV-AXTSPUMRSA-N 286.284 -0.169 5 20 CBBD CON1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 846976353 LDPPPJPXUBNIKE-UHFFFAOYSA-N 282.300 -0.065 5 20 CBBD CNc1nccc(C(=O)NC[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 1332915460 PBLOPTBRMJEYQQ-ZETCQYMHSA-N 293.283 -0.103 5 20 CBBD C[C@@H]1CNC[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1579465811 WFRAWTONZWJYKO-RNFRBKRXSA-N 253.262 -0.334 5 20 CBBD O=C1CCCN1CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1593391976 AFGXAWFJUASVHK-UHFFFAOYSA-N 292.259 -0.406 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1C[C@@H](O)C[C@H](C(=O)O)C1 1608159401 QSMVLVIPCHDPNU-BQBZGAKWSA-N 270.245 -0.400 5 20 CBBD Cc1nn(CC(=O)N2CCNC(=O)C2)c(C)c1[N+](=O)[O-] 23418899 DQMRUUWNBOFAKO-UHFFFAOYSA-N 281.272 -0.633 5 20 CBBD Cn1c(C(=O)NCc2nnn[nH]2)ccc1[N+](=O)[O-] 44929399 MXHWPIDVJHYVFQ-UHFFFAOYSA-N 251.206 -0.624 5 20 CBBD COC(=O)[C@@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 48439785 JEVAKYHKQYRTHK-QMMMGPOBSA-N 282.256 -0.045 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 110516890 CHNUMJTYRFLHEH-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 135518958 SVZDCNZRSDMDIO-MRVPVSSYSA-N 298.255 -0.808 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCO 144451721 UJWCTUCNHZFNGF-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD C[C@H](O)C[C@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 252764771 PCQWISNNIRXJSQ-QXEWZRGKSA-N 272.305 -0.099 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H](C)O 274729567 CLIRSRPYLUEOIM-LDWIPMOCSA-N 298.251 -0.047 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 275154143 SMIFWXHLBNWTEY-RXMQYKEDSA-N 269.213 -0.013 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1COC[C@H]1O 342374458 KQDNFAAQRDEURT-JGVFFNPUSA-N 255.230 -0.245 5 20 CBBD NCC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1 347693590 OXJPCMXALVCAKG-UHFFFAOYSA-N 295.299 -0.802 5 20 CBBD NC(=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 352157453 WKJLRLZCGSQCHB-UHFFFAOYSA-N 254.202 -0.699 5 20 CBBD COC(=O)N1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 490751352 RXOWHRCQXBCYJG-UHFFFAOYSA-N 297.271 -0.298 5 20 CBBD O=c1c(F)cc([N+](=O)[O-])cn1CCN1CCNCC1 582299613 WHVDQEPNENAYBR-UHFFFAOYSA-N 270.264 -0.199 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](CO)CCF 593861210 FMIOZJRLBPMNLE-MRVPVSSYSA-N 287.247 -0.407 5 20 CBBD CNc1nccc(C(=O)NCCn2ccnn2)c1[N+](=O)[O-] 594337065 FXFKUJSYAAQCNG-UHFFFAOYSA-N 291.271 0.053 5 20 CBBD C[C@H]1CO[C@H](C)CN1CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 596428114 HELCUQLGQFQLPS-DTWKUNHWSA-N 296.331 -0.090 5 20 CBBD COC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])n1C 600404603 YTFWSRXEOAMKIN-UHFFFAOYSA-N 285.256 -0.147 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])NCc1nn[nH]n1 609493738 YQBVAUSYWLOKCD-UHFFFAOYSA-N 277.244 -0.164 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCCn1cncn1 727049807 HSFVJRDOTIYQRA-UHFFFAOYSA-N 280.244 -0.065 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OC[C@@H]1COC(=O)O1 763922520 QDICWNQEOSYDNH-SSDOTTSWSA-N 271.185 -0.130 5 20 CBBD CN1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC1=O 826044165 AOEDOLRZMWNTFH-UHFFFAOYSA-N 290.243 -0.594 5 20 CBBD CC(C)[C@H](CO)ONC(=O)c1cc([N+](=O)[O-])n[nH]1 857285606 GWLCZYYLQBSJIK-ZETCQYMHSA-N 258.234 -0.004 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1 923425422 MYYRACBLOVWVSI-JQWIXIFHSA-N 283.332 -0.164 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cocn1 973946600 OOZSBMIZBPEIMY-IBCQBUCCSA-N 294.267 -0.283 5 20 CBBD O=C(CN1CCCC1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991746430 FFJVZWIZPULEMA-GHMZBOCLSA-N 296.327 -0.926 5 20 CBBD CN(CCNC(=O)CNC(N)=O)c1ccc([N+](=O)[O-])cn1 1099910674 OBWRFUQKOFLBPR-UHFFFAOYSA-N 296.287 -0.790 5 20 CBBD CC(=O)NCC(=O)N(C)CCNc1ncccc1[N+](=O)[O-] 1101477018 ZGXASTIOVIAJGR-UHFFFAOYSA-N 295.299 -0.004 5 20 CBBD NC(=O)C(=O)NCCCNCc1csc([N+](=O)[O-])c1 1165613315 LVOIENDCWUZPLX-UHFFFAOYSA-N 286.313 -0.263 5 20 CBBD Cc1nc2c(n1CCO)CC[C@@H](NCC[N+](=O)[O-])C2 1262489705 GPYUPMXBTAIIKY-SNVBAGLBSA-N 268.317 -0.093 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N1CCNCC1 1326807041 ZFQBIKNKDZBTAL-UHFFFAOYSA-N 280.284 -0.503 5 20 CBBD C[C@H](CC(=O)O)NC(=O)c1nn(C)cc1[N+](=O)[O-] 1329657149 OTCCGODNNWPQCM-RXMQYKEDSA-N 256.218 -0.079 5 20 CBBD C[C@@H](C[S@@](C)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1337707050 HEJFSZQOGJPTME-IEMIWKFJSA-N 260.275 -0.185 5 20 CBBD O=C(O)[C@]1(O)CCN(CCn2cc([N+](=O)[O-])cn2)C1 1601722247 FFFYMJKFANYKFO-JTQLQIEISA-N 270.245 -0.687 5 20 CBBD O=C(O)C1(C(=O)OCCn2cnc([N+](=O)[O-])n2)CCC1 1605952265 TWTFKGIHFKAPGB-UHFFFAOYSA-N 284.228 -0.016 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc(O)cc([N+](=O)[O-])c1 1610682773 BMEXVBDSEYVLGT-QMMMGPOBSA-N 270.197 -0.524 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1 35160483 NMJFXVMXIMGEJW-SNVBAGLBSA-N 282.252 -0.213 5 20 CBBD CN(CC(N)=O)C(=O)COc1ccc([N+](=O)[O-])cc1 58254230 AONODGOIZHSEFO-UHFFFAOYSA-N 267.241 -0.083 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCCCNC1=O 65732085 NMXQEMOLGTXYJA-SECBINFHSA-N 295.299 -0.115 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H](O)C2CC2)c1 71304729 LULOMGOMDYMRDL-MNOVXSKESA-N 270.289 -0.487 5 20 CBBD COC[C@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228343485 KTFIQUQYNPVMEK-GXSJLCMTSA-N 288.304 -0.861 5 20 CBBD C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)O 262254549 DYXDYBMQYZKSON-LLVKDONJSA-N 283.240 -0.258 5 20 CBBD O=C1NC[C@@H]2CN(c3ccccc3[N+](=O)[O-])CCN2C1=O 267508909 PEMCXAYHJNBXOT-SECBINFHSA-N 290.279 -0.258 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 287174688 SJBWOYYHDBXJMI-LDWIPMOCSA-N 270.245 -0.412 5 20 CBBD O=C(CO)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 301828691 GLLGGAKZCIFPJV-UHFFFAOYSA-N 266.257 -0.369 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 330689812 FHIOJCJFQVOWJK-JTQLQIEISA-N 281.316 -0.102 5 20 CBBD O=C(NC[C@@H](O)[C@H]1CCOC1)c1cc([N+](=O)[O-])cnc1O 347098459 ZCZVVVXJWDSFMC-OIBJUYFYSA-N 297.267 -0.177 5 20 CBBD CCn1cc(S(=O)(=O)N2CC[C@H](N)C2)c([N+](=O)[O-])n1 353220703 VRFOOJHMXWOBMH-ZETCQYMHSA-N 289.317 -0.467 5 20 CBBD CNC(=O)c1ccc(N(C)C[C@@H](O)CO)c([N+](=O)[O-])c1 355737456 HZFXHHJNNCYAIV-SECBINFHSA-N 283.284 -0.256 5 20 CBBD COC[C@@]1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CCCN1 357257087 LKXNPRNECXTZCB-LBPRGKRZSA-N 297.315 -0.324 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@@H](C(=O)O)C[C@H]1O 595981664 ZGUBUVSTYDCWKR-FSDSQADBSA-N 270.245 -0.036 5 20 CBBD CN(C)C[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 596244519 RCVPEFQCNHPUNR-LURJTMIESA-N 256.266 -0.699 5 20 CBBD CN(CCN)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 598916313 XSFJAWYRFLHZTK-UHFFFAOYSA-N 266.257 -0.050 5 20 CBBD COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])cn1C 600402715 KKHWSONRUQABCZ-UHFFFAOYSA-N 285.256 -0.147 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 611209482 ZVLNKVHLDDIVPH-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD CCS(=O)(=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 732603908 ABENKLLLNYAICX-UHFFFAOYSA-N 262.247 -0.743 5 20 CBBD O=C(CN1CCCNC1=O)OCCn1ccc([N+](=O)[O-])n1 748112587 SWRJQQVBTAKVHI-UHFFFAOYSA-N 297.271 -0.250 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1N 774971192 DHISWXXYCBJYER-UHFFFAOYSA-N 296.239 -0.211 5 20 CBBD CCc1[nH]nc(C(=O)O[C@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 798653517 NDODVOOXHFUNQE-LURJTMIESA-N 296.239 -0.158 5 20 CBBD C[C@H](N)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 857102362 OICGYEIRIUJTMU-QMMMGPOBSA-N 270.293 -0.172 5 20 CBBD Cn1cncc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 995020693 JVXIRQRFZOZESD-RKDXNWHRSA-N 293.283 -0.974 5 20 CBBD C[C@@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCOC1=O 1117664043 ZFOWSWIYXMPZHO-SECBINFHSA-N 269.217 -0.992 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CCN(C)C(=O)C2)c1[N+](=O)[O-] 1321273140 GFDKJGHACLJONF-QMMMGPOBSA-N 295.299 -0.013 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322774302 PSJBBJQLUDFJNG-LDWIPMOCSA-N 270.245 -0.412 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC(C)(C)CC(N)=O 1323830395 RLAPOHBTZZCFBD-UHFFFAOYSA-N 269.261 -0.288 5 20 CBBD CS(=O)(=O)CC[S@@](=O)CCn1cc([N+](=O)[O-])cn1 1340810078 XJNCWUDJISICHM-KRWDZBQOSA-N 295.342 -0.415 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])C1[C@H]2CNC[C@H]12 1578387556 NNOZACOWUCXNOE-WDSKDSINSA-N 251.246 -0.392 5 20 CBBD O=[N+]([O-])c1cn(Cc2cnn[nH]2)nc1-c1nn[nH]n1 1593486635 DOFHDGTUTFGXAV-UHFFFAOYSA-N 262.193 -0.862 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1CC(=O)O 1599855770 QFDRWAMVBCOFJA-HTQZYQBOSA-N 297.271 -0.245 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCO[C@H]1C(=O)O 1600720262 MLCNAISVWDAABX-OIBJUYFYSA-N 298.255 -0.542 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 20214121 BOBSFPYZWPVYOW-FBCQKBJTSA-N 257.202 -0.513 5 20 CBBD CN(C)C(=O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 21185519 JWTYAOSFRKJAEW-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)C(N)=O 61134946 ADRWWSSVWSVBSY-LURJTMIESA-N 269.261 -0.520 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCOC[C@@H]1C(=O)O 88381059 VGMLQJSFLAPECP-SECBINFHSA-N 284.272 -0.115 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCOCCO 227551953 DNBXZPNCQXTNED-UHFFFAOYSA-N 272.261 -0.694 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(N)=O 227871554 NTXAHOGHFOJABM-SECBINFHSA-N 267.241 -0.521 5 20 CBBD COc1nc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)n[nH]1 271287650 PNVTUAKFUDMPHQ-UHFFFAOYSA-N 281.232 -0.135 5 20 CBBD CCN1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1=O 273233238 ADIAZUXCSGZEPA-UHFFFAOYSA-N 295.299 -0.059 5 20 CBBD CN(Cc1nnnn1C)C(=O)c1cc([N+](=O)[O-])cnc1O 343765550 CAJIZWWOUZNIKM-UHFFFAOYSA-N 293.243 -0.509 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@H]1CCCO1 344862695 QDISWLZGYCAZRQ-VHSXEESVSA-N 296.283 -0.158 5 20 CBBD CC1(C)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H](CO)O1 421931680 IOLDOQSLQIVZDJ-SSDOTTSWSA-N 284.272 -0.070 5 20 CBBD COCCOC1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 516957933 JKAVDVQKLKNIKG-UHFFFAOYSA-N 270.245 -0.195 5 20 CBBD O=C(O)c1ccnc(N2CC[C@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 569728661 UCIPTXWVNPEVJV-VXNVDRBHSA-N 297.267 -0.133 5 20 CBBD Nc1nccc(C(=O)N2CC[C@@](F)(CO)C2)c1[N+](=O)[O-] 594356872 DZYNXIWNEHONOQ-NSHDSACASA-N 284.247 0.119 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])o2)C1 600347448 QZRVSRGTVICHGD-UHFFFAOYSA-N 289.269 -0.439 5 20 CBBD CCOC(=O)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 618933975 HVEBJHJEZKLXIN-UHFFFAOYSA-N 256.218 -0.047 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 825630715 PEMKYHYXNSMZGR-GZMMTYOYSA-N 293.279 -0.025 5 20 CBBD O=C(O)C[C@@H]1C(=O)NCCN1CCn1cc([N+](=O)[O-])cn1 833207407 MNPQXYHQWGJACZ-SECBINFHSA-N 297.271 -0.934 5 20 CBBD Cc1c[nH]nc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991242100 MCRULHJXXAECKK-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cn1 1100294628 GKWNLVIOILQZCH-UHFFFAOYSA-N 267.245 -0.973 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@]1(O)CCOC1 1116378204 BRKWHJFGAWNTPZ-LBPRGKRZSA-N 298.299 -0.243 5 20 CBBD C[C@H](N)C[C@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118271018 SXNCMJCLCRUKMV-IUCAKERBSA-N 282.300 -0.002 5 20 CBBD O=C(O)[C@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCCO1 1594864047 WPGVPYGICRLIDG-LLVKDONJSA-N 298.255 -0.459 5 20 CBBD C[C@H](CC(=O)O)OC(=O)Cn1cnc([N+](=O)[O-])n1 1599890570 RAXPICCLAPNIRC-RXMQYKEDSA-N 258.190 -0.407 5 20 CBBD O=C(O)[C@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601856888 AAHSRKQYLSUANJ-FSDSQADBSA-N 260.271 -0.320 5 20 CBBD O=C(O)[C@@H]1CC[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)O1 1602177927 AIUDSIKRSCLCNE-DTWKUNHWSA-N 299.239 -0.033 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2CC[C@@](O)(C(=O)O)C2)n1 1608122444 BNLHIPDNXAPOFX-VIFPVBQESA-N 256.218 -0.646 5 20 CBBD CNC(=O)CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 25202504 RUHZXXJIUSFEKS-UHFFFAOYSA-N 295.251 -0.158 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(CC(=O)O)CC1 35680469 JBQDDBJCDWMQKF-UHFFFAOYSA-N 269.261 -0.465 5 20 CBBD CN1CCN(CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 54377248 DGNIEXPXYVVOIG-UHFFFAOYSA-N 281.316 -0.100 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCC2(CO)CC2)c1 122404785 VQXZEYAFWXUVIW-JTQLQIEISA-N 270.289 -0.486 5 20 CBBD CNC(=O)C1CN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C1 186177440 CZTSFDYDHZVVOC-UHFFFAOYSA-N 295.299 -0.306 5 20 CBBD COC(=O)N1CC(NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 269323495 FZAZCRUCBSKEKF-UHFFFAOYSA-N 283.244 -0.642 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285404555 BBUJLAGUDNBSPO-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2COC[C@H]2O)cc1 323452241 USJHOEMTAWNIDJ-IJLUTSLNSA-N 268.269 -0.023 5 20 CBBD CN(CC(N)=O)C(=O)c1c(N)cccc1[N+](=O)[O-] 354393406 KDZUOCBJWKPZAO-UHFFFAOYSA-N 252.230 -0.266 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC1(c2nn[nH]n2)CC1 357050196 NXOMVAJXTITYGG-UHFFFAOYSA-N 290.243 -0.496 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 588863670 BIZLZDCHSJZIEZ-VIFPVBQESA-N 285.304 -0.780 5 20 CBBD Nc1nc(N[C@@H]2C[C@H](C(=O)O)C[C@H]2O)ncc1[N+](=O)[O-] 595977565 GYJUZLISXHORIX-HBPOCXIASA-N 283.244 -0.397 5 20 CBBD Cn1nnnc1N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 609351024 BCPFGNSUNJSSQN-UHFFFAOYSA-N 290.287 -0.160 5 20 CBBD CN1CC[C@@H](N(C)Cn2nccc2[N+](=O)[O-])C1=O 738270031 UNWOSBIJRZHBPJ-MRVPVSSYSA-N 253.262 -0.089 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(N)=O 760061438 YWQIJJIGWDNXBO-YFKPBYRVSA-N 257.202 -0.582 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1CCn1ccc([N+](=O)[O-])n1 782583815 MECJMIXIDGTOMY-SECBINFHSA-N 267.289 -0.046 5 20 CBBD CCC[C@@H]1C(=O)NCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839717943 PSZCJIAXUJPNJS-IWSPIJDZSA-N 255.274 -0.221 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)c1c[nH]nc1[N+](=O)[O-])C2 861869513 HFDJNJOAXFYJTI-UJURSFKZSA-N 252.186 -0.542 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnco1 974116656 SVJLQOHHDJHDGF-BZNPZCIMSA-N 294.267 -0.283 5 20 CBBD O=C(NC1CN(Cc2ncccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030292308 CDNXMPPIJSRQFF-NXEZZACHSA-N 277.284 -0.558 5 20 CBBD CCN1CCNC(=O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1070963485 SYJMGPURHDCNSI-GHMZBOCLSA-N 298.343 -0.678 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCN2CCCC2=O)c1=O 1317850212 GCYLHLZAEJAQQD-UHFFFAOYSA-N 294.267 -0.522 5 20 CBBD O=C(N[C@@H]1C=C[C@H](CO)C1)c1n[nH]cc1[N+](=O)[O-] 1320377030 XJWMRCFGVKMKPA-NKWVEPMBSA-N 252.230 -0.015 5 20 CBBD CCC[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 1324390526 WYGVPHYCUPVBIF-LURJTMIESA-N 269.261 -0.288 5 20 CBBD CCn1nncc1CNC(=O)c1c([N+](=O)[O-])cnn1C 1329521624 KHRHFPVSIPPXQP-UHFFFAOYSA-N 279.260 -0.130 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN1CCn1ccc([N+](=O)[O-])n1 1601774097 WOVFSBSGMGRJID-YUMQZZPRSA-N 270.245 -0.689 5 20 CBBD CN1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CC1=O 1606252729 YIRXWCOHPMUPOL-UHFFFAOYSA-N 266.213 -0.076 5 20 CBBD COC(=O)[C@H]1C[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 122256689 LZNRYVDBWMXEHA-BDAKNGLRSA-N 282.256 -0.283 5 20 CBBD CC1(O)CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 277761215 OOPVQLJSUKEMNX-UHFFFAOYSA-N 253.214 -0.098 5 20 CBBD CS(=O)(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 336985597 HGLJUTSKOUZXAT-LURJTMIESA-N 287.301 -0.410 5 20 CBBD NC(=O)[C@H](CO)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 343264392 KNWCMVATMBRENZ-VIFPVBQESA-N 294.267 -0.262 5 20 CBBD CCN1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 356749211 WBYKYPRSBGUCBY-UHFFFAOYSA-N 281.272 -0.367 5 20 CBBD Cn1cnnc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 361344558 VJTIRBQRXYMWAN-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1=O 565906774 XJHVMPCZTXKNAP-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 566686923 GZDORAWAFXCCNJ-SFYZADRCSA-N 296.283 -0.206 5 20 CBBD Cc1noc(CN2CCN(C)C[C@H]2CO)c1[N+](=O)[O-] 602906936 VHZOFXXKZNYGTF-VIFPVBQESA-N 270.289 0.000 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1CN(C(=O)O)C1 740387301 DQNAEGOCCHNNBM-UHFFFAOYSA-N 269.217 -0.730 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)[C@H]1COCCO1 748111958 LRWPRPFFQJETFN-SECBINFHSA-N 271.229 -0.250 5 20 CBBD O=C(CN1CCCNC1=O)OCCn1cc([N+](=O)[O-])cn1 748111982 MPPOIBUGXWGPLC-UHFFFAOYSA-N 297.271 -0.250 5 20 CBBD NC(=O)CNC(=O)c1cc([N+](=O)[O-])c2nsnc2c1 771504463 WRCBWAJUEWYRPS-UHFFFAOYSA-N 281.253 -0.185 5 20 CBBD CON1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 846978355 LNADQZTWZNQYKX-UHFFFAOYSA-N 255.278 -0.030 5 20 CBBD C[C@@H]1COC[C@H]1OC(=O)Cn1cnc([N+](=O)[O-])n1 853193279 OSIOFCBAIZTXQC-RNFRBKRXSA-N 256.218 -0.236 5 20 CBBD NC(=O)C(=O)NC1CCN(c2ncccc2[N+](=O)[O-])CC1 1057932644 JEXMRQWCMHULDI-UHFFFAOYSA-N 293.283 -0.440 5 20 CBBD O=C(Cn1cnnn1)NCCNc1ccc([N+](=O)[O-])cn1 1093505685 UYZVLYBVYMBTAN-UHFFFAOYSA-N 292.259 -0.795 5 20 CBBD Cc1cc(C)n(CCNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936685 QLMZRVSLNQGXJH-VXGBXAGGSA-N 295.343 -0.129 5 20 CBBD NC(=O)N1CCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 1324094246 KKAHUUTYONPNSB-VIFPVBQESA-N 296.287 -0.549 5 20 CBBD CNC[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1578730719 GFBAWZXJGUDSEC-VIFPVBQESA-N 282.304 -0.213 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@@H]2CC[C@H](C1)N2 1580578469 FRIJKBSIKLZRIW-OCAPTIKFSA-N 266.261 -0.851 5 20 CBBD O=C(OCc1ccnc(-c2nn[nH]n2)c1)[C@@H]1C[C@H]1[N+](=O)[O-] 1593301799 FOIOFGBRLRSWQU-VXNVDRBHSA-N 290.239 -0.030 5 20 CBBD NC(=O)c1ccnc(N2CC[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 1594653303 IUFJDNGLLAQGBQ-ZCFIWIBFSA-N 280.240 0.000 5 20 CBBD C[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(=O)O 1599902938 RVIDLXSORQAWRW-BYPYZUCNSA-N 255.186 -0.102 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN1CCn1cc([N+](=O)[O-])ccc1=O 1601771884 HZWKYPQHUFIMEN-VHSXEESVSA-N 297.267 -0.724 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC1(C(=O)O)CC1 1608277502 ZJDOFKAIZRTVCF-UHFFFAOYSA-N 266.213 -0.081 5 20 CBBD O=C(O)CNC(=O)CNc1ccc([N+](=O)[O-])nc1 35384569 PZFNAXQGSBYFEY-UHFFFAOYSA-N 254.202 -0.398 5 20 CBBD NC(=O)CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 50702828 FWSHNNLMEYQMCR-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 71270884 URGUUCRBXSSNBS-MRVPVSSYSA-N 290.297 -0.120 5 20 CBBD Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)n1 91885410 FCRXABAOTFHFRT-UHFFFAOYSA-N 278.228 -0.658 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 165998620 IQIBXYBDZBEXKP-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD CC(=O)N1CC(NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 173224366 QLXGAZKUFMRTKS-UHFFFAOYSA-N 267.245 -0.862 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1=O 176260074 LAJNUYVKDTVRES-UHFFFAOYSA-N 253.262 -0.435 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@]2(O)CCOC2)c1[N+](=O)[O-] 339310426 JQLAXOMOKFCHIZ-LLVKDONJSA-N 284.272 -0.239 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@@H]2CCNC2=O)c1[N+](=O)[O-] 340718449 VQDPYUNCIFOHHR-SSDOTTSWSA-N 281.272 -0.159 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H]1CCNC1=O 340720498 PIJDAIQKKLQOAL-MRVPVSSYSA-N 280.240 -0.344 5 20 CBBD COC(=O)[C@H](C)CNC(=O)c1cc([N+](=O)[O-])nn1C 359514767 IIHIGTJVMQKANO-ZCFIWIBFSA-N 270.245 -0.133 5 20 CBBD C[C@@H]1[C@H](CO)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 488810945 WUCCSYUSPSLFCE-JFGNBEQYSA-N 284.316 -0.145 5 20 CBBD COC(=O)N1CC(NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 496464500 YUCVHATUJRIQJB-UHFFFAOYSA-N 295.255 -0.248 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 586810175 CSIBDOVFQVMKMH-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD CNc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 597583496 FFRBVGVQXGGRKT-SECBINFHSA-N 282.256 -0.788 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CN1C1CC1 610654051 FROMOJQYFFCYCV-RKDXNWHRSA-N 294.315 -0.072 5 20 CBBD CN[C@@H](C)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 1326582877 UOBOGTABIPQJNI-ZETCQYMHSA-N 256.266 -0.700 5 20 CBBD O=C1NC(=O)N2CCN(c3ccnc(O)c3[N+](=O)[O-])C[C@H]12 1328012813 LAVRZDNSXCFTSN-SSDOTTSWSA-N 293.239 -0.564 5 20 CBBD Cn1cc(CC(=O)OCCn2cnc([N+](=O)[O-])n2)cn1 1516696941 OXBIJMULVLLHOF-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD O=C(O)CC1(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 1610758271 KKNXQYDPMYPWHC-VIFPVBQESA-N 284.272 -0.251 5 20 CBBD CCN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCn1cccn1 1753083140 VFJPOGRLJBXVFI-VXGBXAGGSA-N 295.343 -0.014 5 20 CBBD N[C@@H]1C[C@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 36263986 SZRJTELTEBDRFJ-RKDXNWHRSA-N 257.271 -0.027 5 20 CBBD CC[C@@H](O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 135043685 ZBYFAAPDNBZTCR-GHMZBOCLSA-N 272.305 -0.097 5 20 CBBD C[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1CO 190374898 IXPSBSOCJWHIOH-ADEWGFFLSA-N 284.316 -0.145 5 20 CBBD CNC(=O)c1ccc(N2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 234341304 XECGIVBYYORXPN-PHIMTYICSA-N 281.268 -0.504 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 274422755 ONYCTBKOVZOXNH-UWVGGRQHSA-N 298.299 -0.210 5 20 CBBD C[C@@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CN(C)C 312446279 CPBKCHOSOFNBEQ-CMPLNLGQSA-N 285.348 -0.061 5 20 CBBD CC[C@H](CO)NS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 343015630 RMDUQWSAZQAGML-SSDOTTSWSA-N 292.317 -0.140 5 20 CBBD COC[C@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 345926019 ASCKSAGWIRSCOP-SNVBAGLBSA-N 299.283 -0.730 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1COC[C@@H]1O 353360842 MQMZNBSBNBIHCR-BDAKNGLRSA-N 255.230 -0.245 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)NC[C@@H]2C1 353996475 DSVUQEPTNIGFJK-ZCFIWIBFSA-N 280.244 -0.833 5 20 CBBD CCn1ncnc1CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 570823543 KAVWBCHXIUKWJL-UHFFFAOYSA-N 291.271 0.113 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC(N2CC[C@@H](O)C2)C1 593857212 WOENVJRQHQHTGS-MRVPVSSYSA-N 281.272 -0.791 5 20 CBBD O=C1C[C@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)N1 597198918 JUTYCGFYVZFPTB-SNVBAGLBSA-N 279.252 -0.022 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC2(CNC2)C1 707989507 GLYPIJRATVULHM-UHFFFAOYSA-N 251.246 -0.777 5 20 CBBD CC(C)[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 725921017 CNPOPJRDGILXMC-VIFPVBQESA-N 270.245 -0.156 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 737706521 OKPHTFIYKWBSCC-ZCFIWIBFSA-N 270.197 -0.227 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCCCO 744902096 LPFGSNDQTOWMDF-UHFFFAOYSA-N 256.214 -0.318 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NS(=O)(=O)C1CCC1 774287682 GCHDGLLGORVRLA-UHFFFAOYSA-N 288.285 -0.210 5 20 CBBD CC(=O)OCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 798137484 RJSXHNUENLUEEF-UHFFFAOYSA-N 256.218 -0.081 5 20 CBBD Nc1ccc(NC(=O)NC(CO)CO)cc1[N+](=O)[O-] 823988313 VVHARURONRFCDP-UHFFFAOYSA-N 270.245 -0.348 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 844114811 LGQZKGNXFFNEKK-JQCXWYLXSA-N 272.257 -0.966 5 20 CBBD O=C(NCCCNCc1cnsn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767789 USPHVUAZJLAUJQ-RKDXNWHRSA-N 285.329 -0.201 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@](O)(C(=O)O)C1 1600990994 LHTSVDZCGBNJHS-SECBINFHSA-N 256.218 -0.646 5 20 CBBD O=C1CC[C@H](n2cc(C(=O)O)cc([N+](=O)[O-])c2=O)C(=O)N1 1602642508 XACRHWGCAMPKMI-LURJTMIESA-N 295.207 -0.568 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1c1ncc([N+](=O)[O-])cn1 129619901 FROZAAWGEMNPHI-APPZFPTMSA-N 254.246 -0.029 5 20 CBBD O=C(Cn1cn[nH]c1=O)NCc1cccc([N+](=O)[O-])c1 130130095 VWYMPFRCJXINGS-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H](C(N)=O)C1 186970982 CGSNJUHBVYALTK-BDAKNGLRSA-N 295.299 -0.096 5 20 CBBD CCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnn[nH]1 268245354 WBXNFRBYUSITHB-QMMMGPOBSA-N 294.275 -0.038 5 20 CBBD Nc1c(C(=O)NCCOCCO)cccc1[N+](=O)[O-] 269407137 CVWDONUNFXWBPF-UHFFFAOYSA-N 269.257 -0.084 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NN1CCCNC1=O 272945062 MZAGIVRILBAYQX-UHFFFAOYSA-N 268.233 -0.762 5 20 CBBD COCCN1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 282518191 SWCBNNPKLKYYSB-UHFFFAOYSA-N 282.256 -0.189 5 20 CBBD NC(=O)C1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOCC1 299027849 ZBQMIBFOIPSPPU-UHFFFAOYSA-N 296.283 -0.065 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H](O)C2CCC2)c1 315851267 FVTVKSQFKCWZQZ-NEPJUHHUSA-N 284.316 -0.097 5 20 CBBD CC(C)(O)[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330545963 PJGHTDUYHKDVQA-QMMMGPOBSA-N 283.288 -0.052 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@H](C)CO)c([N+](=O)[O-])n1 339040516 FAPPDNKDIQLRFS-ZETCQYMHSA-N 292.317 -0.282 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 345411927 JMAGAMIPAPJYNN-SNVBAGLBSA-N 286.244 -0.638 5 20 CBBD COCCN(CCN(C)C)C(=O)c1c([N+](=O)[O-])cnn1C 347159071 QWSFGYUOWNBCDJ-UHFFFAOYSA-N 299.331 -0.022 5 20 CBBD Cn1nnc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1 398179443 WVMSHGJOFYYRNI-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CN1C[C@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)OC1=O 496074399 CRZBDELHDMGJTM-MRVPVSSYSA-N 284.228 -0.215 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)OC 561981191 LPMZJQVODYCHNA-SECBINFHSA-N 283.240 -0.092 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3CC[C@H](CO)[C@@H](O)C3)nn12 572419230 FRDZSMRGEXPKHA-BDAKNGLRSA-N 293.283 -0.183 5 20 CBBD O=C(C[C@H]1COCCN1)NCCn1cc([N+](=O)[O-])cn1 573083440 NDSWMZMCWJJHOA-VIFPVBQESA-N 283.288 -0.714 5 20 CBBD O=C(CO)N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 591151337 AFLQQLXVCGRNAW-UHFFFAOYSA-N 284.247 -0.230 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C(=O)O)O1 600679546 XURODYDIXYLASG-VDTYLAMSSA-N 283.244 -0.355 5 20 CBBD C[C@@H](CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 827443080 YDRBSUDJFFMMPH-WPRPVWTQSA-N 286.288 -0.195 5 20 CBBD CNc1nccc(C(=O)OCc2nnnn2C)c1[N+](=O)[O-] 848790655 GPJBZIYHDVRWHO-UHFFFAOYSA-N 293.243 -0.088 5 20 CBBD CCn1cnnc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1261253129 QFVCAJXSOIHFBN-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](CO)[C@H](CO)C1 1261831244 XLRMGGVLMHQSLT-IUCAKERBSA-N 295.295 -0.150 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@H](CO)C1 1317917862 ULMMGINCPIQCOR-QMMMGPOBSA-N 269.261 -0.583 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](C)CC(N)=O)c1[N+](=O)[O-] 1325193135 HYKKRMPQROJZEQ-YFKPBYRVSA-N 269.261 -0.370 5 20 CBBD O=C(O)[C@@H]1CNCCCN1CCn1cc([N+](=O)[O-])cn1 1601852540 LCRASPOPFIWTAL-JTQLQIEISA-N 283.288 -0.460 5 20 CBBD O=C(O)c1nn(CC(=O)N2CCC2)cc1[N+](=O)[O-] 1609003770 BAPKJDURXGNNGZ-UHFFFAOYSA-N 254.202 -0.278 5 20 CBBD CNc1ccc(C(=O)OCC(=O)NC(N)=O)cc1[N+](=O)[O-] 4509163 TYKVNXLPVUZVQH-UHFFFAOYSA-N 296.239 -0.012 5 20 CBBD NCC(=O)NCC(=O)NCc1ccccc1[N+](=O)[O-] 50015936 KJQFNXQTNCGARP-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD CC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 50469682 AGMSVNAWJNEHLT-ZCFIWIBFSA-N 256.218 -0.229 5 20 CBBD C[C@H](O)CN(CCn1ccc([N+](=O)[O-])n1)[C@H](C)CO 248957760 QMSURNZKPXZMGW-ZJUUUORDSA-N 272.305 -0.145 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@]1(O)CCSC1 270873422 MZVWSLJLWKHYTJ-JTQLQIEISA-N 286.313 -0.225 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 274891716 LZRFLIDQUCEYTJ-UHFFFAOYSA-N 282.256 -0.144 5 20 CBBD Cc1[nH]nc(C(=O)N(C[C@@H](C)O)[C@@H](C)CO)c1[N+](=O)[O-] 275963795 HTCZLEXGIKBJGR-NKWVEPMBSA-N 286.288 -0.170 5 20 CBBD O=C1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CN1CC1CC1 279439456 LLHHDLOUFWJSDN-UHFFFAOYSA-N 279.256 -0.030 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H]2CNC[C@@H]2C1 290174819 PDAGJSKNLJJDAW-VHSXEESVSA-N 279.300 -0.141 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCN(C)C1=O 330838667 IQSDSVCQHJOVHD-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD C[C@@H](C(=O)N[C@@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1F 341732396 PWBOTANCGWDLNE-LDWIPMOCSA-N 299.258 -0.200 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCc2nnn(C)n2)n1 343107398 QYKJIXWVZYUTEC-UHFFFAOYSA-N 293.243 -0.088 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CCCC(=O)N1 345545479 MYLMVNRGWPRSQI-VIFPVBQESA-N 295.299 -0.115 5 20 CBBD CC(C)NS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 352069746 NSFIOFXLPIPSJD-UHFFFAOYSA-N 277.306 -0.376 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])nn1C 362045385 FYKMXQMUKDQSAO-ZCFIWIBFSA-N 270.245 -0.038 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc([N+](=O)[O-])c(O)c1 392176292 VJVWQJQHFPVNQC-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC[C@H]1CCNC1 429426013 MAWQANWLDRVPNO-SNVBAGLBSA-N 294.311 -0.128 5 20 CBBD C[C@H]1OC(=O)N[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 496506815 HIUXNNAXBBHXQG-SVRRBLITSA-N 284.228 -0.169 5 20 CBBD Cc1nc(NC[C@@](C)(O)C(=O)O)ncc1[N+](=O)[O-] 516070840 QZNVTKNCFALDOB-SECBINFHSA-N 256.218 -0.059 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 554876546 QFLRORXVHWSWRJ-SNVBAGLBSA-N 272.261 -0.165 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)CCOC1 571775853 KDFFMIVAMPNZNO-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD C[C@@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 592546920 LMOOXYCHDGUNFF-SSDOTTSWSA-N 254.246 -0.780 5 20 CBBD NC(=O)CCNS(=O)(=O)c1ncccc1[N+](=O)[O-] 594747992 HLJSBWCIKINHBI-UHFFFAOYSA-N 274.258 -0.857 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 600314475 BHXXRPXUHATRLH-URHBZAFASA-N 253.218 -0.688 5 20 CBBD CN1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 615929178 SGHJQGALGCFKGX-SECBINFHSA-N 295.299 -0.082 5 20 CBBD C[C@@H](O)[C@@H](O)CNc1nccc(C(=O)O)c1[N+](=O)[O-] 717351922 UCXWMQBIWCDZOF-VDTYLAMSSA-N 271.229 -0.158 5 20 CBBD O=C(NCC1(CO)COC1)c1ccc([N+](=O)[O-])[nH]1 717579833 AIIIVXNBCUWKOI-UHFFFAOYSA-N 255.230 -0.338 5 20 CBBD O=C(CN1CCCC1=O)OCCn1cc([N+](=O)[O-])cn1 748109173 PBCJVDOHUGFAHQ-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 763699500 KBNZZOREHIXJTR-VIFPVBQESA-N 283.240 -0.863 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@H]1CCCN(C(N)=O)C1 814042196 HVCIVECMHVIVRE-SFYZADRCSA-N 259.262 -0.015 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(NCCO)CC1 996442515 XHXNJNIDRABUFG-NXEZZACHSA-N 257.290 -0.776 5 20 CBBD Cc1nn(CCC(=O)NCC(N)=O)c(C)c1[N+](=O)[O-] 1251730160 JNDYTPJHCNFXNN-UHFFFAOYSA-N 269.261 -0.600 5 20 CBBD CC(C)(C(=O)N[C@@H](CO)C(=O)O)n1cc([N+](=O)[O-])cn1 1589574667 DCPPPZANMQXJKZ-ZETCQYMHSA-N 286.244 -0.912 5 20 CBBD C[C@H](CC(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1609872937 WYFMZPWWLVOUIL-SSDOTTSWSA-N 283.240 -0.264 5 20 CBBD NC(=O)CN(CC(N)=O)C(=O)c1cc(F)ccc1[N+](=O)[O-] 61808641 UBXBUGGYJKGYHG-UHFFFAOYSA-N 298.230 -0.853 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCOC[C@H]1C1CC1 161368448 HHGUKCQKTDVWRF-VIFPVBQESA-N 281.272 -0.176 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1Cn1cc([N+](=O)[O-])cn1 172610292 HERURBVVZAIZEE-MRVPVSSYSA-N 274.302 -0.132 5 20 CBBD COCCN(C)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 184211710 PZAIQSRNKKRMJB-UHFFFAOYSA-N 297.315 -0.120 5 20 CBBD CNS(=O)(=O)CCNc1cccnc1[N+](=O)[O-] 221042824 MMFAXQKLQZPRTA-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD COCCCNC(=O)Cn1cc([N+](=O)[O-])c(C(=O)O)n1 229733679 WQDSMVHTJHHCRA-UHFFFAOYSA-N 286.244 -0.358 5 20 CBBD COC[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)OC 230725337 RZSHJNMEXUSYEJ-QMMMGPOBSA-N 284.272 -0.037 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274937850 DMRIYJOEGNUEOQ-UHFFFAOYSA-N 297.271 -0.304 5 20 CBBD CN(CCNS(C)(=O)=O)c1ccc([N+](=O)[O-])cn1 301306439 YQCRGYRWCQGHRV-UHFFFAOYSA-N 274.302 -0.025 5 20 CBBD Cc1ncc(CN=c2nc(N)c([N+](=O)[O-])c[nH]2)c(O)n1 343595295 GGEVNPDXZMGEJH-UHFFFAOYSA-N 277.244 -0.195 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](CO)[C@H]1CCCO1 344883236 SMOGOUZOOGPECW-VXNVDRBHSA-N 284.272 -0.402 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)OC 351811578 RZMZIKBPOXTCQW-QMMMGPOBSA-N 271.229 -0.159 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 356926093 CIVPNASJDLSMMX-QMMMGPOBSA-N 299.239 -0.651 5 20 CBBD Cc1nc(NC[C@@H]2CNCCN2C)ncc1[N+](=O)[O-] 420272232 LCKKTWSXMLYOBB-VIFPVBQESA-N 266.305 0.009 5 20 CBBD COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O 436958324 GODVHCPDSVISGF-SECBINFHSA-N 297.267 -0.079 5 20 CBBD Cn1c(C(=O)NC[C@H]2CN3CCN2CC3)ccc1[N+](=O)[O-] 437306103 LNRYXOMRMRWFBF-JTQLQIEISA-N 293.327 -0.337 5 20 CBBD CNc1nc(C(=O)N2CCNC(=O)[C@H]2C)ccc1[N+](=O)[O-] 455364834 VOJZLRNRQMBMCD-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD Nc1nccc(C(=O)NC2(c3nn[nH]n3)CC2)c1[N+](=O)[O-] 577624436 LGIAUHCFBVUJIZ-UHFFFAOYSA-N 290.243 -0.496 5 20 CBBD CN(CCN1CCNCC1)CCn1cc([N+](=O)[O-])cn1 592984955 XEKSUFJBTDBCDD-UHFFFAOYSA-N 282.348 -0.372 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@H](CO)CCF 593655797 BPGBGNSHAWYJPD-ZETCQYMHSA-N 293.276 -0.011 5 20 CBBD C[C@H](COC(=O)C(C)(C)NS(C)(=O)=O)[N+](=O)[O-] 813110759 ITNFTKVCVFSDLY-ZCFIWIBFSA-N 268.291 -0.477 5 20 CBBD CCNC(=O)NC(=O)[C@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672956 SUKCAKUWUZGZPE-RRKCRQDMSA-N 273.245 -0.571 5 20 CBBD O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 862583819 PKNLXLNYLHIQDA-DCAQKATOSA-N 282.252 -0.808 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2ncccn2)C1 1042705440 QWZOBRJDVYTTLX-GHMZBOCLSA-N 291.311 -0.216 5 20 CBBD O=[N+]([O-])c1ccnn1Cc1ncc(-c2nn[nH]n2)cn1 1582804785 LYKKZIOBFAQKKE-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD CC(=O)NCCCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1588860895 BXYXSAWJNFSTSC-UHFFFAOYSA-N 280.248 -0.502 5 20 CBBD COC(CN(CCC(=O)O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])OC 1599045399 LCFKBGSTFNXLSS-HTQZYQBOSA-N 290.272 -0.426 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H]1C(=O)O 1601028809 KDGVZLDMTJBDMT-YFKPBYRVSA-N 254.202 -0.373 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 43700686 KDVWGICPBQZOCN-QMMMGPOBSA-N 269.213 -0.152 5 20 CBBD COC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 71264796 UDYCEMNMOYIOPY-ZETCQYMHSA-N 271.229 -0.980 5 20 CBBD NC(=O)CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 109120056 ODANXELEGOPEOA-UHFFFAOYSA-N 290.239 -0.609 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](CO)OC[C@H]1C 154276638 NGLPJBXLHRZBAA-PSASIEDQSA-N 298.299 -0.292 5 20 CBBD COC[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 266000535 SCEYLTRBIUWORB-SECBINFHSA-N 284.272 -0.335 5 20 CBBD NC(=O)c1ccc(N(CCO)CCCO)c([N+](=O)[O-])c1 267571031 XCEUFRDPCSENKQ-UHFFFAOYSA-N 283.284 -0.125 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H](C)O 274445655 ICNZBPVPOMUUIK-LDWIPMOCSA-N 297.267 -0.171 5 20 CBBD C[C@@H](CN1CCN(C)CC1)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285597648 YBWDQCXMRGWQFH-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H](CO)C2)c1 304380525 YFEHPDRWCVORFL-CMPLNLGQSA-N 284.316 -0.144 5 20 CBBD C[C@H]1COCCN1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343684180 CFLJYJNDUHBKQR-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 349487941 PHLFOROYAIDNHK-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1c([N+](=O)[O-])ncn1C 489998348 NPKBVABFNCEDAD-SSDOTTSWSA-N 253.262 -0.005 5 20 CBBD NC(=O)Cn1cc(NC(=O)c2ccc([N+](=O)[O-])cn2)cn1 532388043 OBUROIJLUISOQN-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD CC(C)(CO)N1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 586801884 AVFYIHOGPOGGQK-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCOCCF)c1 596070521 QMUZTUUTMQUZFZ-SNVBAGLBSA-N 276.268 -0.272 5 20 CBBD O=C1CN(CCNc2ccnc(O)c2[N+](=O)[O-])CCN1 596189888 MWVRRCRHFNOAHE-UHFFFAOYSA-N 281.272 -0.461 5 20 CBBD Cc1nn(CN(C)[C@H]2CCNC2=O)cc1[N+](=O)[O-] 779867698 BZQIWQOXVLSVBR-QMMMGPOBSA-N 253.262 -0.122 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1cc([N+](=O)[O-])n[nH]1 795849764 ADBUUNHFRSODGK-IUCAKERBSA-N 295.299 -0.089 5 20 CBBD CNS(=O)(=O)CCn1nc([N+](=O)[O-])cc1[N+](=O)[O-] 857223900 VIEPUXZIVDBRLC-UHFFFAOYSA-N 279.234 -0.751 5 20 CBBD O=C(NC1CN(C(=O)C2CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991299768 WILAOIATNXWXAT-NXEZZACHSA-N 267.285 -0.221 5 20 CBBD Cc1nc(NCCNC(=O)CC(N)=O)ccc1[N+](=O)[O-] 1093538305 GJPLRGHUIGSNRZ-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD Cn1cc(CN2CCC([C@@H](O)C(=O)O)CC2)c([N+](=O)[O-])n1 1600951767 LEFHSZVZBISSNF-SNVBAGLBSA-N 298.299 -0.014 5 20 CBBD O=C(O)Cc1ccc(N2CC(O)(CO)C2)c([N+](=O)[O-])c1 1602120595 DIJHHFOUAFWERN-UHFFFAOYSA-N 282.252 -0.235 5 20 CBBD COC[C@@H](O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 71271000 HFLXERFRZUWKNV-VIFPVBQESA-N 290.297 -0.120 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 152716550 MQCBMVLSKKBIFL-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD NC(=O)[C@@H](O)CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 227830553 REXOHNSOMMGVDX-JTQLQIEISA-N 294.267 -0.262 5 20 CBBD C[C@@]1(CN)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 262078758 SZQHHHXSUUWZTB-NSHDSACASA-N 267.289 -0.011 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H](C(=O)O)O1 262186305 HFOYPKKJZBGKSF-VXNVDRBHSA-N 298.255 -0.508 5 20 CBBD C[C@H]1C(=O)NCCN1c1ncc([N+](=O)[O-])c(N)n1 267277508 OBOZHPHXHYBPHI-YFKPBYRVSA-N 252.234 -0.708 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCNC(=O)c1ccn[nH]1 272572113 WTIFACYHMHCHBF-UHFFFAOYSA-N 279.260 -0.107 5 20 CBBD CCNC(=O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 302142138 FMDCESPMSQIPON-UHFFFAOYSA-N 294.315 -0.357 5 20 CBBD CN1C(=O)CC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 355017139 MJAZFBNXYPRHME-SECBINFHSA-N 281.272 -0.472 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)NCC(=O)NCCO 446178281 CEMGWGXUOMTECB-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD COC(=O)N1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 490788376 UGLORGHMTMZRSV-UHFFFAOYSA-N 298.259 -0.903 5 20 CBBD O=C(O)[C@@H]1COCCN1CCn1ccc([N+](=O)[O-])n1 568772270 PKZKWBBOZACSII-QMMMGPOBSA-N 270.245 -0.423 5 20 CBBD O=C(O)CNC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 592454230 MJRAOBNECGIROV-UHFFFAOYSA-N 268.229 -0.131 5 20 CBBD Cc1nn(C)c(C(=O)N2CCC(=O)N(C)CC2)c1[N+](=O)[O-] 598293985 NCFHXEQWMOMVNQ-UHFFFAOYSA-N 295.299 -0.059 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1C[C@H](C(N)=O)C1 599143095 CGUUXEWRMJGACQ-IZLXSQMJSA-N 279.256 -0.236 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 600469472 MZXZNZJNVHDEDG-SSDOTTSWSA-N 271.229 -0.423 5 20 CBBD Cc1nn(C)c(C(=O)OCc2nnnn2C)c1[N+](=O)[O-] 733465107 FZYNHQLRSXAGQI-UHFFFAOYSA-N 281.232 -0.483 5 20 CBBD CNC(=O)c1ccc(NC[C@H](O)C(=O)NC)c([N+](=O)[O-])c1 757702140 JTCSACZUTJOKBC-JTQLQIEISA-N 296.283 -0.527 5 20 CBBD CCn1nc(C)c(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 819603713 VOHVYJJQKBDQEG-VXNVDRBHSA-N 253.262 -0.112 5 20 CBBD COC(=O)Cc1ccc(N2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 858674877 DMZNSBDNKDBYAP-RYUDHWBXSA-N 296.279 -0.148 5 20 CBBD NC(=O)NCC(=O)NCCCNc1ccc([N+](=O)[O-])cn1 1094297252 FJFACPRNFQCTOJ-UHFFFAOYSA-N 296.287 -0.424 5 20 CBBD O=C(CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NCC1CC1 1157761389 QKMKVQTYADEAHH-GHMZBOCLSA-N 298.343 -0.726 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](CO)C1 1333428877 LKLUVSAVKRZOSP-GFCCVEGCSA-N 296.327 -0.635 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C(=O)O)C2)n1 1600970054 YUJZQGUOOXOICG-OLQVQODUSA-N 268.229 -0.079 5 20 CBBD C[C@H](C(=O)O)[C@@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1603190561 VXFJRWMJVXOERB-BDVNFPICSA-N 294.285 -0.793 5 20 CBBD O=C(O)[C@@H]1CO[C@@H]2CN(c3ncc([N+](=O)[O-])cn3)C[C@@H]21 1777656747 LORIYBOPQSQEEV-IWSPIJDZSA-N 280.240 -0.079 5 20 CBBD C[C@@H]1CNCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 124628824 TVLCSNSNACEFLJ-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)CC(=O)N1CCOCC1 176238361 VVLKFZKVAHNZPX-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOC[C@]12CCOC2 194438293 BFJNASUARWOUQP-GFCCVEGCSA-N 296.283 -0.191 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1ccc([N+](=O)[O-])[nH]1 229687533 WGSKZIQRGKPTPZ-JTQLQIEISA-N 255.230 -0.196 5 20 CBBD O=C(NC(CO)CO)c1ccc([N+](=O)[O-])c(O)c1 273298115 DVJRMJBYBRMOLS-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD CN(C[C@H](O)CO)C(=O)Cc1cccc([N+](=O)[O-])c1 273678609 FKLRYIJPWGDALZ-NSHDSACASA-N 268.269 -0.051 5 20 CBBD CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)CO 276191298 HJIFHSVFZUGHFW-QMMMGPOBSA-N 290.297 -0.237 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@@H]1CCNC1=O 286012735 RFMDXNBWMSQDSV-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD Cn1c(C(=O)N2CCS(=O)(=O)CC2)ccc1[N+](=O)[O-] 348373172 WIGZGXLLENYDHC-UHFFFAOYSA-N 287.297 -0.196 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[S@]1=O 352312265 DYIMLFDQFJGCEC-LILOVNGRSA-N 286.313 -0.229 5 20 CBBD Cc1cc(=O)n(CCS(N)(=O)=O)cc1[N+](=O)[O-] 353827657 HGRFLYYKWLAFFT-UHFFFAOYSA-N 261.259 -0.647 5 20 CBBD COC(=O)CN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 355239535 LUUKNKIPDJPHBQ-UHFFFAOYSA-N 297.315 -0.418 5 20 CBBD CC(CO)(CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 357748239 RCUWJHNGHZEGAR-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 358058898 RKVYVEZAYLSMKO-LLVKDONJSA-N 268.273 -0.281 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCNCC1 428434521 WHYRBWFUXSTSEF-UHFFFAOYSA-N 267.289 -0.078 5 20 CBBD CNc1nc(C(=O)N[C@H]2CCN(C)C2=O)ccc1[N+](=O)[O-] 455728643 GPTNAZQGQYSUJM-QMMMGPOBSA-N 293.283 -0.008 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCOC[C@]12CCOC2 619676402 RPORJSXDSIBWIU-LLVKDONJSA-N 282.256 -0.051 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N1C[C@H](O)C[C@H]1CO 698151370 NMTAHEWRMCYENV-NKWVEPMBSA-N 256.214 -0.245 5 20 CBBD NC(=O)C1(C(=O)OCCn2cc([N+](=O)[O-])cn2)CC1 748122380 LGVBSFPPXLWERY-UHFFFAOYSA-N 268.229 -0.400 5 20 CBBD Cn1nncc1CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 808314379 CQIBCGAUBQZANE-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839679193 GGURLMKRYWHWFU-DSYKOEDSSA-N 295.217 -0.069 5 20 CBBD COCCO[C@@H]1C[C@H](CO)CN(CC[N+](=O)[O-])C1 1119855044 LYELNJURTPXHHN-WDEREUQCSA-N 262.306 -0.391 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCn1cnnc1 1347794664 DNYLNZQJUSDFNP-UHFFFAOYSA-N 279.260 -0.492 5 20 CBBD CCOC(=O)C[C@@H](O)Cn1ncc([N+](=O)[O-])c1N 1348436975 RPEMNDSDVCSEQB-ZCFIWIBFSA-N 258.234 -0.312 5 20 CBBD Cn1cc(CN2CCOC[C@@H]2C(=O)O)c([N+](=O)[O-])n1 1594543329 ZLGMMUCIGNBDRH-MRVPVSSYSA-N 270.245 -0.386 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(COCC(=O)O)n1 1594557814 LCVYQFLIPLSLDO-UHFFFAOYSA-N 283.200 -0.021 5 20 CBBD O=C(O)[C@@]12COC[C@@H]1CN(c1ncc([N+](=O)[O-])cn1)C2 1595192344 IQMCZFIFYDNZFK-CPCISQLKSA-N 280.240 -0.078 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1599175751 WGHLDYZYAGUXFA-QMMMGPOBSA-N 269.213 -0.181 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H](O)CC(=O)O)c1[N+](=O)[O-] 1600768242 MQMYRFGBNAMZAQ-ZCFIWIBFSA-N 286.244 -0.798 5 20 CBBD CN(CC(N)=O)c1cc(F)c(-c2nn[nH]n2)cc1[N+](=O)[O-] 1604716566 DOELWQGCSWLJHU-UHFFFAOYSA-N 295.234 -0.165 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N(CCO)CCO)c1 3776956 ZAZFUUITPJPIOJ-UHFFFAOYSA-N 290.297 -0.430 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCc1nc[nH]n1 80567431 SMJWRNRXTDHBAT-UHFFFAOYSA-N 279.260 -0.342 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 236559875 OHPWWYFJGPAWOV-QWRGUYRKSA-N 282.252 -0.462 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@@H]1C 262704940 BJMCSOPRDMHVDQ-VHSXEESVSA-N 294.311 -0.035 5 20 CBBD COc1ccc(CNC(=O)[C@@H]2C[C@H](O)CN2)cc1[N+](=O)[O-] 269256157 PBHCMYDEPHYRQS-UWVGGRQHSA-N 295.295 -0.058 5 20 CBBD CC(CO)(CO)NC(=O)Nc1ccncc1[N+](=O)[O-] 272754031 UETDMAXCCMPLPY-UHFFFAOYSA-N 270.245 -0.145 5 20 CBBD CNC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CCO1 273054324 CAENPSHAHZQARQ-SECBINFHSA-N 266.257 -0.059 5 20 CBBD CCS(=O)(=O)NCCNc1ncc([N+](=O)[O-])cn1 273591789 HMZZKZRDKXBSDQ-UHFFFAOYSA-N 275.290 -0.264 5 20 CBBD COCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285557613 VBYOUGKCJRHGPZ-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C1CC1 286129606 NXJMUABGXXZHJZ-MRVPVSSYSA-N 268.229 -0.001 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 330621617 MLKGEUVQSRYQGK-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD O=C1NC(=O)N2CCN(c3ncccc3[N+](=O)[O-])C[C@@H]12 351882336 FQZJQNURYYBGPF-QMMMGPOBSA-N 277.240 -0.270 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 424115003 UBOLOURLJBPVFR-SSDOTTSWSA-N 280.240 -0.200 5 20 CBBD COCCN(CC(=O)OC)C(=O)c1c[nH]nc1[N+](=O)[O-] 548085606 GZFOHAJQWBPWTF-UHFFFAOYSA-N 286.244 -0.421 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 590369427 GHODHUCSHZUOOP-MRVPVSSYSA-N 270.289 -0.414 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@H]2COC[C@H]2C1 601974665 UMRUGZOROXQAKK-AOOOYVTPSA-N 293.279 -0.139 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCN(C2CC2)C1 609345063 SBOIYWPOXIDFOE-QMMMGPOBSA-N 280.288 -0.461 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCCC(=O)O)c1=O 821353693 XELCOULMHBJWMH-UHFFFAOYSA-N 269.213 -0.280 5 20 CBBD CNC[C@@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923295023 QNDKWIONQJAMNW-CMPLNLGQSA-N 283.332 -0.164 5 20 CBBD CNC[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923295026 QNDKWIONQJAMNW-ZYHUDNBSSA-N 283.332 -0.164 5 20 CBBD O=C(NCCNc1ncccc1[N+](=O)[O-])c1nc[nH]n1 1093793162 DKKRDHHZGFBHDD-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD O=C(NCc1ccnc(-c2nn[nH]n2)c1)[C@@H]1C[C@H]1[N+](=O)[O-] 1582554766 UONNOIADWJVBCY-VXNVDRBHSA-N 289.255 -0.457 5 20 CBBD CO[C@](C)(C(=O)O)C(=O)OCCn1ccc([N+](=O)[O-])n1 1593932995 CKTAAJRTWLIZQH-SNVBAGLBSA-N 287.228 -0.176 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 43702282 LYIZSPAWWILOPT-QMMMGPOBSA-N 284.228 -0.897 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@]1(C(=O)O)CCOC1 85853874 HTJHSJMGGPSYOS-NSHDSACASA-N 283.240 -0.093 5 20 CBBD CCNCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 236923798 PCULAHOMZSPTHI-UHFFFAOYSA-N 268.273 -0.518 5 20 CBBD CN[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 261808390 SJVZWAUYYOODNV-MRVPVSSYSA-N 268.273 -0.519 5 20 CBBD C[C@H]1NCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@@H]1C 262704936 BJMCSOPRDMHVDQ-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCOCC2)c1 266435661 LOEORPFPELZDSI-SNVBAGLBSA-N 256.262 -0.516 5 20 CBBD O=C(N[C@@]1(CO)CCOC1)c1ccc([N+](=O)[O-])[nH]1 273449828 WZOKQAJDLSZUNN-SNVBAGLBSA-N 255.230 -0.196 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CN1C[C@@H](O)[C@H](O)C1 278659521 HTICRBQHTSHOIZ-YUSALJHKSA-N 298.295 -0.628 5 20 CBBD CCNC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])cn1 293722792 CCZABWUMAPWJFA-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H](O)C2CCC2)c1 315851269 FVTVKSQFKCWZQZ-RYUDHWBXSA-N 284.316 -0.097 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330550469 XDYKFZHRFYKBMF-QMMMGPOBSA-N 296.287 -0.735 5 20 CBBD COC(=O)[C@@H]1CNC(=O)CN1C(=O)c1cc([N+](=O)[O-])c[nH]1 344836275 AMYPWUOAWZJVTO-QMMMGPOBSA-N 296.239 -0.964 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)[C@@H]1CCOC1 351561692 XXDRRDBTFCFTCH-GMSGAONNSA-N 296.283 -0.301 5 20 CBBD O=C(O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc2c1=O 536955221 PAWMGBFLTNMBBR-UHFFFAOYSA-N 266.165 -0.053 5 20 CBBD NCCNC(=O)C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 577084817 OGKZUDQEXMYFND-UHFFFAOYSA-N 292.295 -0.446 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 592477268 UMGZFCBSQWJBSI-IUCAKERBSA-N 283.288 -0.634 5 20 CBBD CCn1cc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)nn1 598142901 VBFIJWSXAXFXRS-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)C(N)=O 760059451 UXKXTYFMTSUSED-VIFPVBQESA-N 285.231 -0.036 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)CCC(C)(C)[N+](=O)[O-] 863012479 ANCBDYWVIXYTOO-MRVPVSSYSA-N 276.289 -0.138 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)CC(C)(C)O)C1 954240932 ZNAOCCXNHGKVJU-NXEZZACHSA-N 299.327 -0.518 5 20 CBBD Cc1nnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)s1 1030292789 VVCVZRMDDYUPTQ-RKDXNWHRSA-N 297.340 -0.188 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](O)C1 1323507556 AWPCLXFZBZRWPW-QMMMGPOBSA-N 254.246 -0.307 5 20 CBBD CNC(=O)C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 1327636397 LFQKNBWSVRQIME-UHFFFAOYSA-N 281.272 -0.299 5 20 CBBD O=C(NC1(CO)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1337872998 CRSCFOIEUIBMLH-UHFFFAOYSA-N 270.245 -0.411 5 20 CBBD Cn1cnc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)c1 1606262889 ATKGXIWREXOBAN-UHFFFAOYSA-N 275.232 -0.247 5 20 CBBD Cn1c(C(=O)NCC(=O)N2CCNCC2)ccc1[N+](=O)[O-] 40507975 PYKZKWMDKPKJFL-UHFFFAOYSA-N 295.299 -0.905 5 20 CBBD CN(CC(N)=O)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 47628590 DTGCLMIKHDIFAU-UHFFFAOYSA-N 266.257 -0.389 5 20 CBBD C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])C(N)=O 53393577 VCSXDQHVRMPVMX-SSDOTTSWSA-N 267.241 -0.036 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@H](O)C1 61705827 JDTLITUSKOJYTP-ZETCQYMHSA-N 253.214 -0.510 5 20 CBBD Cn1nnc(Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)n1 193322831 LBRUCXXAQJBVLV-UHFFFAOYSA-N 287.239 -0.124 5 20 CBBD C[C@H](O)C[C@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228113303 PCQWISNNIRXJSQ-ATZCPNFKSA-N 272.305 -0.099 5 20 CBBD NC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CCO1 274724528 BRXHUDPYKGQDOH-MRVPVSSYSA-N 280.284 -0.023 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])[nH]n1)NCC(F)(F)F 285011994 GLUFRXDJJMTZIM-UHFFFAOYSA-N 295.177 -0.274 5 20 CBBD C[C@@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCS(=O)(=O)C1 285490457 OYCPAHFPMKYNQC-SECBINFHSA-N 288.285 -0.375 5 20 CBBD O=C(NCCn1cncn1)c1cc([N+](=O)[O-])[nH]n1 285813528 ZLJHAVCRWYZZPP-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1O 331181236 RLRPJHDEIVLINE-ONGXEEELSA-N 295.295 -0.014 5 20 CBBD CNC(=O)N[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 341562537 JDAULKVFDDYZAM-LURJTMIESA-N 281.276 -0.525 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 343722570 MDHUJSVSBKDOBH-LURJTMIESA-N 267.245 -0.379 5 20 CBBD COC(=O)[C@H]1CNC(=O)CN1C(=O)c1ccc([N+](=O)[O-])[nH]1 344898214 ZZFJYUXWVRKRTH-SSDOTTSWSA-N 296.239 -0.964 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@H]21 357900443 CCWLDDWFUSBYLO-KPCSLPGQSA-N 252.230 -0.297 5 20 CBBD C[C@@H]1C[C@H](N2CCOCC2)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 376189399 SMSGCLMWHYFIJJ-WRWGMCAJSA-N 283.328 -0.027 5 20 CBBD Nc1nc(SCCN2C(=O)CNC2=O)ncc1[N+](=O)[O-] 566498785 NPRHSOTZTWVHOZ-UHFFFAOYSA-N 298.284 -0.389 5 20 CBBD Nc1nc(SCC(=O)N2CCNC2=O)ncc1[N+](=O)[O-] 573104294 NPXSTMDSINMMMQ-UHFFFAOYSA-N 298.284 -0.389 5 20 CBBD C[C@H](CCO)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 593107866 PFUUHQFJONCYSC-MWLCHTKSSA-N 272.305 -0.145 5 20 CBBD C[C@@H](CNS(=O)(=O)c1cccnc1[N+](=O)[O-])C(=O)O 593943629 NBPXZVFYVMEQTO-LURJTMIESA-N 289.269 -0.011 5 20 CBBD C[C@H]1CN(C)C(=O)CN1CCn1cc([N+](=O)[O-])ccc1=O 782582435 BXIIKJLWSLEKAO-JTQLQIEISA-N 294.311 -0.081 5 20 CBBD O=C(NCCn1cnnn1)c1ccc([N+](=O)[O-])c(O)c1 807918712 DEWNTYJTKVWPQL-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD O=C1CC[C@@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)N1 845092338 VTGQUHAXSXZGDT-ZETCQYMHSA-N 268.229 -0.387 5 20 CBBD Cc1cnc(NCCCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1094741541 CALMWKQBDPXVBS-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD O=C(NC[C@H]1CNCCCO1)c1n[nH]cc1[N+](=O)[O-] 1261473172 DPUJXJPJJJDUNM-SSDOTTSWSA-N 269.261 -0.574 5 20 CBBD CC(C)C(=O)NCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1318361621 JRTXEVBVNGLRET-UHFFFAOYSA-N 284.276 -0.925 5 20 CBBD O=C(O)C1(NS(=O)(=O)c2cccnc2[N+](=O)[O-])CC1 1610730286 WCOBBITZQBCFBM-UHFFFAOYSA-N 287.253 -0.115 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1ccc([N+](=O)[O-])[nH]1 85847363 UWCYOXONPDPXFM-JTQLQIEISA-N 269.213 -0.104 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCN(CCO)CC1 230682281 YAHWVQPKXGOCGL-UHFFFAOYSA-N 295.299 -0.678 5 20 CBBD CCCNC(=O)CNc1ncc([N+](=O)[O-])c(N)n1 263978854 ZKUWUABVLHYLRS-UHFFFAOYSA-N 254.250 -0.095 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CCNC1=O 340100763 IJPBHNIRPAUOLZ-MRVPVSSYSA-N 252.230 -0.117 5 20 CBBD CCn1cc(S(=O)(=O)NCC[C@H](C)N)c([N+](=O)[O-])n1 353217285 LSOMSFULBUVWNR-ZETCQYMHSA-N 291.333 -0.173 5 20 CBBD C[C@H]1NCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 434707103 PTKGJDNDSUQESQ-HTQZYQBOSA-N 268.277 -0.557 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)OC[C@H]2C1 493427691 QETGBYVSWBZXPO-SSDOTTSWSA-N 267.245 -0.031 5 20 CBBD CO[C@@H]1COC[C@H]1NCCn1cc([N+](=O)[O-])cn1 568997316 KZJNHTNFCNEYKR-NXEZZACHSA-N 256.262 -0.205 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@](C)(O)CO)n1 572408534 BHBGJCWJCGOOHX-NSHDSACASA-N 285.256 0.152 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCC(=O)N1 599697645 RBAYVPPNMVFBHJ-WCBMZHEXSA-N 295.299 -0.178 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)NC[C@@H]2C1 610588895 DFWHOKDIBJBFPE-SSDOTTSWSA-N 266.261 -0.458 5 20 CBBD COC(=O)CN(CC(=O)OC)Cn1nccc1[N+](=O)[O-] 728561540 XGJAEKGKVCXIGC-UHFFFAOYSA-N 286.244 -0.603 5 20 CBBD Nc1ccc(C(=O)NCC2(CO)COC2)cc1[N+](=O)[O-] 747525369 IYUTWRAYVCAPPB-UHFFFAOYSA-N 281.268 -0.084 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]2CCCC[C@@H]2N1 839700700 GXEZWMHLJOAXAS-UTINFBMNSA-N 267.285 -0.079 5 20 CBBD COCCCNC(=O)[C@H](C)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672664 KOWAVFWXZNVPQN-DJLDLDEBSA-N 274.273 -0.264 5 20 CBBD COC(=O)c1nsc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 844517561 ASIKDSXZHWYFJU-QWWZWVQMSA-N 272.242 -0.072 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)c1ccn2nnnc2c1 851046750 RVVTVBSNNBVCPG-ZCFIWIBFSA-N 251.202 -0.054 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCS(=O)(=O)CC1 1323120472 JCRUXMBDYGVONE-UHFFFAOYSA-N 274.258 -0.812 5 20 CBBD O=CN1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 1347758152 ALIMCOYVRZBQSK-LBPRGKRZSA-N 297.315 -0.684 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1607500103 KAMLAFRAVDQXOE-SNVBAGLBSA-N 284.228 -0.712 5 20 CBBD Cc1cnc(OCCS(N)(=O)=O)c([N+](=O)[O-])c1 157973559 NLMVDSKGCQAUFP-UHFFFAOYSA-N 261.259 -0.034 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C 186825495 YKKQUAVWDJIVTP-ZETCQYMHSA-N 281.272 -0.369 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1CO 360862079 UTNAEPXAOJDIOJ-NXEZZACHSA-N 295.295 -0.157 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C1=O 559277907 XNLICFHIUCXESG-SSDOTTSWSA-N 293.235 -0.213 5 20 CBBD NC(=O)CSc1ncnc(N2CCOCC2)c1[N+](=O)[O-] 598630054 SMAFNBWSUUAKGN-UHFFFAOYSA-N 299.312 -0.201 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(O)c([N+](=O)[O-])c1 600241114 JATZADZHASWADH-APPZFPTMSA-N 295.251 -0.639 5 20 CBBD CN1CC[C@H](OC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1=O 734894639 KSURXLOCMWPDSI-VIFPVBQESA-N 295.251 -0.470 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 782879495 NEZSWHKFSBOLQR-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(CNC(=O)C(F)(F)F)C1 831122144 XEGGKJOXKBLCAN-RNFRBKRXSA-N 295.217 -0.212 5 20 CBBD O=C([C@H]1CCCO1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839462614 BUZNYTBSHOJURC-GMTAPVOTSA-N 297.311 -0.499 5 20 CBBD CCOCCNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157775623 SHPWPAIJPPYKCD-NXEZZACHSA-N 259.306 -0.216 5 20 CBBD COC(=O)COCC(=O)Nc1c([N+](=O)[O-])cnn1C 1323710446 VEXZDFVKPIIOPM-UHFFFAOYSA-N 272.217 -0.544 5 20 CBBD Cc1noc(CN2C[C@@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 1327535716 SBBCKWJCGPJVEJ-JGVFFNPUSA-N 257.246 -0.324 5 20 CBBD COCCN(CCC(=O)O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1599236096 UXKXSYFCUWULFX-HTQZYQBOSA-N 260.246 -0.399 5 20 CBBD COC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cn1C 71266652 QMFULMZTUDOXPA-MRVPVSSYSA-N 257.246 -0.330 5 20 CBBD C[C@@H](CN(C)c1ncc([N+](=O)[O-])c(N)n1)c1nnn[nH]1 132907618 HWDVAWYSSODCLB-YFKPBYRVSA-N 279.264 -0.280 5 20 CBBD Nc1c(C(=O)N[C@H]2CNC(=O)C2)cccc1[N+](=O)[O-] 230655030 BCUISUHWBXGNRV-ZCFIWIBFSA-N 264.241 -0.205 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1CCCNC1 238142957 BKTSQAKWFGFIQC-SECBINFHSA-N 280.284 -0.375 5 20 CBBD C[C@@H](O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247525540 NTJYTNGCEUJWMW-PSASIEDQSA-N 258.278 -0.535 5 20 CBBD CCc1nn(C)c(NCCC(=O)NC(N)=O)c1[N+](=O)[O-] 288299078 CBFWPWLSIXGBSR-UHFFFAOYSA-N 284.276 -0.112 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)[C@H](CO)C2)n1 316920416 VJHRVYLALHTHSH-IMTBSYHQSA-N 283.240 -0.523 5 20 CBBD NC(=O)CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 336813900 VWLLMZMHQIDLEZ-UHFFFAOYSA-N 291.260 -0.112 5 20 CBBD COCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 343960456 VRZAWHHYOBYVPQ-ZETCQYMHSA-N 284.272 -0.301 5 20 CBBD CCCN(CC(=O)NC)C(=O)c1c([N+](=O)[O-])cnn1C 347095283 IFWWEUCSKDLYMI-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CCn1cnnc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 349891852 LCPHCWOAWILSFK-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD O=C(NCCn1cccn1)c1cc([N+](=O)[O-])n[nH]1 350071565 FFQAVJAAQQRLTC-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)C[C@@H](O)CO)c1 356567292 PWRVSMFHXXGIOJ-QMMMGPOBSA-N 261.255 -0.278 5 20 CBBD CC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 357844892 BYGZYDZOQKHHLT-ZCFIWIBFSA-N 255.234 -0.829 5 20 CBBD CCOC[C@@H](O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359041448 RVPLQOQIPQCAPS-QMMMGPOBSA-N 284.272 -0.069 5 20 CBBD COC(=O)[C@@H](C)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 361636569 IFRPLTLIAVRURD-SCZZXKLOSA-N 286.288 -0.355 5 20 CBBD COC(=O)[C@@H]1C[C@H](OC)CN1c1ncc([N+](=O)[O-])c(N)n1 372787256 WDLYHXNGTGQNEO-BQBZGAKWSA-N 297.271 -0.266 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 592198820 OYKQFOSXJUGEKQ-UWVGGRQHSA-N 298.299 -0.353 5 20 CBBD CCNC(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 594214976 KCUQMFYIVHVEOR-UHFFFAOYSA-N 281.272 -0.103 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 770429181 AFVXSRMJEXCMQG-VIFPVBQESA-N 297.267 -0.169 5 20 CBBD Cn1cnn(CC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)c1=O 819893911 WRMGLGBFNRQTSX-UHFFFAOYSA-N 292.255 -0.289 5 20 CBBD CS(=O)(=O)N1CCC[C@H]1C(=O)OCCC[N+](=O)[O-] 860913887 LVDHVLSFLCWNDL-QMMMGPOBSA-N 280.302 -0.380 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC=CCN2)c1 923429516 WFMLKGVBEIKLRA-JTQLQIEISA-N 253.262 -0.471 5 20 CBBD Cc1cnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126938533 CXJBJXFANQLFBO-GHMZBOCLSA-N 279.300 -0.344 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1nccn1C 1261911408 CGGZLYYXJHTWHA-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD NC(=O)N1CCCN(c2ncc([N+](=O)[O-])cn2)CC1 1320376209 CUQLMUPVHWAHEC-UHFFFAOYSA-N 266.261 -0.024 5 20 CBBD CN1CC[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1322767098 ZREQEVXLSNTQLO-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD COC(=O)[C@H]1CCN(CC[N+](=O)[O-])[C@@H](C(=O)OC)C1 1333921489 WKRNNINEBWALHQ-DTWKUNHWSA-N 274.273 -0.310 5 20 CBBD O=[N+]([O-])c1ncccc1-n1cnc(-c2nn[nH]n2)n1 1593486983 FTFKDOXKDYUMNH-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD O=C(O)c1cc(C(=O)N2CC(O)(CO)C2)cc([N+](=O)[O-])c1 1602244053 MZQDHMMMEXXWEJ-UHFFFAOYSA-N 296.235 -0.528 5 20 CBBD COC(=O)Cn1cc([N+](=O)[O-])cc(C(=O)OC)c1=O 47369167 NKVQTIUAWWCIKJ-UHFFFAOYSA-N 270.197 -0.284 5 20 CBBD C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@H](O)C1 278940965 YDMLIWIKDNHGFH-FXAINCCUSA-N 295.295 -0.041 5 20 CBBD N[C@@H]1CCC[C@@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@@H]21 342763780 YVOSJJLIJYIDJQ-KXUCPTDWSA-N 294.315 -0.228 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]1 343987241 OBLMMFRPNXWQLR-UHFFFAOYSA-N 269.217 -0.762 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCN2CCOC[C@@H]2C1 356746887 QIFNKTGWNXPNJI-VIFPVBQESA-N 295.299 -0.515 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1 358061444 GIWFHEIXJADGGN-CYBMUJFWSA-N 294.311 -0.027 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 358388922 NRPOCMBUQSNVOE-NSHDSACASA-N 285.256 -0.033 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])nn1C 360743030 BZKHDLKTFCKDSO-QMMMGPOBSA-N 298.255 -0.658 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1N 429158519 OYTMTCAYPFEMLS-WCBMZHEXSA-N 267.289 -0.013 5 20 CBBD Cc1nc(=NCCN=c2cncc[nH]2)[nH]cc1[N+](=O)[O-] 450273863 IJMMXBAVRYRXGX-UHFFFAOYSA-N 275.272 -0.149 5 20 CBBD C[C@@]1(CO)CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 546103497 CQLVOSLTFGABDJ-NEPJUHHUSA-N 284.316 -0.001 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H](O)CO)c1 561383132 WXPCMEXYDPEBBB-GHMZBOCLSA-N 286.284 -0.723 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H](C)N 562978113 WVNOVWIAHJUKJF-JGVFFNPUSA-N 255.278 -0.109 5 20 CBBD CS(=O)(=O)NCCSc1ncc([N+](=O)[O-])c(N)n1 570291822 FPNDIVAYBPTMPJ-UHFFFAOYSA-N 293.330 -0.392 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCN(CCCO)CC1 1005380066 BDVOEFOVPFJDKF-VXGBXAGGSA-N 285.344 -0.043 5 20 CBBD CC(C)CC(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1041233546 OJWFMDRMJZKLPJ-NXEZZACHSA-N 299.327 -0.613 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1cncn1 1251653383 HFGSHJIBQVCGGX-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD Cn1cnnc1CCOC(=O)Cn1ccc([N+](=O)[O-])n1 1263383043 MOKUGCLPTKLKAW-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322774309 PSJBBJQLUDFJNG-WKEGUHRASA-N 270.245 -0.412 5 20 CBBD C[C@H](/C=C/C(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1592202102 SLIZGXHWDOAYPC-YRFDSLTASA-N 269.217 -0.668 5 20 CBBD O=C1OCC[C@@H]1Nc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1593423080 WCUDCNZHADQHBI-LURJTMIESA-N 291.227 -0.103 5 20 CBBD COC[C@@](C)(NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)O 1599152201 HWHPPPRLPVWVJR-SECBINFHSA-N 272.217 -0.463 5 20 CBBD Nc1c(C(=O)N2CC(O)(C(=O)O)C2)cccc1[N+](=O)[O-] 1608269302 WJMNBPVWHAUCBK-UHFFFAOYSA-N 281.224 -0.552 5 20 CBBD O=C(O)C[C@H]1COCCN1Cn1nccc1[N+](=O)[O-] 1610764760 GNQDUMGUWFFBJS-QMMMGPOBSA-N 270.245 -0.076 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2COCCO2)c1 38061312 FPJPITMCHCIKGL-MNOVXSKESA-N 286.288 -0.843 5 20 CBBD Cc1nc(C(=O)NCCn2cc([N+](=O)[O-])cn2)no1 124580198 XUEPKMAECULCNR-UHFFFAOYSA-N 266.217 -0.087 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H](OCCO)C1 188097102 HGQCZSRRKWTBCY-QMMMGPOBSA-N 284.272 -0.069 5 20 CBBD C[C@H](O)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 227714600 KPFXGQNETSELRW-GXSJLCMTSA-N 272.305 -0.097 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228755682 FYLYVYJHJJQSJA-NSHDSACASA-N 285.304 -0.780 5 20 CBBD COC[C@@](C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 262273773 SUSXRFMHMWGXMK-SNVBAGLBSA-N 286.244 -0.603 5 20 CBBD C[C@@](O)(CNC(=O)c1cccc([N+](=O)[O-])c1N)C(=O)O 262557362 VGUPVSCRALJATQ-LLVKDONJSA-N 283.240 -0.258 5 20 CBBD CC(C)[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 269124063 FUFKYNUMXTYVJM-LURJTMIESA-N 254.250 -0.111 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1C[C@H]2COC[C@@H](C1)O2 338381896 KYTQTCBQLQRVNY-DTORHVGOSA-N 268.273 -0.072 5 20 CBBD O=C1C[C@H](Nc2nc(O)c3cc([N+](=O)[O-])ccc3n2)CN1 342934612 QPTXLLJSXPOXGY-LURJTMIESA-N 289.251 0.544 5 20 CBBD C[C@H]1[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCN1C 343565593 RUSZWJHHLGXTAD-DTWKUNHWSA-N 282.304 -0.215 5 20 CBBD N[C@@H]1C[C@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 563431264 LRHMKMCLEJQBOI-VHSXEESVSA-N 277.284 -0.262 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@@H](O)CO 592430497 UVOYBECDTVDNPI-ZJUUUORDSA-N 286.284 -0.723 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CC(=O)N[C@@H](C)C1 602840928 PGSYJVYZRFHKCG-QMMMGPOBSA-N 267.289 -0.080 5 20 CBBD CC(=O)NCC(=O)OCCn1c([N+](=O)[O-])cnc1C 753951214 SNCVDBVGKVWTGW-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 763709210 NOPNTALVZPKVGN-SECBINFHSA-N 283.240 -0.863 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)O1 808200155 CLGDHGGKQLQLKR-SVRRBLITSA-N 268.229 -0.389 5 20 CBBD C[C@@H](N)CN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 861613216 DUSLFKQJTVTAOH-MRVPVSSYSA-N 270.293 -0.220 5 20 CBBD C[C@](CC(=O)O)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 864199763 XMYJRZADLQHPIX-LLVKDONJSA-N 297.271 -0.054 5 20 CBBD CC(F)(F)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991281302 RTEYTAFALQIWEA-RNFRBKRXSA-N 277.227 -0.366 5 20 CBBD CC(F)(F)C(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1009791110 DJJXPSLYDQZFJL-HTQZYQBOSA-N 291.254 -0.022 5 20 CBBD Cc1nc(=NC(=O)c2c([N+](=O)[O-])c(C)nn2C)n(C)[nH]1 1116571045 PFUDYBHEKZSEDK-UHFFFAOYSA-N 279.260 -0.252 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1261246106 BGNSPSVWSGHNJJ-URLYPYJESA-N 280.284 -0.122 5 20 CBBD Cn1cnnc1CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1326798382 DBYHGGYVULVHJK-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@](N)(CO)C2)n1 1578349888 BWPWZBIPEBBBHF-LBPRGKRZSA-N 297.315 -0.263 5 20 CBBD O=C(NC[C@H](C(=O)O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 1601457335 SQHZRUYJARHESI-RQJHMYQMSA-N 298.255 -0.215 5 20 CBBD C[C@](CO)(NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1604195712 LRUFILRQPCOZLF-SECBINFHSA-N 258.234 -0.784 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H]2COCCO2)c1 38061311 FPJPITMCHCIKGL-WDEREUQCSA-N 286.288 -0.843 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 65769645 NMOUWJSJDZGVDM-MRVPVSSYSA-N 283.288 -0.178 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cn1C 110517456 GGADIDISDVCNDO-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])c1nc(=O)[nH][nH]1 126526123 DRXMHZKGABEBQJ-UHFFFAOYSA-N 292.255 -0.152 5 20 CBBD NC(=O)c1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 179096032 JLDVSHOPQHAKRT-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD COCC[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)OC 291564834 OJHBPZLHQPHMHF-LURJTMIESA-N 286.244 -0.374 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1CCn1cc([N+](=O)[O-])cn1 305129913 MMWMSGRCCFTIIA-KOLCDFICSA-N 270.289 -0.127 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@]1(O)CCSC1 331037862 OJEXZFLBQSTENP-SNVBAGLBSA-N 286.313 -0.225 5 20 CBBD O=C1C[C@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CN1 358890608 PPSKAEMQLFKDGS-VIFPVBQESA-N 299.308 -0.097 5 20 CBBD CC1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](CO)O1 420641885 ZSXOHMHSCIGSGG-SSDOTTSWSA-N 283.288 -0.057 5 20 CBBD Cn1nncc1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 505480566 NQOXAYUKPMPWIE-UHFFFAOYSA-N 263.213 -0.232 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCCN(C)C 550604086 FPJJQEBMAQYLHO-QMMMGPOBSA-N 298.299 -0.016 5 20 CBBD COc1ccc(NC(=O)CNC(CO)CO)c([N+](=O)[O-])c1 574171070 VEEFTXHATLXMBJ-UHFFFAOYSA-N 299.283 -0.515 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N[C@@H]1CCNC1 599615010 XDFAZSRRFDQQRJ-SSDOTTSWSA-N 251.246 -0.105 5 20 CBBD Cn1nnnc1CCNC(=O)c1c(N)cccc1[N+](=O)[O-] 611529291 POGIGXIYEAFESZ-UHFFFAOYSA-N 291.271 -0.327 5 20 CBBD O=C(NC(CO)CO)c1cc([N+](=O)[O-])ccc1O 612556458 BXDRNBCYWIMRSH-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 763723937 KJUQJZWHMZAWLR-SECBINFHSA-N 267.241 -0.569 5 20 CBBD CN(CCN1CCCC1=O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839682007 VVLQGARKITYPMO-RKDXNWHRSA-N 255.274 -0.268 5 20 CBBD CO[C@H]1COCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783666 JZDXGELBDKKLQV-KYXWUPHJSA-N 258.274 -0.181 5 20 CBBD CC(C)(C)CNC(=O)COC(=O)Cn1cnc([N+](=O)[O-])n1 859515024 FDNZPXJJFJLNJV-UHFFFAOYSA-N 299.287 -0.108 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2[C@H]3CC[C@H]2CNC3)c1 923398303 KHAHWPLCVLQMLY-JBLDHEPKSA-N 281.316 -0.412 5 20 CBBD CO[C@H](C)CNC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1118703883 GZFIBEDEIXOMQO-MRVPVSSYSA-N 299.287 -0.941 5 20 CBBD Cc1[nH]nc(C(=O)NCCS(C)(=O)=O)c1[N+](=O)[O-] 1318095722 OXMUVVMYAPARGM-UHFFFAOYSA-N 276.274 -0.599 5 20 CBBD COC(=O)C1(NC(=O)c2c([N+](=O)[O-])cnn2C)CC1 1319657959 QFEKMPIRXOXTMN-UHFFFAOYSA-N 268.229 -0.236 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C(=O)O)O1 1599862743 YFZDODYGLQNFNI-VDTYLAMSSA-N 284.228 -0.368 5 20 CBBD O=C1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CCN1 29187194 FVVFRQWPBZEVFA-UHFFFAOYSA-N 289.251 -0.233 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 50165678 KBWMYKWFCQPHRB-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD NC(=O)CCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 122674723 YUESTGUWCRNPRR-UHFFFAOYSA-N 291.260 -0.112 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@H](C(=O)O)C1 262036927 CAMODXLTCSDGJA-QMMMGPOBSA-N 298.255 -0.588 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])cnc1O)NCC1CC1 272148016 BJIJGIZXTUQWBL-UHFFFAOYSA-N 294.267 -0.049 5 20 CBBD O=[N+]([O-])c1cnc(NC[C@@H]2CN3CCN2CC3)nc1 274007916 ULPKZOBMPRRUOW-SNVBAGLBSA-N 264.289 -0.204 5 20 CBBD CCN1CN(Cc2c([N+](=O)[O-])ncn2C)CC1=O 332702996 NLNUWVHKGIOBAA-UHFFFAOYSA-N 253.262 -0.050 5 20 CBBD C[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 339189429 PKJREWOIRQSRMW-ZETCQYMHSA-N 255.230 -0.747 5 20 CBBD C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)S(N)(=O)=O 359608429 DKLCAOSCZCPGII-YFKPBYRVSA-N 276.274 -0.670 5 20 CBBD C[C@H]1CNCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 432525459 HUBKPESWBGIUOQ-WCBMZHEXSA-N 267.289 -0.095 5 20 CBBD CCc1nncn1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 552232051 KWIZNIKKVNPSJJ-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD COC[C@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])cn1 593066351 MJPLBPZSCVIXBW-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD CO[C@@](C)(CO)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594398906 SJZDDLSNMIOFIK-LLVKDONJSA-N 284.272 -0.301 5 20 CBBD NC(=O)c1cc(N2CCN(CCO)CC2)ccc1[N+](=O)[O-] 596056257 VOJPGWOLTSCRTK-UHFFFAOYSA-N 294.311 -0.192 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 846450718 BMGLJCVGUDWWPB-RKDXNWHRSA-N 296.283 -0.206 5 20 CBBD C[C@@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CCNC1=O 853169635 FODBFMGOFPSEIH-NSHDSACASA-N 282.256 -0.139 5 20 CBBD O=C1NC[C@@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CCN12 1333706872 GEXQFDMZYIXTHT-SSDOTTSWSA-N 279.256 -0.091 5 20 CBBD O=[N+]([O-])c1ccnn1Cc1nnc2n1CCOC2 1344477972 YZDODDXAKMWNLT-UHFFFAOYSA-N 250.218 -0.039 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1CC(O)(C(=O)O)C1 1601344476 KXSKIWMCSQSEFF-UHFFFAOYSA-N 296.235 -0.369 5 20 CBBD Nc1ncc(C(=O)N2CCO[C@@H](C(=O)O)C2)cc1[N+](=O)[O-] 1605655327 MFZAEAPBHHHLIP-MRVPVSSYSA-N 296.239 -0.502 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1N 50702842 CGKHWZJZKUEZTH-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H](CO)O1 229996447 VVPHOYMYIZURAE-RKDXNWHRSA-N 284.272 -0.601 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCOC1 266564199 YXLBUENQGHFVFL-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD COC(=O)[C@@H]1COCCN1CCn1ccc([N+](=O)[O-])n1 267847596 WAKVQKVPJZQJKD-VIFPVBQESA-N 284.272 -0.335 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc(C)cc([N+](=O)[O-])c1N 274224822 QYSFCHHENKHLMH-MRVPVSSYSA-N 297.267 -0.251 5 20 CBBD CCNC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 294094172 QRDZCOWDOKZKNI-UHFFFAOYSA-N 269.261 -0.028 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1O 294433470 YTTRKYUJFPONCH-YFKPBYRVSA-N 268.229 -0.440 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1COC[C@H]1O 296789851 DJXRDMDIYMJBIE-PSASIEDQSA-N 282.252 -0.151 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1 299454387 OFOBIBJLYKWSFI-SNVBAGLBSA-N 295.251 -0.373 5 20 CBBD Cc1nn(Cc2nc(=O)n(C)[nH]2)c(C)c1[N+](=O)[O-] 332701709 XJJGMJLTBRFDCR-UHFFFAOYSA-N 252.234 -0.122 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 339894246 YFBQPAYVDCGXGJ-ZETCQYMHSA-N 267.245 -0.732 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NC1CC1 347237659 LPAGFEMJNYLKDI-UHFFFAOYSA-N 267.245 -0.814 5 20 CBBD CN1CC[C@@](O)(CNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 358486688 UYYYELJUJGXTAO-GFCCVEGCSA-N 295.299 -0.400 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN2CCOC[C@H]2C1 374961009 DWMKKGZNQAJDGC-OPRDCNLKSA-N 255.274 -0.805 5 20 CBBD Cn1nnc(CNC(=O)c2cccc([N+](=O)[O-])c2O)n1 398157906 PTXKDUCAJHDBNL-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD Nc1nccc(C(=O)N[C@H]2C[C@@H](O)C2)c1[N+](=O)[O-] 565213169 FNVPHFXAUFXWRU-IZLXSQMJSA-N 252.230 -0.175 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@@]2(O)CCOC2)n1 566800133 USQVMDISMNKJDB-LBPRGKRZSA-N 297.267 0.560 5 20 CBBD COC[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 581539935 CZMDGGPOAPFWJH-MRVPVSSYSA-N 296.283 0.059 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](CO)CCF 593861211 FMIOZJRLBPMNLE-QMMMGPOBSA-N 287.247 -0.407 5 20 CBBD CNc1nccc(C(=O)NC2(C(N)=O)CCC2)c1[N+](=O)[O-] 594328908 UBWWWQRHAXFGDC-UHFFFAOYSA-N 293.283 0.169 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCOCCN1 597706879 CGUCROFEMWEKPD-UHFFFAOYSA-N 269.261 -0.455 5 20 CBBD CO[C@@]1(C(=O)O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 600869940 NQBWFHIYJZWGPW-NSHDSACASA-N 298.255 -0.507 5 20 CBBD NC(=O)CN1CCN(c2cccnc2[N+](=O)[O-])CC1 603845376 PMGZSTQMLSSSJK-UHFFFAOYSA-N 265.273 -0.403 5 20 CBBD NS(=O)(=O)c1c(NCCO)cccc1[N+](=O)[O-] 603927988 FWFZTYWIJUWRGZ-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD NC(=O)[C@@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 611153068 JGBOFOMFTHMHOZ-SSDOTTSWSA-N 276.256 -0.051 5 20 CBBD COCC(COC)OC(=O)Cn1ccc([N+](=O)[O-])n1 766426859 PAULIFUMXWEUGP-UHFFFAOYSA-N 273.245 -0.004 5 20 CBBD O=C(Nn1cnnc1O)c1cnc(O)c([N+](=O)[O-])c1 770682720 OLDXORDAZMLAEE-UHFFFAOYSA-N 266.173 -0.624 5 20 CBBD CC(C)(O)CONC(=O)Cn1cc([N+](=O)[O-])cn1 791264514 SFJVDFCINNRYQP-UHFFFAOYSA-N 258.234 -0.390 5 20 CBBD O=C(CO)N1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1 882136395 OZBMHLXQWMSUEZ-UHFFFAOYSA-N 284.247 -0.230 5 20 CBBD Cc1cc(NC2(CNC(=O)C(N)=O)CC2)ncc1[N+](=O)[O-] 1110324492 QMVZSDNZVPKUAU-UHFFFAOYSA-N 293.283 -0.156 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCCNC1 1118082272 WPMHQEMJZUVOSV-IUCAKERBSA-N 282.304 -0.309 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)c1cnon1 1135573730 QCTYPUWYNSVWDJ-UHFFFAOYSA-N 295.259 -0.769 5 20 CBBD O=C1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CN1 1319260600 ANMXCLYNBPKYSS-MRVPVSSYSA-N 281.272 -0.566 5 20 CBBD Cc1nn(C)c(C(=O)NCCN2CC[C@H](O)C2)c1[N+](=O)[O-] 1329627327 ZQTNQZKAXUMTNB-VIFPVBQESA-N 297.315 -0.567 5 20 CBBD C[C@](CN)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1345596221 BLINZTMQORQANS-SNVBAGLBSA-N 268.277 -0.570 5 20 CBBD O=C1C[C@@H](Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])CN1 1346828014 IMXZBSUOKBELJF-RXMQYKEDSA-N 255.190 -0.164 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1594724025 SCGDNCSNYRPYEC-VIFPVBQESA-N 270.201 -0.709 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1O 1610683709 XXSRTWZSRBLZFW-ZETCQYMHSA-N 270.197 -0.524 5 20 CBBD COC(=O)[C@H](CO)NC(=O)COc1ccc([N+](=O)[O-])cc1 35161168 DRPCVNBUDSDOPD-JTQLQIEISA-N 298.251 -0.376 5 20 CBBD COC(=O)C(C)(C)NC(=O)Cn1cc([N+](=O)[O-])cn1 46217732 BCUAMFWLXXJBTC-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD C[C@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 269132799 MKXYJZFXUZZUGY-ZCFIWIBFSA-N 253.218 -0.268 5 20 CBBD COC[C@H](O)CCNc1ncc([N+](=O)[O-])c(N)n1 270754983 BLMUJEUSLNPRJD-ZCFIWIBFSA-N 257.250 -0.224 5 20 CBBD COC(=O)[C@H](CNc1c([N+](=O)[O-])ncn1C)OC 292267961 LKJTZVXMFBAPPR-LURJTMIESA-N 258.234 -0.072 5 20 CBBD CNC(=O)NC(=O)Cn1cccc([N+](=O)[O-])c1=O 357041604 QAVYCDQWBKGSPL-UHFFFAOYSA-N 254.202 -0.788 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C(=O)N1 450613569 MPAJWTCLEUZXLB-YFKPBYRVSA-N 270.270 -0.269 5 20 CBBD CCOC(=O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525129088 GQTMDVPLQNJOGR-UHFFFAOYSA-N 289.269 -0.169 5 20 CBBD C[C@H]1CN(CCNC(=O)c2c([N+](=O)[O-])cnn2C)CCO1 536583391 LCVHKWRNJIWGOJ-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CNC(=O)CCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 577527181 LBTLHIGCISWCEC-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](O)[C@@H](N(C)C)C1 579894586 YYGNRJADTHLFQN-UWVGGRQHSA-N 297.315 -0.767 5 20 CBBD CNC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCCC1 751238139 LTECLJFNEOHRLC-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1N 786778163 ZZSUWKAHKOALTH-UHFFFAOYSA-N 252.230 -0.266 5 20 CBBD C[C@@H](O)CN(C)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 820479700 BCHQILZZYNKJQX-ZCFIWIBFSA-N 279.260 -0.013 5 20 CBBD C[C@@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC(=O)NC1CC1 840671979 AMSMYOMAHUPQQW-LPBLVHEISA-N 285.256 -0.429 5 20 CBBD CNc1nccc(C(=O)NCC(=O)N(C)OC)c1[N+](=O)[O-] 848229942 XFAKSXHNRUIYGO-UHFFFAOYSA-N 297.271 -0.219 5 20 CBBD Cn1ccc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1 991282134 WSFLUOXPCMTOJY-GHMZBOCLSA-N 292.295 -0.369 5 20 CBBD O=C(C[C@@H]1CCC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 1118741469 YEGKKLCCPORNBG-QMMMGPOBSA-N 281.272 -0.424 5 20 CBBD CCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1122344070 YFXXOIOEDBQUBK-UHFFFAOYSA-N 255.278 -0.056 5 20 CBBD O=C1CC[C@@H](Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])N1 1261510246 SJFPHRNNNNJZPG-YFKPBYRVSA-N 255.190 -0.022 5 20 CBBD CN1CCN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C[C@@H]1CO 1598622685 BRYDKCUMBBRYHT-SECBINFHSA-N 296.283 -0.199 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 230697465 LUZKUZCVCHBEDW-UHFFFAOYSA-N 279.256 -0.514 5 20 CBBD C[C@@H](O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 275849464 RNITXKMHOJAEBJ-SECBINFHSA-N 267.289 -0.112 5 20 CBBD CC(=O)N1CCN(C(=O)Cn2nccc2[N+](=O)[O-])CC1 341227953 PUQCLOKSTDEJHV-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])n1C 345081989 CDBHCZYQUOZUTM-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD O=C(O)Cn1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 345884860 JTFLTVXPUIHVNB-UHFFFAOYSA-N 279.212 0.456 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)OC[C@@H]2C1 362221073 NUESZFPUQZCCKF-QMMMGPOBSA-N 295.255 -0.546 5 20 CBBD Nc1nc(N2CCN(C(=O)C3CC3)C2)ncc1[N+](=O)[O-] 420636993 OCRXLLJEYWTTKB-UHFFFAOYSA-N 278.272 -0.017 5 20 CBBD NCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 428470232 NLUJAVHPJBOVSF-UHFFFAOYSA-N 254.246 -0.779 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)CO 436437482 YFWNRZNFLROXLQ-SSDOTTSWSA-N 291.285 -0.993 5 20 CBBD O=C(CCN1C[C@H](O)[C@H](O)C1)Nc1ccc([N+](=O)[O-])cc1 444695356 MFPUQLIGRFGQCH-TXEJJXNPSA-N 295.295 -0.039 5 20 CBBD Cn1cc([C@@H](CO)NCCn2cc([N+](=O)[O-])cn2)cn1 494810279 RKJIHHWOMQWNFF-LLVKDONJSA-N 280.288 -0.152 5 20 CBBD Nc1ccc(N2CC[C@@H](S(N)(=O)=O)C2)nc1[N+](=O)[O-] 596122667 ALVCJOSGVZRGCC-ZCFIWIBFSA-N 287.301 -0.561 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2cccnc2[N+](=O)[O-])CC1 610898688 UBBSXBLGICXODD-UHFFFAOYSA-N 286.269 -0.714 5 20 CBBD O=[N+]([O-])c1cnc(N2CC(CCO)C2)c(-c2nn[nH]n2)c1 826500555 BUTPMHVHWAGNIJ-UHFFFAOYSA-N 291.271 -0.012 5 20 CBBD CON1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 854861030 ATISKZLOGKDMGT-UHFFFAOYSA-N 269.261 -0.503 5 20 CBBD CC(=O)N1CC2(CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 1018645331 CXZNEVSMFHWCII-NXEZZACHSA-N 267.285 -0.268 5 20 CBBD C[C@H](C[S@](C)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116837468 HFDGLPKJYYKLLP-NEXAQPNMSA-N 260.275 -0.185 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[C@H]1C(=O)O2 1118875092 NPYBIUUQPWJDIX-SVRRBLITSA-N 278.224 -0.288 5 20 CBBD O=C(NCCNCc1nncs1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936879 VTPJQLXGTCCXSD-RNFRBKRXSA-N 271.302 -0.591 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1 1334336435 BOMYZADHLUSODA-KOLCDFICSA-N 269.305 -0.554 5 20 CBBD CON(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](C)C(=O)O 1594040723 PRRIMBHUNLAJBD-SCSAIBSYSA-N 258.190 -0.205 5 20 CBBD CN(CC(=O)N[C@@H](CO)C(=O)O)c1ccccc1[N+](=O)[O-] 1610109111 VILOOPDJFRJYKC-QMMMGPOBSA-N 297.267 -0.407 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])NCc1nnn[nH]1 44927173 OSHXELPMVWTVOS-UHFFFAOYSA-N 262.229 -0.033 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CCO[C@H](C(=O)O)C1 50442200 FRRWGMWNERVYFS-QMMMGPOBSA-N 296.239 -0.622 5 20 CBBD CCN(CC)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152827302 BTBGIXZDWZHSDE-UHFFFAOYSA-N 291.333 -0.033 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230682104 CZYRVIBTKDKISC-SCSAIBSYSA-N 253.218 -0.824 5 20 CBBD COC[C@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274993705 SHLJCNWTSMWJAW-SSDOTTSWSA-N 271.229 -0.568 5 20 CBBD O=[N+]([O-])c1cnc(N2CCC(O)(CO)CC2)nc1 313626144 LFPLVEVLMGZFFM-UHFFFAOYSA-N 254.246 -0.292 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1 314528882 WEQLGKPKUAWLRH-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1N 315017891 FFXLWOBCHNYJFD-UHFFFAOYSA-N 296.287 -0.379 5 20 CBBD CC[C@@]1(CO)CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 331312527 VNVRBAMLVTXQKD-NSHDSACASA-N 283.288 -0.050 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CC(=O)NCC1(C)C 337475150 WSHFAANFJZLFKP-UHFFFAOYSA-N 281.272 -0.321 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 349487939 PHLFOROYAIDNHK-SECBINFHSA-N 298.251 -0.133 5 20 CBBD C[C@@H]1CCN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 354006707 NCTFHCWMWNHADI-SECBINFHSA-N 282.304 -0.261 5 20 CBBD CC(CO)(CO)CNC(=O)c1ccc([N+](=O)[O-])o1 393877311 BGQZTMCCMWESIJ-UHFFFAOYSA-N 258.230 -0.092 5 20 CBBD CCN1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 452998999 UOVWMTRDGGGROX-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CCC[C@H](O)[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 565785235 OBLWQTXGBBQOHS-BDAKNGLRSA-N 298.299 -0.176 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H]1O 566452431 HJMMCFUOPQQXLJ-IUCAKERBSA-N 283.288 -0.925 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@@H]2CNCCO2)c1[N+](=O)[O-] 580714357 SNEYTWKSWHUOSH-QMMMGPOBSA-N 297.315 -0.011 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@H](CO)[C@@H](O)C2)n1 581491449 TYHLFBNFAIHMGM-XCBNKYQSSA-N 297.267 -0.133 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@H](C(=O)O)C[C@@H]1O 595981967 ZGUBUVSTYDCWKR-XVMARJQXSA-N 270.245 -0.036 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)c1ccnc(N)c1[N+](=O)[O-] 598179307 YYECZSAPKLBQFE-MRVPVSSYSA-N 296.283 0.059 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CN(C)CCO1 610907213 FPWHMRMGTLITMF-ONGXEEELSA-N 297.315 -0.373 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC2(C1)OCCO2 701205470 NFWZYTGBTWKWGU-UHFFFAOYSA-N 282.256 -0.233 5 20 CBBD O=C1CC[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CN1 748116000 IQGKCJFWFLGQFL-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD CCCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CC(=O)N(C)C1=O 839759680 PQHHJCZTDWXSLL-IWSPIJDZSA-N 283.284 -0.353 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](N2CCOC2=O)C1 855499453 YMRNXDGQBTVFKL-DJLDLDEBSA-N 269.257 -0.295 5 20 CBBD CN(C)C(=O)[C@H]1CCCN1CCCNCC[N+](=O)[O-] 905088711 KJSPOPYOVWJQSP-LLVKDONJSA-N 272.349 -0.205 5 20 CBBD CNC(=O)CN1CCC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1001398013 YBSJEAHGOWEBFG-GHMZBOCLSA-N 298.343 -0.774 5 20 CBBD Cc1nc(CCNC(=O)Cn2cc([N+](=O)[O-])nc2C)n[nH]1 1318880334 FAGLQIPKBFALQS-UHFFFAOYSA-N 293.287 -0.115 5 20 CBBD C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCN1CCC(=O)O 1594487170 QCTUATYQWUYBHW-IVZWLZJFSA-N 285.300 -0.341 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCCCC(=O)C(=O)O)n1 1608122429 AUFQACRJLSBJKU-UHFFFAOYSA-N 285.212 -0.081 5 20 CBBD O=C1NC[C@@H](Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)O1 1609044312 SNCKQJDGRZQTGN-LURJTMIESA-N 283.196 -0.437 5 20 CBBD CN(CCNC(=O)c1cccc([N+](=O)[O-])c1N)CC(=O)O 1610119053 OBCQDPLBIWFCOR-UHFFFAOYSA-N 296.283 -0.077 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2CC[C@@](O)(C(=O)O)C2)n1C 1777526257 GDVPSMISDADJNK-JTQLQIEISA-N 270.245 -0.337 5 20 CBBD COC(=O)Cn1cc(C(=O)OC)cc([N+](=O)[O-])c1=O 41744557 ZSQCIGXWGHLMIC-UHFFFAOYSA-N 270.197 -0.284 5 20 CBBD CC(C)N1CC(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 275297459 YATCGBZQFCBXDS-UHFFFAOYSA-N 294.311 -0.035 5 20 CBBD C[C@]1(C(N)=O)CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 280676933 GIMXGGPDVFKEOQ-ZDUSSCGKSA-N 294.311 -0.046 5 20 CBBD O=C1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CN1CC1CC1 287046196 LIFVPOYFTMQMNM-UHFFFAOYSA-N 279.256 -0.030 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 293952863 HSWFADRODYJLGY-UHFFFAOYSA-N 270.249 -0.633 5 20 CBBD CN(C[C@H]1CCC[C@@H]1O)C(=O)Cn1cnc([N+](=O)[O-])n1 330460485 QXOWMNNTVSUGFX-BDAKNGLRSA-N 283.288 -0.194 5 20 CBBD CN(C[C@H]1CCCO1)C(=O)Cn1cnc([N+](=O)[O-])n1 330646284 ZCRAWPFKHSFIPO-MRVPVSSYSA-N 269.261 -0.176 5 20 CBBD Cn1c(C(=O)Nc2ccn(CC(N)=O)n2)ccc1[N+](=O)[O-] 339826143 GZSBEZKCMMETSG-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD CN(C[C@@H](O)CO)C(=O)CN(C)c1ccccc1[N+](=O)[O-] 354157687 HUVUHOYHRKHZGF-SNVBAGLBSA-N 297.311 -0.157 5 20 CBBD C[C@H]1[C@H](CO)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 427831248 XAOIXYVSYLCOBJ-UWVGGRQHSA-N 295.295 -0.014 5 20 CBBD CN1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(=O)N1 539782532 LIXGOIPMGWRUJM-JTQLQIEISA-N 294.267 -0.565 5 20 CBBD CNC(=O)[C@H](O)CNc1cc(C)c([N+](=O)[O-])cn1 757701188 GKLDHKVUAXOPSJ-MRVPVSSYSA-N 254.246 -0.183 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CNOC1 808093737 SBDAAAHRFSOXRP-QMMMGPOBSA-N 270.245 -0.064 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCc1cnsn1 848708396 XICXNJCPSQTDRO-UHFFFAOYSA-N 270.230 -0.219 5 20 CBBD CCS(=O)(=O)C1CN(c2c([N+](=O)[O-])cnn2C)C1 894082019 NUEHTOUORRHIOY-UHFFFAOYSA-N 274.302 -0.048 5 20 CBBD Cn1ccc(N2CCC[C@@H](NCC[N+](=O)[O-])C2=O)n1 905135679 JGEOKDUHFOVVPZ-SECBINFHSA-N 267.289 -0.218 5 20 CBBD COC(=O)CCc1nc(Cn2cnc([N+](=O)[O-])n2)no1 1251751584 GQQVFKIESGZQIT-UHFFFAOYSA-N 282.216 -0.277 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(C(N)=O)CC1 1262366382 DEAYRHONRUZDNV-UHFFFAOYSA-N 254.250 -0.471 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NCC1CCC1 1322218423 IJSHFMSSUYPBHX-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1N 1329483114 JIDJDDCNDJNLRG-JGVFFNPUSA-N 268.277 -0.618 5 20 CBBD Cc1noc(CN2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1329895007 MKOIXKZTVJSWLK-YUMQZZPRSA-N 257.246 -0.181 5 20 CBBD Cn1nncc1CNC(=O)NCCn1cc([N+](=O)[O-])cn1 1342418039 TVUZVRQWQKAMKK-UHFFFAOYSA-N 294.275 -0.581 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC2(CNC2)C1 1579869420 XWFQQOQTTZXEDH-UHFFFAOYSA-N 279.300 -0.078 5 20 CBBD Cc1c(-c2nn[nH]n2)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1C 1591797604 NWPVCKIGBMQOIM-PHDIDXHHSA-N 292.259 -0.488 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc(O)ccc1[N+](=O)[O-] 1608485274 IVHOYJRWDFORTG-ZETCQYMHSA-N 270.197 -0.524 5 20 CBBD Cc1c(C(=O)NCCS(N)(=O)=O)cccc1[N+](=O)[O-] 40223335 BVJADCYAHJSWLY-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD NC(=O)Cn1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)nn1 174171531 MVQFONLSRKVMIB-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228705391 UIZXXISQDNJTSE-KCJUWKMLSA-N 284.272 -0.553 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H](C)CCO)c([N+](=O)[O-])n1 339049819 XBZRXAGENVTTHK-ZETCQYMHSA-N 292.317 -0.140 5 20 CBBD Nc1nc(N2CCN([C@H]3CCOC3)CC2)ncc1[N+](=O)[O-] 364042009 ZLOZVWPYRNLLEC-VIFPVBQESA-N 294.315 -0.122 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H](O)C[C@@H]1CO 370329022 YJGKOJNTYXWYNO-GHMZBOCLSA-N 296.279 -0.072 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 385054517 WQUXHXXPMFQREJ-VXNVDRBHSA-N 254.246 -0.227 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@H](C)N)c1 521999514 XBZTZKJQEMTYKS-LURJTMIESA-N 255.230 -0.110 5 20 CBBD CN(c1ccc(N)c([N+](=O)[O-])n1)[C@H]1CCNC1=O 596177602 JJHRXWMNIVORNG-ZETCQYMHSA-N 251.246 -0.103 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NCCN3CC[C@@H](O)C3)nn12 599176374 RYVIVPANFJAEIV-SECBINFHSA-N 292.299 0.116 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]21 599989217 WLMXKEKLESHAHD-GDGBQDQQSA-N 279.300 -0.190 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 615925270 HPTHVYNUKRMDOE-JTQLQIEISA-N 270.245 -0.377 5 20 CBBD COC[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC 774760814 XWSZPFGVXPVWCJ-MRVPVSSYSA-N 287.228 -0.478 5 20 CBBD CCN(CC)C(=O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 795577563 WYADLECQAZIYDT-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD Cc1nn(C)c(C(=O)OCc2nnn(C)n2)c1[N+](=O)[O-] 799479363 OQFHNQKMTBROGR-UHFFFAOYSA-N 281.232 -0.483 5 20 CBBD CNC(=O)CN1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1000670144 ONPIUQCDTCDLFS-GHMZBOCLSA-N 296.327 -0.854 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCNC(=O)CNC(N)=O 1093500822 NQWPATNYFPPGDE-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@@H]1COCCO1 1255624166 IRXZRLKFFCFBET-ZETCQYMHSA-N 256.218 -0.318 5 20 CBBD C=CC(=O)NCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322366710 WKRROCALIDQXII-UHFFFAOYSA-N 253.218 -0.650 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1324659981 RICVDVGPJAOREC-ZCFIWIBFSA-N 269.261 -0.417 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCC[C@H]1CCNC1=O 1344460143 XWJFCIWJKWFUAX-SSDOTTSWSA-N 283.244 -0.744 5 20 CBBD COC[C@H](O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591452853 BCFATFHFNRHEDX-SSDOTTSWSA-N 295.259 -0.411 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 62118209 OVNDWEXXXGTESN-ZETCQYMHSA-N 268.229 -0.276 5 20 CBBD CNC(=O)c1ccc(N(CCO)CCO)c([N+](=O)[O-])c1 97093817 IICVRVZNPQVHMN-UHFFFAOYSA-N 283.284 -0.255 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(CO)CC1 167677887 NDBWQBWWWFMLTA-UHFFFAOYSA-N 254.246 -0.320 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 264265367 VERVFDMRSWUHSC-QMMMGPOBSA-N 294.267 -0.897 5 20 CBBD Nc1nc(N[C@@H]2CC[S@@](=O)C2)ncc1[N+](=O)[O-] 348745933 XFYAVAKXWFAHFC-NEXAQPNMSA-N 257.275 -0.100 5 20 CBBD CN(C[C@@H](O)CO)C(=O)Cc1cccc([N+](=O)[O-])c1 354157283 FKLRYIJPWGDALZ-LLVKDONJSA-N 268.269 -0.051 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H](O)C(F)F)c1[N+](=O)[O-] 355140118 UKROMMZTZYFZSY-SCSAIBSYSA-N 264.188 -0.018 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 362425546 ZYFUATDGJJNCBO-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD CNc1ccc(C(=O)N[C@@H](CO)C(N)=O)cc1[N+](=O)[O-] 553301304 AJIIARPHBNNCMQ-QMMMGPOBSA-N 282.256 -0.788 5 20 CBBD N[C@@H]1C[C@@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 563431262 LRHMKMCLEJQBOI-NXEZZACHSA-N 277.284 -0.262 5 20 CBBD CC(C)[C@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)C(=O)O 594541421 UNCBDJSTHCGYMG-LURJTMIESA-N 269.261 0.158 5 20 CBBD C[C@@H]1[C@H](N(C)C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 597696621 CYEZUDXRMKTGRO-RKDXNWHRSA-N 282.304 -0.263 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)Cn1ccc([N+](=O)[O-])n1 598180932 HXMVPEHHVLXQMM-SECBINFHSA-N 284.272 -0.335 5 20 CBBD CC(C)[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 725930393 XIMAVQDHFUKAAU-NSHDSACASA-N 297.267 -0.190 5 20 CBBD CN(C)CCN(C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839774083 NKWREMTZTWXSEI-GHMZBOCLSA-N 272.349 -0.349 5 20 CBBD COC[C@H]1CCCN1NC(=O)Cn1cc([N+](=O)[O-])cn1 862605704 ZCYMHMTWQWLUPN-SECBINFHSA-N 283.288 -0.067 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2[C@H]3CCNC[C@H]2CC3)c1 923333520 XGVKHOUPTIZWAK-WZRBSPASSA-N 295.343 -0.022 5 20 CBBD CN(C(=O)C(N)=O)C1CN(Cc2cccc([N+](=O)[O-])c2)C1 1043714531 PNRZHCRVVGTTTA-UHFFFAOYSA-N 292.295 -0.277 5 20 CBBD C[C@@H](CS(C)(=O)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 1116057914 PXAMDFSCVLFHJU-ZETCQYMHSA-N 290.301 -0.659 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1117763229 BUWABDIJIGOCIT-ZMONIFLSSA-N 252.230 -0.372 5 20 CBBD CCNC(=O)CN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319473562 IXJKOAAYDHTEPF-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(=O)NC1CC1 1336696722 CGSIZWUCQBCJCJ-UHFFFAOYSA-N 267.245 -0.663 5 20 CBBD O=[N+]([O-])c1c(N2CCS(=O)(=O)CC2)ccnc1O 1350456778 NULURUZBOGRWRG-UHFFFAOYSA-N 273.270 -0.070 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@](C)(CO)C(=O)O)n1 1600304146 HJUFXIZERYTRLL-NSHDSACASA-N 283.240 -0.136 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CC=C(C(=O)O)C1 1601390236 XUQDVOZUMHHWTE-ZETCQYMHSA-N 281.228 -0.524 5 20 CBBD Cc1cc(C(=O)NCCS(N)(=O)=O)ccc1[N+](=O)[O-] 40218801 TYPXDJAPXOGNNV-UHFFFAOYSA-N 287.297 -0.078 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)OCC1CC1 101878678 NOYDCENWZFJLOJ-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C(N)=O 123675702 IXQRAKBXMZIEDY-SSDOTTSWSA-N 266.257 -0.003 5 20 CBBD C[C@H]1CCNC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 186820342 BUCRDJPIUVKGFK-DTWKUNHWSA-N 267.289 -0.095 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1c1ncc([N+](=O)[O-])cn1 218320256 ZPZLFBLCBYOCBN-RQJHMYQMSA-N 254.202 -0.591 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 274724615 YMPRXXKAXNLVPX-SECBINFHSA-N 284.224 -0.436 5 20 CBBD CC[C@]1(CO)CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 331312526 VNVRBAMLVTXQKD-LLVKDONJSA-N 283.288 -0.050 5 20 CBBD NC(=O)[C@@H](O)CNc1ncnc2cccc([N+](=O)[O-])c12 340914347 WPRKLLVHEJWRIX-QMMMGPOBSA-N 277.240 -0.204 5 20 CBBD COC[C@@H](CO)NC(=O)c1c(N)cccc1[N+](=O)[O-] 357692039 BYDCHSRAOCTYHY-SSDOTTSWSA-N 269.257 -0.086 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCc1nc(O)n[nH]1 359042078 SMHAZBJEWMLXOP-UHFFFAOYSA-N 279.216 -0.443 5 20 CBBD CN=c1[nH]ccc(C(=O)N=c2cc[nH][nH]2)c1[N+](=O)[O-] 516798062 NVLDGIQFXOXAHQ-UHFFFAOYSA-N 262.229 -0.149 5 20 CBBD CN1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(=O)N1 539782537 LIXGOIPMGWRUJM-SNVBAGLBSA-N 294.267 -0.565 5 20 CBBD CNc1nccc(C(=O)N2CCNC(=O)C2)c1[N+](=O)[O-] 568898761 LLYMPMFIZIIDSN-UHFFFAOYSA-N 279.256 -0.397 5 20 CBBD O=C(NCC[C@@]1(O)CCCOC1)c1n[nH]cc1[N+](=O)[O-] 593881536 JCSIHSXYWZIIKS-NSHDSACASA-N 284.272 -0.021 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594348056 PHECKKWXMJAPTO-KRTXAFLBSA-N 296.283 -0.158 5 20 CBBD N[C@H](CO)Cc1cn(-c2ccc(O)cc2[N+](=O)[O-])nn1 594652775 OGVHKYMQDPISMU-ZETCQYMHSA-N 279.256 -0.257 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)N(C)C 1118714704 RWZRLTMKUZWRLT-VIFPVBQESA-N 282.300 -0.177 5 20 CBBD Cc1noc(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 1318304940 SMUOBIZJRXXTLF-UHFFFAOYSA-N 293.239 -0.236 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1C[C@@H]2[C@@H](CO)[C@@H]2C1 1324153158 JFQKTSKPHFKGKA-GDNZZTSVSA-N 279.296 -0.073 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@H]2NCC[C@H]2C1 1326305260 DQLSDHWGYPXOSU-DTWKUNHWSA-N 280.288 -0.603 5 20 CBBD CC(C)[C@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1591886081 YWDZSVNWEGHABI-QMMMGPOBSA-N 271.233 -0.588 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1csc([N+](=O)[O-])c1 37563191 IWUOVNIWOKLVJO-YFKPBYRVSA-N 260.227 -0.168 5 20 CBBD C[C@@H]1C(=O)NCCN1CCn1ccc([N+](=O)[O-])n1 176226880 OTACUKUIZGMBNV-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD Cn1nnc(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)n1 193054683 UXGQUMXDRPIHNO-UHFFFAOYSA-N 288.223 -0.086 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1COCCN1 236080415 JNWCYMVTVVJKPC-MRVPVSSYSA-N 268.273 -0.349 5 20 CBBD O=C(O)c1cc(N2C[C@H](O)[C@H](O)C2)ccc1[N+](=O)[O-] 236612730 GTEYYAATQRWHCC-AOOOYVTPSA-N 268.225 -0.165 5 20 CBBD CNC(=O)[C@H](C)CN(C)c1ncc([N+](=O)[O-])c(N)n1 267138182 XGHDFNMBKZCZFS-ZCFIWIBFSA-N 268.277 -0.215 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@@H]1CO 276024978 SXXGIMLHFJSWIL-GXSJLCMTSA-N 295.295 -0.014 5 20 CBBD CNC(=O)[C@H](CO)Nc1ccc([N+](=O)[O-])c(C)n1 302159339 OWBGSYCTIFLPNP-ZETCQYMHSA-N 254.246 -0.183 5 20 CBBD CN1CCC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 331095631 LMALLLFPCGRUJB-SECBINFHSA-N 281.272 -0.472 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2COC[C@@H]2O)n1 342403402 FNWNBPUWESCTPX-BDAKNGLRSA-N 284.272 -0.357 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@H]1COC[C@H]1O 342432508 KMDVCEAAFPFAID-DTWKUNHWSA-N 283.240 -0.473 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@]2(CCNC2)C1 343641654 OGKRMVXMQDJLPY-LBPRGKRZSA-N 294.315 -0.212 5 20 CBBD CCN(CC(N)=O)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 356901367 ILDWZAYLXCTLHZ-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)OC 359488507 YKKUKFSKCUXYHM-ZCFIWIBFSA-N 286.244 -0.754 5 20 CBBD COCCN1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1=O 596178337 IMEUYLINXDFLGM-UHFFFAOYSA-N 296.283 -0.010 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 599765342 CRZHEHTUBWHECN-ZETCQYMHSA-N 298.255 -0.543 5 20 CBBD NC(=O)CNC(=S)Nc1ccc(N)c([N+](=O)[O-])c1 727064070 SLZUEWXGDCTCTE-UHFFFAOYSA-N 269.286 -0.051 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 763701706 VUKDHUAKCZVRQD-SECBINFHSA-N 285.231 -0.429 5 20 CBBD C[C@H](COC(=O)CCCN1C(=O)CNC1=O)[N+](=O)[O-] 813107620 PHSFWKDQMZLFGI-SSDOTTSWSA-N 273.245 -0.473 5 20 CBBD CN(CCC(=O)O)C(=O)c1c([N+](=O)[O-])cnn1C 820585907 DGAMEVUGDGJFED-UHFFFAOYSA-N 256.218 -0.125 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1ncn(C)n1 1324731650 TZTWYVYXOGRTEL-UHFFFAOYSA-N 293.287 -0.065 5 20 CBBD C[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1nncn1C 1325302684 GFTJMGLCYFOFAS-ZCFIWIBFSA-N 279.260 -0.020 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C(=O)O)O1 1599923734 WWGCUDNGDLRSNQ-XPUUQOCRSA-N 298.255 -0.358 5 20 CBBD COC[C@@](C)(CC(=O)O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610242007 GCJXHIAEIBEPNT-BRDIYROLSA-N 260.246 -0.352 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCNCC1 40507971 XGBSMDJQFQVQGE-UHFFFAOYSA-N 295.299 -0.905 5 20 CBBD CS(=O)(=O)N1CCN(Cn2nccc2[N+](=O)[O-])CC1 48620171 LDBGOJHJIYIDBP-UHFFFAOYSA-N 289.317 -0.674 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 49225434 BBACXSUCSCKJHW-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 73544499 YQJTVHPOMPEBBW-RXMQYKEDSA-N 253.214 -0.096 5 20 CBBD CS(=O)(=O)NCCNc1cccnc1[N+](=O)[O-] 159321836 DRJGLYCDDJRAAK-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD C[C@H]1CCNC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 186707019 ZFSLFOSAOWNECT-WPRPVWTQSA-N 267.289 -0.095 5 20 CBBD COCCN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 271193346 NNNTZRAFSWCYIG-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD COCCN(C)C[C@H](O)Cn1cnc([N+](=O)[O-])n1 311139451 KXRPMMZATPXZJH-QMMMGPOBSA-N 259.266 -0.875 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC(O)(CO)CC1 313625651 INJAZBPKHAVCDP-UHFFFAOYSA-N 269.257 -0.118 5 20 CBBD O=C(NCCNc1cnccn1)c1ccc([N+](=O)[O-])[nH]1 341921229 FYYWOJBKEGYIOQ-UHFFFAOYSA-N 276.256 0.555 5 20 CBBD CN(CC(N)=O)c1cccc(S(N)(=O)=O)c1[N+](=O)[O-] 352391507 MFILHRDSKRTCDQ-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCc1nc(N)no1 360236567 CZKCJPDFULSXEV-UHFFFAOYSA-N 253.222 -0.052 5 20 CBBD CN[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 428412601 INRIXEDEWPYDTM-SECBINFHSA-N 267.289 -0.080 5 20 CBBD NC[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 428514457 WDGNPCRELXHSPO-JTQLQIEISA-N 294.311 -0.046 5 20 CBBD NC(=O)CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 518287834 NOXUULSIZSBPSF-UHFFFAOYSA-N 281.224 -0.419 5 20 CBBD C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H](O)C(F)(F)F 591786309 UELWNCPJDIEQPB-XINAWCOVSA-N 297.193 -0.386 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCOC1 594402759 RJWCMPFTQDHKQC-GFCCVEGCSA-N 295.251 -0.325 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])Nn1c(O)nnc1O 816730818 QSJISFWWAKVJHC-UHFFFAOYSA-N 279.212 -0.090 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCC(=O)NCC(=O)O 821297747 GRFLTPKPGCZENV-UHFFFAOYSA-N 285.212 -0.709 5 20 CBBD O=[N+]([O-])c1ccc(N2CC(O)C2)cc1-c1nn[nH]n1 826498444 VCZBEGVZJFCQRA-UHFFFAOYSA-N 262.229 -0.044 5 20 CBBD C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C(N)=O)C1 840425527 AOBOFLQREYNIGG-JQCXWYLXSA-N 255.274 -0.236 5 20 CBBD O=C(N[C@H]1CCNC[C@H]1F)c1n[nH]cc1[N+](=O)[O-] 1580617231 OHGZVTOVVAMYOM-RITPCOANSA-N 257.225 -0.252 5 20 CBBD O=C(O)CC1(COC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1601923053 WYKNDWGIFNKHGG-UHFFFAOYSA-N 284.228 -0.016 5 20 CBBD O=C(NCC1(C(=O)O)CC1)c1cc([N+](=O)[O-])n[nH]1 1608426749 MNQGUFARPVQXQF-UHFFFAOYSA-N 254.202 -0.088 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCN1CCOC1=O 51717447 KUUZOFDQOSOFMB-UHFFFAOYSA-N 284.228 -0.213 5 20 CBBD CN(CC(=O)NCC(N)=O)c1ccccc1[N+](=O)[O-] 79453402 TWRNFJBUJBCDRR-UHFFFAOYSA-N 266.257 -0.368 5 20 CBBD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(C)CCO 170392287 WSVXJIKBGDHULA-UHFFFAOYSA-N 297.267 -0.007 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 228747111 MIXSHMBGJAHROT-NSHDSACASA-N 270.289 -0.035 5 20 CBBD COCCN1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 270805809 VMZJXYZDPNZQDL-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 282431733 RBRANEDPDXHCRE-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CC(=O)NC1=O 347176283 WSJLXZUFQSZFOS-LURJTMIESA-N 295.255 -0.795 5 20 CBBD O=C1C[C@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)CN1 436975935 AQLGVPPWOWQLNN-ZETCQYMHSA-N 265.225 -0.081 5 20 CBBD CC[C@H](C)N(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 442752733 TYUFAEXQLYBYQP-ZETCQYMHSA-N 285.260 -0.102 5 20 CBBD COC(=O)N1CC(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 496420232 SJQJERDGWLIVGI-SNVBAGLBSA-N 299.287 -0.808 5 20 CBBD Cc1cc(C(=O)N[C@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 539781128 OTFIHLRCQBFEQJ-VIFPVBQESA-N 278.268 -0.022 5 20 CBBD C[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 565265295 UYGNMEHBAXSBKO-ZCFIWIBFSA-N 271.233 -0.436 5 20 CBBD Nc1ccc(N2CCO[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 595965543 FVRXTXNSOIANOY-SSDOTTSWSA-N 268.229 -0.138 5 20 CBBD C[C@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)[C@H](C)CO1 596428111 HELCUQLGQFQLPS-BDAKNGLRSA-N 296.331 -0.090 5 20 CBBD CC[C@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 726996300 HUCFDQLMECHIID-ZETCQYMHSA-N 256.218 -0.402 5 20 CBBD Cc1cc(F)cc(C(=O)NCC(=O)NCCO)c1[N+](=O)[O-] 746225737 FHVYXXHPWBZRLI-UHFFFAOYSA-N 299.258 -0.119 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 804357108 YMZBRMZIJSABMA-ZETCQYMHSA-N 287.659 -0.176 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 863632967 QXQXBRRKMQCBFO-YFKPBYRVSA-N 271.233 -0.544 5 20 CBBD COC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 1117653150 KSDSHBWQWGCBNX-QMMMGPOBSA-N 272.261 -0.777 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCN(C=O)CC1 1326742957 BZDWPRYWRQVPNI-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](n2cncn2)C1 1341015927 WPHRYQYJQKVTIY-ZETCQYMHSA-N 277.244 -0.003 5 20 CBBD CN(CCNC(=O)c1ccc([N+](=O)[O-])cc1N)CC(=O)O 1598493293 VRZSTOSQGHFJRM-UHFFFAOYSA-N 296.283 -0.077 5 20 CBBD O=C(O)[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 50469764 MDSCZJCKWZQHDU-SSDOTTSWSA-N 284.228 -0.897 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](O)C(=O)O 164797068 VGRCXVNJSYMGMC-QMMMGPOBSA-N 284.224 -0.221 5 20 CBBD Cn1cnc(C(=O)NCCn2cc([N+](=O)[O-])cn2)c1 179367001 PISDZRAOAIUNAR-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD COC[C@@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228343478 KTFIQUQYNPVMEK-MWLCHTKSSA-N 288.304 -0.861 5 20 CBBD C[C@]1(O)CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 245880906 ICPORKCTRWXGMI-NEPJUHHUSA-N 284.316 -0.001 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)Cn2ccc([N+](=O)[O-])n2)c1 270202794 ZSJWXRQTOAMIGX-MRVPVSSYSA-N 282.216 -0.043 5 20 CBBD COC(=O)[C@H](CO)NC(=O)CNc1ccccc1[N+](=O)[O-] 272304871 XHTIRIDQZZBNTM-VIFPVBQESA-N 297.267 -0.343 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H](CC1CC1)C(=O)O 347517666 MKVNOFYOQULBNQ-SSDOTTSWSA-N 283.244 -0.444 5 20 CBBD NC(=O)COCCNC(=O)Cc1ccc([N+](=O)[O-])cc1F 358480573 QPYRPQRAWWJZPO-UHFFFAOYSA-N 299.258 -0.106 5 20 CBBD CCN1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 361415860 ZNWCNCJOFPMTCG-UHFFFAOYSA-N 267.245 -0.410 5 20 CBBD O=C(O)c1cnc(N2CC[C@@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1 396795565 DUOGSHHRZGVFRU-WCBMZHEXSA-N 297.267 -0.133 5 20 CBBD Cc1c(NC(=O)C(=O)NCCC(N)=O)cccc1[N+](=O)[O-] 445920039 PUDWCOQJCCDFGU-UHFFFAOYSA-N 294.267 -0.167 5 20 CBBD Nc1nccc(C(=O)N2CCOCC2)c1[N+](=O)[O-] 548713324 DARHHKNJYFSDBG-UHFFFAOYSA-N 252.230 0.044 5 20 CBBD Cn1cnc(NC(=O)c2cc([N+](=O)[O-])cn2C)n1 562189571 GQQPCRQIDDZTLY-UHFFFAOYSA-N 250.218 0.314 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@H](C(=O)O)C[C@H]1O 595981966 ZGUBUVSTYDCWKR-RRKCRQDMSA-N 270.245 -0.036 5 20 CBBD C[C@H]1[C@@H](N(C)C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 597696620 CYEZUDXRMKTGRO-IUCAKERBSA-N 282.304 -0.263 5 20 CBBD CCn1cc(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])nn1 598141195 WGWRGLCFHSWGFB-UHFFFAOYSA-N 291.271 0.113 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1C[C@@H](C(=O)O)C1 703465024 CZNHBPUHADOMGD-KNVOCYPGSA-N 268.229 -0.229 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@@H](COC)C(N)=O)c1[N+](=O)[O-] 760077277 OWQSUTXLUVZOKS-ZETCQYMHSA-N 299.287 -0.500 5 20 CBBD NC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1N 774969878 RHVDDUHRFVOSNM-UHFFFAOYSA-N 282.212 -0.471 5 20 CBBD C[C@H](COC(=O)CN1CC(=O)N(C)C1=O)[N+](=O)[O-] 860777054 JVMXUPAHBQPCEM-ZCFIWIBFSA-N 259.218 -0.911 5 20 CBBD Nc1ccc(C(=O)NCCOCCO)cc1[N+](=O)[O-] 914534175 MMLLETQKMLDBLZ-UHFFFAOYSA-N 269.257 -0.084 5 20 CBBD NC(=O)C(=O)NCCCNCc1cccc([N+](=O)[O-])c1 1165614086 SUNNZYDWYOGBJH-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD NC(=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1318829559 ZEOQTUGWGQNWTQ-UHFFFAOYSA-N 255.234 -0.827 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CCN(C)C(=O)C2)c1[N+](=O)[O-] 1321273139 GFDKJGHACLJONF-MRVPVSSYSA-N 295.299 -0.013 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCn1ccnc1 1323228110 XOCLOSWTORWWDK-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC2(CCNCC2)C1 1328523721 YLPMMUWJGFTJRF-UHFFFAOYSA-N 294.315 -0.212 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN([C@@H]2CCOC2)CC1 1338059868 MHKOWTDRCZSEGN-SNVBAGLBSA-N 296.331 -0.497 5 20 CBBD CN1CC[C@H](N2CCC(NCC[N+](=O)[O-])CC2)C1=O 1346339141 KEWXCYYNZUFWBD-NSHDSACASA-N 270.333 -0.452 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc(O)nn1 187419411 XLNOAYHYXWFIDX-UHFFFAOYSA-N 264.201 -0.074 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H]2CNC[C@H]2C1 290174821 PDAGJSKNLJJDAW-ZJUUUORDSA-N 279.300 -0.141 5 20 CBBD CCN(CC(=O)OC)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 299586096 UPGDRLQJFWNWKD-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD Cc1cn(CC(=O)N2CCC[C@H](C(N)=O)C2)nc1[N+](=O)[O-] 337939078 ZFPAMFMSRXPMCB-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 345443431 DNKVEZSJYBGCPV-GFCCVEGCSA-N 299.283 -0.023 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@H]1CCN(S(C)(=O)=O)C1 400181343 AGGFYCIYJYXOFD-ZETCQYMHSA-N 289.317 -0.226 5 20 CBBD Nc1nc(N2CC[C@H]3CCN[C@@H]3C2)ncc1[N+](=O)[O-] 591439646 XNYVNPXLMBRSHL-HTQZYQBOSA-N 264.289 0.155 5 20 CBBD O=C(NCCOc1ccc([N+](=O)[O-])cc1)NC(CO)CO 610403322 JDJZICLRBTWPOY-UHFFFAOYSA-N 299.283 -0.374 5 20 CBBD C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CN(C)CCO1 839710100 VDHAICXCPLOMBS-ZYUZMQFOSA-N 257.290 -0.513 5 20 CBBD Cn1[nH]c(COC(=O)CCn2cc([N+](=O)[O-])cn2)nc1=O 1323969155 YJRQVCOCRXVWCI-UHFFFAOYSA-N 296.243 -0.653 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](n2cncn2)C1 1341015912 WPHRYQYJQKVTIY-SSDOTTSWSA-N 277.244 -0.003 5 20 CBBD CCN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCNC1=O 1343587322 BFLUHQJZIQTYHY-MRVPVSSYSA-N 293.283 -0.197 5 20 CBBD C[C@@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 51818950 REOLLYNUCRJKAU-ZCFIWIBFSA-N 255.230 -0.264 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H](O)CN1 150755175 OUBWGIAFGWRTPN-NEPJUHHUSA-N 294.311 -0.154 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1 230753584 XMNBTMDSRAPIHL-UHFFFAOYSA-N 265.273 -0.040 5 20 CBBD CN1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 304332687 OFGQFOJJKOKJTP-LLVKDONJSA-N 269.305 -0.600 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC(O)C1 331609249 PAUXQGINEIXBKG-BOBPJJCASA-N 270.289 -0.393 5 20 CBBD CCOc1ccc(C(=O)N[C@H](CO)C(N)=O)cc1[N+](=O)[O-] 341736821 LTVLZUQIFAEUHT-MRVPVSSYSA-N 297.267 -0.431 5 20 CBBD O=C(N[C@@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])cnc1O 359445009 WCVMEEIHJAYYKA-ZLWQNGGKSA-N 285.281 -0.054 5 20 CBBD CCN1CCOC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 378445940 WXZSFMQEBJDOIU-LLVKDONJSA-N 297.315 -0.372 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@H](O)[C@H](CO)C2)n1 396812943 QSYXDWXGYLHESU-XVKPBYJWSA-N 297.267 -0.133 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C(=O)O)O1 431802377 WWGCUDNGDLRSNQ-SVRRBLITSA-N 298.255 -0.358 5 20 CBBD Cc1noc(CNC(=O)NCCn2cc([N+](=O)[O-])cn2)n1 489923467 ZLHTYGNMOHSSKI-UHFFFAOYSA-N 295.259 -0.018 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@@H]2CN(C)NC2=O)c1[N+](=O)[O-] 539782378 OBSUHKSEHJQHAK-SSDOTTSWSA-N 296.287 -0.655 5 20 CBBD CNc1nccc(C(=O)NC[C@H](C)O)c1[N+](=O)[O-] 553546166 LTTXQJPEPDKFMA-LURJTMIESA-N 254.246 0.142 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 558764184 JEQIREXOFIGVFA-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@@H](O)C[C@H]2CO)n1 592978992 ZGSHZTUOMSWAOD-YUMQZZPRSA-N 297.267 -0.072 5 20 CBBD COC(=O)[C@](C)(CO)NCCn1cc([N+](=O)[O-])cn1 595526235 IECJMIMJEZLDCX-JTQLQIEISA-N 272.261 -0.695 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 611209481 ZVLNKVHLDDIVPH-LURJTMIESA-N 267.245 -0.332 5 20 CBBD C[C@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C[C@@H]1O 611257460 OILALQIQUSKNRP-YUMQZZPRSA-N 287.297 -0.009 5 20 CBBD COC[C@H](O)C(=O)OCCn1cc([N+](=O)[O-])cn1 766137120 HVXULYXGALYJSR-QMMMGPOBSA-N 259.218 -0.658 5 20 CBBD C[S@](=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 770440624 PSWOTSODPMNRHJ-SFHVURJKSA-N 273.270 -0.196 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1cc([N+](=O)[O-])n[nH]1 795849766 ADBUUNHFRSODGK-RKDXNWHRSA-N 295.299 -0.089 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CN(C)CCO1 839710098 VDHAICXCPLOMBS-SGIHWFKDSA-N 257.290 -0.513 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCO1 861967805 KFKCUMIFKXSKCO-SECBINFHSA-N 270.245 -0.330 5 20 CBBD COCC(=O)N1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891879857 YEGLMNWIWBJFPL-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD CN(CCNS(C)(=O)=O)Cn1cc([N+](=O)[O-])cn1 1321801798 VKDKDSKCLCSLPI-UHFFFAOYSA-N 277.306 -0.770 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(C[C@@H]2CNCCO2)n1 1327023038 TZPYNORYSMOHQS-SSDOTTSWSA-N 294.271 -0.091 5 20 CBBD Nc1nccc(C(=O)N2CC(C(=O)O)C2)c1[N+](=O)[O-] 1601221750 PCSWFUGIEYYIIB-UHFFFAOYSA-N 266.213 -0.271 5 20 CBBD O=C(O)[C@H](O)C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1610723647 XIOSHZPODCYSDT-SECBINFHSA-N 298.255 -0.384 5 20 CBBD CCN(CCNCc1ncnn1C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1754045204 IBLHXBVQGGAEJQ-NXEZZACHSA-N 296.331 -0.582 5 20 CBBD COC(=O)CNC(=O)CCn1cc([N+](=O)[O-])nc1C 65742558 HLCQMCJYKZYJOU-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD CN1CCC[C@@H](CN(C)C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330804730 LFEKFESFSDJNKC-SNVBAGLBSA-N 296.331 -0.014 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCN2CCCC[C@@H]12 331623641 HCOBVCJEAAOKIO-ZJUUUORDSA-N 294.315 -0.071 5 20 CBBD O=C1C[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CN1 332273870 XAVTYBXPCRDFGL-ZETCQYMHSA-N 293.235 -0.058 5 20 CBBD O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[C@H](O)CO 339182839 WLCJOYFAEJPFBB-VIFPVBQESA-N 281.224 -0.235 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 341749474 URFXZYHMZXPYAX-JTQLQIEISA-N 292.251 -0.348 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(N)=O 353001033 DWPJPZWYJUAGCW-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@@](C)(O)CO)n1 572408533 BHBGJCWJCGOOHX-LLVKDONJSA-N 285.256 0.152 5 20 CBBD CC1(O)CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 594322224 YHCVXEUVYDLCJT-UHFFFAOYSA-N 252.230 -0.221 5 20 CBBD Nc1ccc(N2CC[C@@H](CO)[C@H](O)C2)nc1[N+](=O)[O-] 596207975 UDFSAPXFGRWXCG-IONNQARKSA-N 268.273 -0.249 5 20 CBBD COC(=O)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 610260324 LQFXHTZQJFOMMQ-UHFFFAOYSA-N 289.269 -0.169 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 825630716 PEMKYHYXNSMZGR-KCJUWKMLSA-N 293.279 -0.025 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C(=O)O 828442044 XCUXWYROEUFIOT-DVVUODLYSA-N 298.299 -0.195 5 20 CBBD O=C(O)[C@H]1C[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 833178623 HLIHFKKXPJGQIU-SFYZADRCSA-N 268.229 -0.372 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C)N1 923285897 HNSUHFXORFMARU-CKYFFXLPSA-N 283.332 -0.166 5 20 CBBD NC(=O)C(=O)NCCCNc1ccccc1[N+](=O)[O-] 1094742381 VJYPYSOULDTNTD-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCO[C@H](CN)C1 1118165313 UEAJOPHPXSOETD-SNVBAGLBSA-N 297.315 -0.324 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)NCCO 1319340871 JUWNYYDGESKNEY-UHFFFAOYSA-N 296.283 -0.525 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)O[C@@H]1CCS(=O)(=O)C1 1516638579 WSPOCBTZBYKEKY-MRVPVSSYSA-N 289.269 -0.478 5 20 CBBD Cc1nn(CCS(=O)(=O)CC(=O)O)cc1[N+](=O)[O-] 1594488462 HNAKUGUUSBUKGM-UHFFFAOYSA-N 277.258 -0.401 5 20 CBBD Cc1c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cnn1CC(=O)O 1600046461 DEDZDBDCAKLKRP-HTRCEHHLSA-N 268.229 -0.120 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1 14300855 HJRNKNFQCYUUSJ-QMMMGPOBSA-N 295.255 -0.234 5 20 CBBD Nc1nc(N[C@@H]2CCC(=O)NC2)ncc1[N+](=O)[O-] 264161267 UURGVNGQUNIHQK-RXMQYKEDSA-N 252.234 -0.343 5 20 CBBD CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 279418076 SVLKAYCQAQSICU-JTQLQIEISA-N 295.295 -0.014 5 20 CBBD COc1cc(S(=O)(=O)NCC(=O)O)ccc1[N+](=O)[O-] 340449568 MXNNNNZXJQTHTI-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD CN(C)C[C@@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357458083 XLLYEJHATUEVFW-LBPRGKRZSA-N 297.315 -0.187 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 425097364 YHFWHRFZYMCURB-MRVPVSSYSA-N 295.255 -0.945 5 20 CBBD Nc1nc(=NC[C@H]2CCCC(=O)N2)[nH]cc1[N+](=O)[O-] 432918849 QPWSTXVDKFZXGW-ZCFIWIBFSA-N 266.261 -0.531 5 20 CBBD COC(=O)NCCNc1ncc([N+](=O)[O-])cc1C(N)=O 497137654 ZHDSDDWJNMKPTA-UHFFFAOYSA-N 283.244 -0.143 5 20 CBBD O=C(O)C(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 584353649 IPRBWWIBWFWYLU-UHFFFAOYSA-N 297.271 -0.980 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCC2(CO)CCC2)c1 592430203 HQRDXYWLNXCYGF-NSHDSACASA-N 284.316 -0.096 5 20 CBBD C[C@@H](C(=O)O)N(C)S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600653670 MCRZVOKDFOARHS-YFKPBYRVSA-N 292.273 -0.578 5 20 CBBD Cc1nn(C)c(C(=O)N2CCNC(=O)C[C@@H]2C)c1[N+](=O)[O-] 610242208 UKZIMFDGRUSTOH-ZETCQYMHSA-N 295.299 -0.013 5 20 CBBD O=C1CCC(C(=O)OCCn2cc([N+](=O)[O-])cn2)=NN1 748103503 JDBOITOWAIJAPE-UHFFFAOYSA-N 281.228 -0.400 5 20 CBBD CC[C@](C)(NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 770021591 YQAKUXQUGDRAIS-LBPRGKRZSA-N 296.283 -0.473 5 20 CBBD Cc1nnc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1031661916 MXHRVKJMYLOTRY-NXEZZACHSA-N 295.299 -0.409 5 20 CBBD CN(CCO)C(=O)C(=O)NCCc1cccc([N+](=O)[O-])c1 1258325716 LRJHTBCRZKLQIS-UHFFFAOYSA-N 295.295 -0.296 5 20 CBBD CN1CC[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1320655649 CBALMYCZYBMHLN-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@]2(CCO)CCOC2)c1[N+](=O)[O-] 1320865941 QKJFOHFFUDAPPL-NSHDSACASA-N 284.272 -0.102 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@@H]2CCCNC2)c1=O 1326017413 AUUUYBGQWNDLGD-MRVPVSSYSA-N 280.284 -0.145 5 20 CBBD CN(Cc1cnn(C)c1)c1nnc(C[N+](=O)[O-])n1C 1341371922 OTZQWGULHRHZGI-UHFFFAOYSA-N 265.277 -0.038 5 20 CBBD O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1N1CC(O)C1 1593482281 XNMGYSKTUIZHKO-UHFFFAOYSA-N 262.229 -0.044 5 20 CBBD O=C1CN(c2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])CCN1 1609589069 DMNVPBFVLPETKN-UHFFFAOYSA-N 289.255 -0.289 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H]2CCCO2)c1 37882052 BYTAMAXDRVHIEN-GHMZBOCLSA-N 270.289 -0.079 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CCO1 43701084 NZJWPHJXHVZIGD-QMMMGPOBSA-N 297.223 -0.791 5 20 CBBD O=C(NN1CCCNC1=O)c1cnc(O)c([N+](=O)[O-])c1 278038450 KTANBLHVMSEGQV-UHFFFAOYSA-N 281.228 -0.245 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@@H]1CC(=O)NC1=O 286090967 UETUUNQMNAUWNZ-ZCFIWIBFSA-N 281.228 -0.805 5 20 CBBD Cn1nncc1CNc1ncc([N+](=O)[O-])c(N)n1 288183397 JEKUQNUQWZYUSK-UHFFFAOYSA-N 250.222 -0.292 5 20 CBBD CC(C)(C(=O)N[C@H]1CNC(=O)C1)n1cc([N+](=O)[O-])cn1 330895268 RTGQKCDPVKRIRB-SSDOTTSWSA-N 281.272 -0.469 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCO[C@@H](CO)C1 331187248 JFSCXSZSJKVZJN-SNVBAGLBSA-N 284.272 -0.599 5 20 CBBD NC(=O)c1ccc(CNc2ncc([N+](=O)[O-])cn2)cn1 354570860 HTQYFMXAVAFVLQ-UHFFFAOYSA-N 274.240 0.491 5 20 CBBD C[C@](O)(CO)CNc1ncc([N+](=O)[O-])cc1C(N)=O 360092673 FSCFHGHUUOWUPQ-SNVBAGLBSA-N 270.245 -0.756 5 20 CBBD CC(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 567768163 DWPKXGGGXJDXKB-UHFFFAOYSA-N 254.250 -0.461 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 592462845 AFXOVOKHWFBEOH-CBAPKCEASA-N 297.267 -0.081 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@@H](C(=O)O)C[C@@H]1O 595981965 ZGUBUVSTYDCWKR-QYNIQEEDSA-N 270.245 -0.036 5 20 CBBD COC(=O)CN(CC(=O)O)Cn1nccc1[N+](=O)[O-] 737619126 YYCATOZYXUKBHF-UHFFFAOYSA-N 272.217 -0.692 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1cc([N+](=O)[O-])cnc1N 779104865 PEQHQZFSBMWUOF-UHFFFAOYSA-N 297.227 -0.816 5 20 CBBD CC[C@@H](C)NC(=O)CN1CCN(CC[N+](=O)[O-])CC1 791054410 UYFIOXNJRISONI-LLVKDONJSA-N 272.349 -0.205 5 20 CBBD O=C(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NCCO 843072082 TWEUVTOFSAUUGL-NSHDSACASA-N 283.284 -0.674 5 20 CBBD O=c1n(CCCNCC[N+](=O)[O-])nc2n1CCCC2 905051155 BTNHGIVUNAASNK-UHFFFAOYSA-N 269.305 -0.363 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1[C@H]2CC[C@H]1CN(CCO)C2 1017544192 MZSVXUQAVLIKEO-UKKRHICBSA-N 269.301 -0.681 5 20 CBBD CN1CCN(C2CCN(CC[N+](=O)[O-])CC2)CC1 1351572139 QGPJVPJNKJRMSE-UHFFFAOYSA-N 256.350 -0.025 5 20 CBBD C[C@@H](O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1590000746 DXQHADRANDHJAX-RXMQYKEDSA-N 265.233 -0.037 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](C)O[C@H](CO)C1 187877139 PKFRAGCDVXSVIF-WPRPVWTQSA-N 298.299 -0.292 5 20 CBBD CC(C)(O)CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 331808505 ASOIWHURNVNAHQ-UHFFFAOYSA-N 283.288 -0.052 5 20 CBBD Cn1c(C(=O)NCCn2ncnn2)ccc1[N+](=O)[O-] 338967389 SZXZJPFZMAYJMH-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD COCCOC[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 358685053 SIFDKXRFBMXKER-VIFPVBQESA-N 286.288 -0.041 5 20 CBBD C[C@@H](N)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 573923426 QTGILBJZQRWBFZ-RKDXNWHRSA-N 282.300 -0.002 5 20 CBBD COCCOC1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 574767353 BEBHDZUVTJGQNU-UHFFFAOYSA-N 296.283 0.059 5 20 CBBD CNc1nccc(C(=O)NCC[C@H](O)COC)c1[N+](=O)[O-] 579855610 DMSKYVLUJGJHKR-QMMMGPOBSA-N 298.299 0.159 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 583093318 IZKQOHSAZDRBPY-LURJTMIESA-N 282.256 0.111 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])NC(CO)CO 611288160 VSNVOEFZXACUSN-UHFFFAOYSA-N 269.257 -0.524 5 20 CBBD CNC(=O)NC(=O)COC(=O)Cn1cc([N+](=O)[O-])nc1C 744664808 YNYSGQKNCOOJGT-UHFFFAOYSA-N 299.243 -0.901 5 20 CBBD Nc1nccc(C(=O)NC[C@@H]2COCO2)c1[N+](=O)[O-] 861976692 ARWGKWXYGUUULM-ZCFIWIBFSA-N 268.229 -0.325 5 20 CBBD Cc1ccnc(N(C)CCN(C)C(=O)C(N)=O)c1[N+](=O)[O-] 1105543086 JJYUKBKCOAEQPV-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD CCNC(=O)CN(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 1117684234 IYGSJVFPROKAPF-UHFFFAOYSA-N 281.272 -0.339 5 20 CBBD Cc1nnc(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)n1C 1257471142 BPVXKKWOEORUMA-UHFFFAOYSA-N 293.287 -0.413 5 20 CBBD NC(=O)[C@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1326232901 SZESMWMSRUHFMT-VHSXEESVSA-N 269.257 -0.936 5 20 CBBD C[C@@H](c1nnc(N2CCC[C@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1525462178 KDERNKMTYXBVAV-YUMQZZPRSA-N 282.304 -0.146 5 20 CBBD COCC[C@@H]1CNCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1579010350 JEEAPKBHLBMUOB-OPRDCNLKSA-N 257.290 -0.512 5 20 CBBD C[C@H](NC(=O)c1cnc(N)c([N+](=O)[O-])c1)C(=O)O 1599902679 JIKQLYFLPCKCRE-BYPYZUCNSA-N 254.202 -0.225 5 20 CBBD CN1C[C@@H](O)[C@H](Nc2ncc(C(=O)O)cc2[N+](=O)[O-])C1 1777093361 YUTADFYFZDNTBE-VXNVDRBHSA-N 282.256 -0.225 5 20 CBBD CCOCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 43794747 YICIQJNPHGTOOV-UHFFFAOYSA-N 255.230 -0.108 5 20 CBBD Nc1ccc(C(=O)N2CCN(CCO)CC2)cc1[N+](=O)[O-] 52077028 IWXZBGGXCLCYDH-UHFFFAOYSA-N 294.311 -0.073 5 20 CBBD C[C@@H](CN1CCCC1=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 55811778 WQUSBFAWZSASMJ-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCC(=O)O)cc([N+](=O)[O-])c1 137090082 WBXRYBBPUJTYPA-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD C[C@H]1CO[C@H](CO)CN1c1c([N+](=O)[O-])ncn1C 168541879 GJAHVOIIFZQIMQ-YUMQZZPRSA-N 256.262 -0.086 5 20 CBBD COCCCOCC(=O)NCCn1cc([N+](=O)[O-])cn1 181448971 DNKBEPASJZEWLE-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2CNC[C@@H]2C1 195218847 CFKMFXBMHFVNPF-AOOOYVTPSA-N 292.295 -0.566 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 276247421 LRPBOUPUAQMNBD-ZETCQYMHSA-N 292.251 -0.045 5 20 CBBD O=C(NCC1(N2CCOCC2)CC1)c1cc([N+](=O)[O-])[nH]n1 287288195 ZFYVFYJOBBLULU-UHFFFAOYSA-N 295.299 -0.088 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 299225617 OJEYDDBNAOJAIN-VIFPVBQESA-N 295.299 -0.095 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 341504541 VICRDANLTBRNAK-MRVPVSSYSA-N 296.287 -0.679 5 20 CBBD NC(=O)CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 351836866 ZIUCYKYJBHPFJC-UHFFFAOYSA-N 267.197 -0.461 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1 436640242 HSUYMMQSZUXTQN-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC(C)(C(N)=O)C1 565301306 RPSFOHDLGVRRTD-UHFFFAOYSA-N 253.262 -0.365 5 20 CBBD C[C@H](N)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 573923415 QTGILBJZQRWBFZ-DTWKUNHWSA-N 282.300 -0.002 5 20 CBBD CCN(CC(=O)NC)C(=O)c1n[nH]cc1[N+](=O)[O-] 763808540 YSJHTUFYJRYTOD-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD COCC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 795478791 APNSALMWEHLFQJ-UHFFFAOYSA-N 284.224 -0.485 5 20 CBBD CN(C)C(=O)N[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 840475036 RQIVFANPEVQLCJ-IVZWLZJFSA-N 284.316 -0.086 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)c1cn(C2CC2)nn1 860583668 AENZIHINCQLFMB-UHFFFAOYSA-N 293.243 -0.030 5 20 CBBD O=C(CCN1CCCS1(=O)=O)OCCC[N+](=O)[O-] 860915339 DWXBLVRSJLNSCK-UHFFFAOYSA-N 280.302 -0.378 5 20 CBBD C[C@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)N(C)C 1324267497 RWZRLTMKUZWRLT-SECBINFHSA-N 282.300 -0.177 5 20 CBBD CC[C@H](O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590475987 BXFADPKQRWIQEH-YFKPBYRVSA-N 253.222 -0.258 5 20 CBBD NC(=O)[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CCO1 92734811 GDUUSTKEQIEBJB-LLVKDONJSA-N 281.268 -0.014 5 20 CBBD O=C(CO)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 129585625 FIAIJLGADFINTL-UHFFFAOYSA-N 299.308 -0.067 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](O)[C@@H](O)C1 278664941 HXIGQKHKHUHNFQ-RYUDHWBXSA-N 295.295 -0.121 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nc(N(C)C)n[nH]1 286111172 VIBISDLRLFWPND-UHFFFAOYSA-N 294.275 -0.077 5 20 CBBD COCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 298072110 CEZUWJOIYJAREN-UHFFFAOYSA-N 298.255 -0.812 5 20 CBBD C[C@@H](CS(C)(=O)=O)N(C)c1ncc([N+](=O)[O-])c(N)n1 301224736 FKTBLAOTTNRQML-LURJTMIESA-N 289.317 -0.164 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1C=C[C@@H](CO)C1 341729723 HALIMWFYWYQZFB-BDAKNGLRSA-N 266.257 -0.156 5 20 CBBD Cn1c(C(=O)NC[C@@H]2CC[C@H](C(N)=O)O2)ccc1[N+](=O)[O-] 347391915 PWJDXUPDUPUCJR-IONNQARKSA-N 296.283 -0.304 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 351825063 GEPLPEUTNHKZGH-IEBDPFPHSA-N 270.289 -0.535 5 20 CBBD O=C(NCCNC(=O)c1n[nH]cc1[N+](=O)[O-])c1cc[nH]n1 356993084 CZBMLHHFJRPRNT-UHFFFAOYSA-N 293.243 -0.799 5 20 CBBD O=C(NCCCc1nc[nH]n1)c1cc([N+](=O)[O-])n[nH]1 572969877 UJHODHNQGFGLJN-UHFFFAOYSA-N 265.233 -0.201 5 20 CBBD O=C(CNCC1CC1)NCCn1cc([N+](=O)[O-])cn1 575044025 CLAVDRCUZZDVSD-UHFFFAOYSA-N 267.289 -0.093 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC(CO)CO 575400998 CMVRVHOVCGHXJJ-JTQLQIEISA-N 286.284 -0.723 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@@H](C)N1 579714778 VUXLCPBWDDVANW-AOOOYVTPSA-N 294.311 -0.035 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 590369825 OMYGQKNMYHAQPE-MRVPVSSYSA-N 284.272 -0.652 5 20 CBBD O=C(O)CNC(=O)COc1ccc([N+](=O)[O-])c(CO)c1 591696851 MEJAHXSTHMNEEI-UHFFFAOYSA-N 284.224 -0.333 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H](C(=O)O)C1CCC1 596003608 SXSVFAIQBQIIMF-QMMMGPOBSA-N 297.271 -0.197 5 20 CBBD O=C(O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 611559286 XLDQRTGPSLZBBB-UHFFFAOYSA-N 257.206 -0.825 5 20 CBBD CNC(=O)[C@@H](O)CNc1nccc(C)c1[N+](=O)[O-] 757693484 QHAMCVVPMXVBGR-ZETCQYMHSA-N 254.246 -0.183 5 20 CBBD O=C(NN1CCCNC1=O)c1n[nH]cc1[N+](=O)[O-] 783599081 AEJAVOVTWQOVNV-UHFFFAOYSA-N 254.206 -0.622 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)CN1CCCC1 808218550 JDHMBGHSTUYSON-JTQLQIEISA-N 297.315 -0.636 5 20 CBBD C[C@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC(=O)N1 836853467 QFGWWBRZNQKNFH-UFBFGSQYSA-N 293.279 -0.025 5 20 CBBD CN1CC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 928563778 RINICIQSAGTWDG-SECBINFHSA-N 280.284 -0.423 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cn[nH]c1 973922833 XTTPPFXLHWMMRZ-UTINFBMNSA-N 293.283 -0.548 5 20 CBBD CCn1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1030294177 ZTOMXCAMILRCBQ-GHMZBOCLSA-N 294.315 -0.736 5 20 CBBD CCN(C(=O)COC)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1079208945 WSSUWBMOIFRPMU-NXEZZACHSA-N 285.300 -0.643 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CO)[C@H](O)C1 1116789016 VOKOFTISOSADOI-IONNQARKSA-N 284.272 -0.856 5 20 CBBD CNC(=O)C1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1317946462 OSQCUTCVZRZEDZ-UHFFFAOYSA-N 295.299 -0.224 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1323961117 XYPSVZTZTGDXEH-JGVFFNPUSA-N 296.283 -0.325 5 20 CBBD O=[N+]([O-])c1ncccc1N1CCN2CCOC[C@@]2(CO)C1 1339840392 JPVPKFKMKUDNSE-ZDUSSCGKSA-N 294.311 -0.127 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC(=O)[C@H]1C[C@H]1C(=O)O 1600990946 KCURDYWJWSXVGA-CRCLSJGQSA-N 254.202 -0.013 5 20 CBBD CCOCCS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152818890 GLAPGBDZJKISDB-UHFFFAOYSA-N 292.317 -0.253 5 20 CBBD Cc1[nH]nc(C(=O)N(C[C@H](C)O)[C@@H](C)CO)c1[N+](=O)[O-] 275963793 HTCZLEXGIKBJGR-BQBZGAKWSA-N 286.288 -0.170 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 280132989 RQPJCARSFYMCOH-GFCCVEGCSA-N 295.299 -0.095 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 298291524 FSDVUZWFXFIIDC-ZETCQYMHSA-N 285.260 -0.348 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@@H](O)[C@H]1CCOC1 359017436 JOQYCTAAZPSJEZ-GZMMTYOYSA-N 296.283 -0.069 5 20 CBBD COC(=O)[C@@H](C)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 361636568 IFRPLTLIAVRURD-PSASIEDQSA-N 286.288 -0.355 5 20 CBBD O=C(O)CNC(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 362439046 VYGVSYRWSSCIHY-UHFFFAOYSA-N 291.223 -0.010 5 20 CBBD CN[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 428412609 INRIXEDEWPYDTM-VIFPVBQESA-N 267.289 -0.080 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1nnc(N)o1 556980482 NTBMELHWHCEWJO-UHFFFAOYSA-N 266.217 -0.172 5 20 CBBD Cc1n[nH]cc1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 576270973 OBBQSRNQUVDIOO-LLVKDONJSA-N 280.288 -0.026 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 588864643 KQOYVCCFTIFLEY-QMMMGPOBSA-N 283.284 -0.047 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCC(=O)N1 599697646 RBAYVPPNMVFBHJ-WPRPVWTQSA-N 295.299 -0.178 5 20 CBBD CN1CC[C@H](OC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 781669849 RKUYIOFYTCIBRP-QMMMGPOBSA-N 280.240 -0.041 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1SC[C@H](O)CO 823630068 QNMCOYBQGHKLOG-RXMQYKEDSA-N 298.284 -0.385 5 20 CBBD CC(C)N1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839684405 VFFVCUZYVZYJJO-HRDYMLBCSA-N 255.274 -0.223 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 854466273 ZWIRPKRHEZWDPD-ZETCQYMHSA-N 283.288 -0.776 5 20 CBBD Cc1cnc(NC/C=C/CNC(=O)C(N)=O)c([N+](=O)[O-])c1 1107480764 SOVLGKBASVQUDC-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CCC(N)CC1 1580008856 DDLHHEJIJVBUAK-UHFFFAOYSA-N 296.331 -0.519 5 20 CBBD C[C@](O)(CO)CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1589992925 FQWZTXCGZGKURV-LLVKDONJSA-N 294.271 -0.070 5 20 CBBD O=C(O)CN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 1602062278 NVUZHJBUAOKPTL-UHFFFAOYSA-N 283.288 -0.507 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CCOCN2)n1 1602404579 SRUUYUSXFBOUCA-UHFFFAOYSA-N 254.202 -0.013 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC(O)CC1 48284142 LNXWBQBUDOGTQY-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD C[C@H](N)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 178688968 SEEBJRLZZFYXMZ-QMMMGPOBSA-N 268.273 -0.390 5 20 CBBD O=C(CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)N1CCCC1 228812144 NKZRDQODZJRENL-LLVKDONJSA-N 297.315 -0.636 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCN1CCC1 337598880 QNJWYQHLABXPGO-UHFFFAOYSA-N 280.284 -0.422 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1C=C[C@@H](CO)C1 341729726 HALIMWFYWYQZFB-RKDXNWHRSA-N 266.257 -0.156 5 20 CBBD NS(=O)(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 345448090 SEEXYMMUGUEHEG-UHFFFAOYSA-N 299.264 -0.521 5 20 CBBD CNC(=O)CCCNC(=O)CCn1cc([N+](=O)[O-])cn1 354021468 FYIOMFLAAJXGMH-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD CN(C)C(=O)NCCNC(=O)Cn1ccc([N+](=O)[O-])n1 357114590 BQXLZSBWRZRUIO-UHFFFAOYSA-N 284.276 -0.821 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@](C)(O)CN1CCOCC1 361090639 YXZBNPBHWIHYHL-LBPRGKRZSA-N 299.331 -0.177 5 20 CBBD Nc1nc(N2CC[C@@H](n3cncn3)C2)ncc1[N+](=O)[O-] 363785071 XKJZNYNJRBJLJD-SSDOTTSWSA-N 276.260 0.010 5 20 CBBD CC(C)C(=O)NCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 393161293 LBMDTLQXPAJUFK-NSHDSACASA-N 299.331 -0.486 5 20 CBBD CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 412529944 WQJVVUCSYOXEFR-NXEZZACHSA-N 299.283 -0.053 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@H](C(N)=O)O1 531594758 HSZKKTNROREHIB-WCBMZHEXSA-N 296.283 -0.304 5 20 CBBD Cc1nn(C)c(N2CC[C@@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 583476687 RZJCKVMRMQVCKP-DTWKUNHWSA-N 270.289 -0.184 5 20 CBBD CNC[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 702053077 UWFGETJLMVBOAN-VIFPVBQESA-N 267.289 -0.141 5 20 CBBD CC(C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 737595678 KDOJNWVVMBLCJN-UHFFFAOYSA-N 257.206 -0.834 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NCCn1cnnn1 807920567 UALKVJGGYCOHAP-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD O=CN1CCCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1 816270402 FHLJMQCLIIUPCL-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD CCNC(=O)N1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839704567 YQZPSOGQAMXONG-IWSPIJDZSA-N 270.289 -0.428 5 20 CBBD C/C=C(/C)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991278450 HRWJMSGCWNNJAX-DKBAEGMRSA-N 267.285 -0.055 5 20 CBBD O=C(CC1CC1)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1041121677 MMIKHNROAYPLOZ-NXEZZACHSA-N 297.311 -0.859 5 20 CBBD CN[C@@H](C)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1326276813 YLSQOLLUSNOYHD-VIFPVBQESA-N 282.300 -0.129 5 20 CBBD Cn1cc(CCn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)nn1 1592573845 VYKPBLIFIKWTKO-UHFFFAOYSA-N 290.247 -0.657 5 20 CBBD NC(=O)NC(=O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O 4412118 DXOCRNZMAPNSCZ-UHFFFAOYSA-N 291.223 -0.500 5 20 CBBD Cc1ccc([N+](=O)[O-])c(=O)n1CC(=O)N1CCOCC1 96552965 JYTPGZYLXIBNEH-UHFFFAOYSA-N 281.268 -0.076 5 20 CBBD CN1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 265633403 FXBUALFVJAMJBP-JTQLQIEISA-N 295.299 -0.130 5 20 CBBD O=C(O)[C@@H]1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)O1 276183039 SNZBELCYHVOEQZ-IUCAKERBSA-N 298.255 -0.460 5 20 CBBD COCC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 343945601 LKMKTISRBCZRMN-SECBINFHSA-N 299.283 -0.730 5 20 CBBD CC(C)(CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 348460136 NPZRWKVEHKCCEJ-UHFFFAOYSA-N 296.283 -0.473 5 20 CBBD Nc1nc(N[C@@H]2CC[S@](=O)C2)ncc1[N+](=O)[O-] 348745932 XFYAVAKXWFAHFC-WXQGDBPDSA-N 257.275 -0.100 5 20 CBBD CN(C)C1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 351711249 YSMAZIJHYFNPEE-UHFFFAOYSA-N 265.273 -0.042 5 20 CBBD COC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 359790539 MRNZBFJNZKSDJT-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD CN1CCO[C@@H]2CN(Cc3c([N+](=O)[O-])ncn3C)C[C@@H]21 377666089 IMASQZGHHWAXJK-GXSJLCMTSA-N 281.316 -0.157 5 20 CBBD Cc1nn(C)c(C(=O)OC[C@H]2CNC(=O)O2)c1[N+](=O)[O-] 495717266 NSEIDHLRKKLPFG-ZCFIWIBFSA-N 284.228 -0.098 5 20 CBBD N[C@@H]1C[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN2C1=O 571702585 NMXGHLKRVDNQGH-MWLCHTKSSA-N 294.315 -0.965 5 20 CBBD CO[C@H]1C[C@H](C(=O)O)N(CCn2cc([N+](=O)[O-])cn2)C1 574697360 RACPAJKPNWTRFX-VHSXEESVSA-N 284.272 -0.035 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@H](C)N1 579714780 VUXLCPBWDDVANW-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC[C@@H](O)CO)cc21 588002337 SLFLFPMCIPMEJG-SSDOTTSWSA-N 296.283 -0.450 5 20 CBBD COCCNC(=O)CNc1ccnc(O)c1[N+](=O)[O-] 596062316 WLUDZOFVRJXVKT-UHFFFAOYSA-N 270.245 -0.130 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H](O)[C@@H](O)C1 600216734 DCMNVKRAGGKKMK-UWVGGRQHSA-N 268.225 -0.522 5 20 CBBD CN1CC[C@H](N(C)Cn2cc([N+](=O)[O-])cn2)C1=O 738264880 FHHRWIBLXZXQAZ-VIFPVBQESA-N 253.262 -0.089 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC[S@](=O)CC(=O)N(C)C 871610028 HHMGPHCITZZNFT-IBGZPJMESA-N 288.329 -0.063 5 20 CBBD O=[N+]([O-])c1nccn1CCN1CCCS1(=O)=O 918368806 NGLIXHKWFHQRPH-UHFFFAOYSA-N 260.275 -0.173 5 20 CBBD CN(CCNS(C)(=O)=O)c1ccnc(O)c1[N+](=O)[O-] 1328008877 GHRMIRJVRDXGOR-UHFFFAOYSA-N 290.301 -0.319 5 20 CBBD CC(C)(CCCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1331949054 IKNVQVDEHZLOMF-UHFFFAOYSA-N 270.293 -0.180 5 20 CBBD C[C@](O)(CO)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1589992890 DOFAXBUULGWVIV-SNVBAGLBSA-N 295.259 -0.675 5 20 CBBD Cc1nc(N2C[C@H](O)C[C@@H]2C(=O)O)ncc1[N+](=O)[O-] 1600710439 BDKHXNYIIGGFPX-RNFRBKRXSA-N 268.229 -0.283 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 110665167 SSLJDNBVILYRQT-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD CC[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 344383478 MMSPWLQSGNKQGH-SECBINFHSA-N 269.257 -0.356 5 20 CBBD COC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)OC 351791449 YXICTUREVUMDMA-QMMMGPOBSA-N 286.244 -0.905 5 20 CBBD C[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)c1nc[nH]n1 353804423 ZHKKNGBZAGMPNG-ZETCQYMHSA-N 294.275 -0.030 5 20 CBBD CCOC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360644477 AJTBKGFHSGLPEM-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD O=C(CCN1CCOC1=O)NCCn1cc([N+](=O)[O-])cn1 493852456 LKPWOUBJHIMJIV-UHFFFAOYSA-N 297.271 -0.250 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@@H]1CNC(=O)O1 495656581 XJIIEBOVGKVDDR-QMMMGPOBSA-N 284.228 -0.167 5 20 CBBD CN(Cc1nnnn1C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 568661113 GLTNCPZRPYTYPP-UHFFFAOYSA-N 292.259 -0.632 5 20 CBBD NS(=O)(=O)c1ccc(OCC2CNC2)c([N+](=O)[O-])c1 592158496 IDMUKJOQPVLSNQ-UHFFFAOYSA-N 287.297 -0.160 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1[C@H]2CNC[C@H]21 592565148 UQYNTUNCHUUGKU-MYJAWHEDSA-N 265.273 -0.627 5 20 CBBD CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 598293828 LLQCFUJOQKBYLD-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD O=C1NC[C@H]2CN(c3sccc3[N+](=O)[O-])CCN2C1=O 611290201 XRXNCXRJZNOIAX-ZETCQYMHSA-N 296.308 -0.197 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1ccnn1 782490828 BHFAKENYHHVMNR-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD CC(C)[C@@H](O)COC(=O)Cn1cnc([N+](=O)[O-])n1 849705000 RNXVEKAJXYYINC-ZETCQYMHSA-N 258.234 -0.254 5 20 CBBD CCn1ncn(NC(=O)c2c([N+](=O)[O-])cnn2C)c1=O 854629413 WTINYSZAGWQCMK-UHFFFAOYSA-N 281.232 -0.910 5 20 CBBD Cc1ccnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030292311 CGWZQUBLKHRTBD-GHMZBOCLSA-N 291.311 -0.249 5 20 CBBD NC(=O)c1ccnc(N2CC[C@](F)(CO)C2)c1[N+](=O)[O-] 1117647623 JFLKTAVIZAIUOO-LLVKDONJSA-N 284.247 -0.001 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CO)CCF 1118271395 NHJAFLBVPRSGRB-ZCFIWIBFSA-N 261.213 -0.977 5 20 CBBD CC(=O)NCCCNCc1c([N+](=O)[O-])ncn1C 1154037372 ZNSHYFIXAPNAMI-UHFFFAOYSA-N 255.278 -0.056 5 20 CBBD Nc1nc(N2C[C@@H](CO)[C@H](CO)C2)ncc1[N+](=O)[O-] 1261791082 FDWYDFXCERUXJO-BQBZGAKWSA-N 269.261 -0.996 5 20 CBBD COCC(=O)NCCC(=O)NCCn1cc([N+](=O)[O-])cn1 1324094460 UACAKOFACWNHJM-UHFFFAOYSA-N 299.287 -0.940 5 20 CBBD CCN(C(=O)Cn1cnc([N+](=O)[O-])n1)c1cnn(C)c1 1329925778 VIGJAOCHGWKTAR-UHFFFAOYSA-N 279.260 -0.027 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H](N)C1CC1 1349156046 OUIMJPAGRYBDBG-SSDOTTSWSA-N 253.262 -0.205 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1cc2c(c([N+](=O)[O-])c1)OCO2 1601419262 ITVSAQNREWZWIL-ZCFIWIBFSA-N 298.207 -0.501 5 20 CBBD Nc1cc(NCCO)cc(-c2nn[nH]n2)c1[N+](=O)[O-] 1609511057 VMKVSYFYQZDJTJ-UHFFFAOYSA-N 265.233 -0.239 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)COc1ccc([N+](=O)[O-])cc1 35161167 DRPCVNBUDSDOPD-SNVBAGLBSA-N 298.251 -0.376 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)N(CCO)CCO 40431378 PVWUQTNZPUJCQJ-UHFFFAOYSA-N 290.297 -0.430 5 20 CBBD O=C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1 59883091 PGURLDODZDRSGK-UHFFFAOYSA-N 252.230 -0.115 5 20 CBBD CN1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 122175538 KAQPULLOJMTLKN-SECBINFHSA-N 295.299 -0.224 5 20 CBBD Cc1ccn(CC(=O)N2CCNC2=O)c(=O)c1[N+](=O)[O-] 130022059 VCRXFAZHYZDWSE-UHFFFAOYSA-N 280.240 -0.383 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1CCn1ccc([N+](=O)[O-])n1 189565150 CLINGQDELMIGSP-ONGXEEELSA-N 298.299 -0.210 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(N)=O 228509101 JRXCNANPERGSRV-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD NC(=O)[C@@H](O)CNc1ncnc2ccc([N+](=O)[O-])cc12 228604080 GLLJYWBBBGSTSA-VIFPVBQESA-N 277.240 -0.204 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)O1 268430549 ZBYIVYYKXDPQFA-POYBYMJQSA-N 282.256 -0.314 5 20 CBBD Cc1cc(C(=O)N(CC(N)=O)CC(N)=O)ccc1[N+](=O)[O-] 340671596 CSEKCIVMENXKKK-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)N2CCC2)c1 358371095 FDXLDWZLOWAJAH-UHFFFAOYSA-N 295.251 -0.225 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 425077951 VGTQKABASGPZSK-YFKPBYRVSA-N 281.228 -0.805 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1CCCNC1 428628351 UHQMYKIEACZXKZ-SNVBAGLBSA-N 294.311 -0.128 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 444313255 GZDFPFCYAHXPCU-NKWVEPMBSA-N 284.272 -0.552 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC(=O)NC1CC1 514941773 YZUAVTDJETZUDK-UHFFFAOYSA-N 266.257 -0.058 5 20 CBBD CNc1nccc(C(=O)NCCOCCOC)c1[N+](=O)[O-] 553052755 ZSBFCGUTMHGGAP-UHFFFAOYSA-N 298.299 0.424 5 20 CBBD CC(C)NCC(=O)NCCn1cc([N+](=O)[O-])cn1 573267315 FCHLPILOPJTJBF-UHFFFAOYSA-N 255.278 -0.095 5 20 CBBD NC(=O)c1cc(N[C@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 596184686 UALOUKZNEVRXMA-SSDOTTSWSA-N 264.241 -0.006 5 20 CBBD COc1ccc(CC(=O)NCc2nn[nH]n2)cc1[N+](=O)[O-] 609532895 SGNVFVVHDYHFLN-UHFFFAOYSA-N 292.255 -0.025 5 20 CBBD O=C(NC1CN(C(=O)c2cncnc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282093 WCADSMAXBXERKH-NXEZZACHSA-N 291.267 -0.918 5 20 CBBD COCCOCCNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936289 FKYGDBDIWIULKZ-NXEZZACHSA-N 275.305 -0.980 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 1320490565 MMRYEKNBILOILR-LURJTMIESA-N 267.245 -0.413 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1c[nH]nc1[N+](=O)[O-] 1340015688 FBYNRPMZSNOYTI-BDAKNGLRSA-N 295.299 -0.089 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC1)CNCCO2 1580807266 QTPCFNAHVDIJBN-NXEZZACHSA-N 269.301 -0.367 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H](O)CC(=O)O)c1[N+](=O)[O-] 1600768241 MQMYRFGBNAMZAQ-LURJTMIESA-N 286.244 -0.798 5 20 CBBD O=C(N[C@H](CCF)C(=O)O)c1c[nH]nc1[N+](=O)[O-] 1601415530 YYUBGWKPMXCEIM-RXMQYKEDSA-N 260.181 -0.140 5 20 CBBD O=C(O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610764409 JEKFAWUTTVNQHK-XLPZGREQSA-N 258.230 -0.646 5 20 CBBD COc1ccc(NC(=O)CN(C)CC(N)=O)c([N+](=O)[O-])c1 47629383 SPJXRNJRINADEN-UHFFFAOYSA-N 296.283 -0.041 5 20 CBBD CNC(=O)c1ccc(N2CCNC(=O)C2)c([N+](=O)[O-])c1 48892893 BUYVOQNTVGYNDH-UHFFFAOYSA-N 278.268 -0.109 5 20 CBBD NS(=O)(=O)CCNc1ncc([N+](=O)[O-])s1 189682353 ZWQOTZRSHJYFFJ-UHFFFAOYSA-N 252.277 -0.248 5 20 CBBD CC(=O)NC1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 190508680 LZYMIJOWBUBXCY-UHFFFAOYSA-N 281.272 -0.553 5 20 CBBD COC(=O)[C@H](O)CNC(=O)COc1ccccc1[N+](=O)[O-] 227050891 LXGNDXOZKDDKJC-SECBINFHSA-N 298.251 -0.376 5 20 CBBD O=C1CN(CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1 272801931 UXHMHMSWSKPLCG-UHFFFAOYSA-N 281.272 -0.916 5 20 CBBD C[C@]1(C(N)=O)CCN(CCn2ccc([N+](=O)[O-])n2)C1 280820584 USWZXVQKSIMFDJ-NSHDSACASA-N 267.289 -0.011 5 20 CBBD CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@H]1COC[C@H]1O 343618335 FIXIXESSEPRKPS-JGVFFNPUSA-N 279.256 -0.167 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 362405570 XQCIVVCEHNMKOM-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCc1nc(=O)o[nH]1 392143108 GDUKYPIZINMJEJ-UHFFFAOYSA-N 294.227 -0.779 5 20 CBBD CN(CCN=c1nc(N)c([N+](=O)[O-])c[nH]1)CC(F)F 599202542 MLPIWIPXCNVBPV-UHFFFAOYSA-N 276.247 -0.002 5 20 CBBD CC[C@@H](OC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 727002750 UAFGNYYFAUDJJF-SSDOTTSWSA-N 270.245 -0.093 5 20 CBBD CCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])cnc1O 763804192 AIUNAAOKDDKLSB-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD COC[C@H](O)C(=O)OCCn1ccc([N+](=O)[O-])n1 766142231 XBYDBYXKLWFAHH-ZETCQYMHSA-N 259.218 -0.658 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)O[C@H]1CCNC1=O 769992252 BJCNMDYGATUSMV-LURJTMIESA-N 254.202 -0.777 5 20 CBBD COc1ccc(CC(=O)NOCC(N)=O)cc1[N+](=O)[O-] 772940848 WYIAEHVPFFHJCB-UHFFFAOYSA-N 283.240 -0.321 5 20 CBBD COC(=O)[C@@H]1CN(C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 840500431 WPEFRENJGYISBS-OPRDCNLKSA-N 285.300 -0.785 5 20 CBBD O=C(O)Cc1ccc(N2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 844210880 NOYPQLZVKIBLKR-PHIMTYICSA-N 282.252 -0.236 5 20 CBBD CS(=O)(=O)N1CCC[C@H](NCC[N+](=O)[O-])C1 905062641 YINYPVHKZJTRLR-QMMMGPOBSA-N 251.308 -0.723 5 20 CBBD NC(=O)NCCC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093623364 JWSLIAHFMNKBLG-UHFFFAOYSA-N 296.287 -0.424 5 20 CBBD CCN(CCNC(C)=O)c1ncc([N+](=O)[O-])c(N)n1 1100446456 IKEQBOHIIZBASE-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1116496934 ZCIPQVHRJJKMKJ-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)c1nncn1C 1320759611 BXSYOESBOSLHMX-QMMMGPOBSA-N 293.287 -0.160 5 20 CBBD Cc1c(C(=O)OCCn2cnc([N+](=O)[O-])n2)nnn1C 1524688783 JVAZAWPHYTWIJJ-UHFFFAOYSA-N 281.232 -0.520 5 20 CBBD C[C@@H](C(N)=O)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589033242 BCRLPBCNSHZBRJ-VKHMYHEASA-N 252.194 -0.982 5 20 CBBD O=C1OCC[C@@H]1Nc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1593422493 KGMNMODRZIMWMB-ZETCQYMHSA-N 291.227 -0.103 5 20 CBBD O=C(N[C@H](C(=O)O)C1CC1)c1c[nH]nc1[N+](=O)[O-] 1601393652 ZHUGYLQCKUXXEX-LURJTMIESA-N 254.202 -0.089 5 20 CBBD CC1(C(N)=O)CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C1 1604505671 GAMJIOMRZGSEFU-UHFFFAOYSA-N 280.240 0.000 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1 35160336 KIECQTGKPXDTQJ-VIFPVBQESA-N 268.225 -0.142 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)c1n[nH]c(=O)[nH]1 49401806 NXJGVAKCMDMUCH-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD CCNS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 178923198 MPQDSXPUOBKNAZ-UHFFFAOYSA-N 263.279 -0.765 5 20 CBBD CC(C)N1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 265661261 QZRSGTKEQHJNEU-VIFPVBQESA-N 295.299 -0.083 5 20 CBBD NC(=O)[C@@]1(O)CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 276563209 ZYYDVMZWGHTQPV-LLVKDONJSA-N 296.239 -0.071 5 20 CBBD CNC(=O)C1CN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C1 276827476 URRUDCIXLPIBAA-UHFFFAOYSA-N 294.267 -0.041 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@]1(CCO)CCOC1 278111575 PMAFXIXTHOZHNH-LBPRGKRZSA-N 298.299 -0.161 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC(=O)N(C2CC2)C1 279702368 WIJUMOZWHHNRSW-UHFFFAOYSA-N 265.229 -0.278 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1COC[C@@H]1O 342456602 NTFISLIVDXPFPQ-BDAKNGLRSA-N 269.257 -0.235 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC(F)C1 345568767 LEQJXHDAMMKROR-UHFFFAOYSA-N 255.205 -0.063 5 20 CBBD COC(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 347012032 LQGZCXUTIOUCCS-UHFFFAOYSA-N 256.218 -0.427 5 20 CBBD CN1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 353560506 IEJQGRXKCHZUCV-LURJTMIESA-N 267.245 -0.332 5 20 CBBD N=c1ccc(CN=c2[nH]cc([N+](=O)[O-])c(=N)[nH]2)c[nH]1 357844384 SOENVELDUVWKIA-UHFFFAOYSA-N 261.245 -0.361 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1 358061448 GIWFHEIXJADGGN-ZDUSSCGKSA-N 294.311 -0.027 5 20 CBBD C[C@@H]1OC(=O)N[C@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 496506814 HIUXNNAXBBHXQG-POYBYMJQSA-N 284.228 -0.169 5 20 CBBD CN(Cc1nnnn1C)c1nc(C(=O)O)ccc1[N+](=O)[O-] 567979662 WKPBQGBHXLENMV-UHFFFAOYSA-N 293.243 -0.152 5 20 CBBD CO[C@@H]1COC[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 575864456 LAPITPBIJADEPW-HTQZYQBOSA-N 279.256 0.463 5 20 CBBD NC(=O)C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 588855908 REWLTSJYZWOHFY-ZCFIWIBFSA-N 266.261 -0.331 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1 590552130 YTOLBHILIUKQBV-UHFFFAOYSA-N 292.255 -0.027 5 20 CBBD COC[C@H]1C[C@@H](O)CN1c1c([N+](=O)[O-])ncn1C 593497345 BLXSXVHGKMXPRE-HTQZYQBOSA-N 256.262 -0.086 5 20 CBBD COC(=O)c1ccnc(N2C[C@@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 598629050 BFRNTEONNGPMEN-IONNQARKSA-N 297.267 -0.434 5 20 CBBD CN(C[C@H]1C[C@@H](O)C1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 600611132 MHWDOOFRYNLHBV-JGZJWPJOSA-N 295.295 -0.014 5 20 CBBD CC1=NNC(=O)[C@@H]1CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 609620275 DTJPPKRXCSELSF-ZCFIWIBFSA-N 279.260 -0.687 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CNC[C@@H]1O 700956969 NCVFKUGRXHISHG-ZJUUUORDSA-N 281.268 -0.334 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3C[C@@]3(CO)C2)c1 782616049 LRGCNRLVKUOYHX-WCQGTBRESA-N 282.300 -0.534 5 20 CBBD Cn1nccc1C(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 848703905 SWEZSSGHKIFNLF-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD Cc1conc1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 999654718 PWXUBUQBCNXKHH-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCNC(=O)C(N)=O 1094079707 XPMHLNXSCDQGSR-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1116431907 NHJJOXJPQUOYLW-UHFFFAOYSA-N 269.261 -0.512 5 20 CBBD NC(=O)CN1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C1 1318463212 YMOLDHXHMCHLNY-QMMMGPOBSA-N 296.283 -0.133 5 20 CBBD C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])N1CCN(C)CC1 1319607629 OBSYNNDBDWQRTL-SECBINFHSA-N 296.331 -0.316 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NC[C@]2(C)CNCCO2)n1 1579970345 VABCRCIRULARDE-NSHDSACASA-N 283.288 -0.563 5 20 CBBD O=C(O)[C@H]1CNCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 1601850290 LGYAPGXHDKBURI-SECBINFHSA-N 297.271 -0.934 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@H](CO)C1 51885267 CLFOHKKSQGARDR-QMMMGPOBSA-N 254.246 -0.368 5 20 CBBD O=c1c([N+](=O)[O-])cc(Br)cn1C[C@@H](O)CO 122307494 MYCWPDJZSKZWIT-ZCFIWIBFSA-N 293.073 -0.128 5 20 CBBD CN1CCO[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]21 152194749 JUBWXJJLLBWRPD-UWVGGRQHSA-N 295.299 -0.667 5 20 CBBD CN(CCO)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O 272873778 DRVRLIKROSLPCN-UHFFFAOYSA-N 275.286 -0.329 5 20 CBBD COC(=O)c1cnc(N2C[C@@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 277519034 UYWKJUZVRSSMCP-RKDXNWHRSA-N 283.240 -0.682 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 330860710 PMYOUVKALARDGZ-ZETCQYMHSA-N 252.230 -0.117 5 20 CBBD COCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])nn1C 343932795 AZXLJHIKVCXTNH-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 348504212 DKYLIXGJADOTIC-LURJTMIESA-N 267.245 -0.345 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 351825061 GEPLPEUTNHKZGH-DVVUODLYSA-N 270.289 -0.535 5 20 CBBD O=C1NC(=O)N2CCN(CCn3ccc([N+](=O)[O-])n3)C[C@H]12 352772467 QSFGTDCFADVIIB-MRVPVSSYSA-N 294.271 -0.973 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](CO)O1 355077721 ZLWHMEMKCGGGQY-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD C[C@H](CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 362355478 XHFLFYAGUWSIPX-ZCFIWIBFSA-N 255.234 -0.829 5 20 CBBD O=C(CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)NCC1CC1 393084276 TZTOKIFCRLFFDM-LLVKDONJSA-N 297.315 -0.732 5 20 CBBD Nc1nc(N2CCO[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 572845134 DSJPDFHEMWJKMI-ZCFIWIBFSA-N 269.217 -0.743 5 20 CBBD C[C@H](C(=O)O)N(C)S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600653668 MCRZVOKDFOARHS-RXMQYKEDSA-N 292.273 -0.578 5 20 CBBD O=C(CN1C(=O)CCC1=O)OCCn1ccc([N+](=O)[O-])n1 748103147 TUSMETQPVWCHAT-UHFFFAOYSA-N 296.239 -0.517 5 20 CBBD C[C@]1(C(N)=O)CCN(Cn2cc([N+](=O)[O-])cn2)C1 794702927 GLQSQUBOFIXLLN-JTQLQIEISA-N 253.262 -0.054 5 20 CBBD Cn1ncc(COC(=O)Cn2ccc([N+](=O)[O-])n2)n1 802981873 CGPGBLBVLRIHLN-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD CCn1ncn(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1=O 820387900 GDYISCQGFGYWQU-UHFFFAOYSA-N 295.259 -0.752 5 20 CBBD CON1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 846977060 OOMXGAZSSGXNHM-LLVKDONJSA-N 285.304 -0.669 5 20 CBBD O=C(OCCC[N+](=O)[O-])c1ccn2nnnc2c1 860922628 WCSBJAAUIHRMOD-UHFFFAOYSA-N 251.202 -0.052 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cocn1 990466792 AQIGOOWBGJAAAJ-VXNVDRBHSA-N 280.240 -0.720 5 20 CBBD COCC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062989395 BXZJZNAMNYYLFI-RKDXNWHRSA-N 285.300 -0.547 5 20 CBBD CN(CCNc1ncccc1[N+](=O)[O-])C(=O)CNC(N)=O 1101484574 ZUBJQFLJJXQKBC-UHFFFAOYSA-N 296.287 -0.472 5 20 CBBD CC(C)(CS(C)(=O)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1325269328 VNRHLOSVUQZHLD-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD CC[C@@H]1C[C@H]1NC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1327321156 HTBIENIXJRBWOI-PSASIEDQSA-N 295.299 -0.178 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@](F)(CO)C1 1340086265 JPKTUMKYYAWEBH-VIFPVBQESA-N 258.209 -0.136 5 20 CBBD O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@@H](O)CO 1582803918 CLABNDYHSAQHCB-ZCFIWIBFSA-N 280.244 -0.460 5 20 CBBD CO[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@](C)(C(=O)O)C1 1599135649 VRSACDWKQKNKTQ-KCGFPETGSA-N 272.257 -0.258 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1cc[nH]n1 48349113 YUKAAEGZPUXZQG-UHFFFAOYSA-N 250.218 -0.169 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H]2CO)c1 266561544 XSIBUVVPAZYNGT-ONGXEEELSA-N 270.289 -0.391 5 20 CBBD COC[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)OC 272636751 BYMHMWPZIIZKGG-VIFPVBQESA-N 272.261 -0.431 5 20 CBBD O=[N+]([O-])c1cnc(NCCN2CCCS2(=O)=O)nc1 273161452 KOIOZNSEDQVBKR-UHFFFAOYSA-N 287.301 -0.168 5 20 CBBD C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@H](O)C1 278864010 SEVOKZFEEVOTGL-KPXOXKRLSA-N 295.295 -0.041 5 20 CBBD O=C(N[C@H]1CCCN(CCCO)C1)c1cc([N+](=O)[O-])[nH]n1 295492130 OQJLZTJYLVXWJY-VIFPVBQESA-N 297.315 -0.106 5 20 CBBD NC(=O)NC(=O)CCCn1cccc([N+](=O)[O-])c1=O 339994796 MRIYFYSNEWIGDZ-UHFFFAOYSA-N 268.229 -0.268 5 20 CBBD CCc1[nH]nc(C(=O)NCCn2cncn2)c1[N+](=O)[O-] 345642037 WWPSMAIGQPIBRO-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)CC1=O 356483035 QYPSUTXSIMACPN-LURJTMIESA-N 267.245 -0.711 5 20 CBBD C[S@](=O)C1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 442925058 QOACWSRLUYNYLH-IBGZPJMESA-N 286.313 -0.181 5 20 CBBD CNC(=O)OCCOC(=O)Cn1ccc([N+](=O)[O-])n1 496657674 BYDNVNYABLKYJP-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD CN1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)C(=O)N1 558350840 NONFCODNFWKCMR-SECBINFHSA-N 264.241 -0.330 5 20 CBBD CO[C@@H](CN)C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 569601211 VXEAAIAJDLJEOB-VIFPVBQESA-N 279.256 0.383 5 20 CBBD CNc1nccc(C(=O)N(C)CC(=O)OC)c1[N+](=O)[O-] 581437176 CUPUCQUJOFTFGM-UHFFFAOYSA-N 282.256 0.277 5 20 CBBD C[C@@H](CCO)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 593879684 JJPJFMDWWBFQHI-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1N 595229097 QUJFOGSPCFNJOX-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN(C)C(=O)C1 602781575 TXJGNVPKVZQMPU-UHFFFAOYSA-N 267.289 -0.126 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CCNC1=O 769999492 YSCILGXLGLRPLR-QMMMGPOBSA-N 282.256 -0.078 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 770228637 BBHCSEBUYMDAMD-UHFFFAOYSA-N 289.269 -0.530 5 20 CBBD Cn1nnc(C(=O)NCCNc2ncccc2[N+](=O)[O-])n1 1094043337 YZRYPYBHYFGACE-UHFFFAOYSA-N 292.259 -0.645 5 20 CBBD O=C(Cc1ncc[nH]1)NCCn1cc([N+](=O)[O-])cn1 1261731143 PHQSTMLARKRSAA-UHFFFAOYSA-N 264.245 -0.127 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCNCC1 1329272923 MHIYMXKVBXDBQH-UHFFFAOYSA-N 266.257 -0.812 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(C(=O)O)CC1 1329495041 IPDFADNYIPCVMX-UHFFFAOYSA-N 268.229 -0.077 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)c1cc[n+]([O-])cc1 1344616182 FKSXFPVRPIOHMM-UHFFFAOYSA-N 279.212 -0.323 5 20 CBBD CC(C)C[C@H](NC(=O)Cn1ncc([N+](=O)[O-])n1)C(=O)O 1591179082 ZEQVORCLRXXAOF-ZETCQYMHSA-N 285.260 -0.198 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)Cn1cc(C(=O)O)cn1 1592831560 DFQZZLIFWKMPOU-ZCFIWIBFSA-N 257.202 -0.210 5 20 CBBD O=C(O)[C@@H](O)C1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1601684676 GNQXFEJHYIKYMY-QMMMGPOBSA-N 298.255 -0.384 5 20 CBBD CN(CC(=O)O)c1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 37115750 LOTFNRYMZNDYMZ-UHFFFAOYSA-N 289.269 -0.237 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ncn[nH]1 49447969 IASWJWQZXXCNBD-UHFFFAOYSA-N 251.206 -0.143 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](O)C(N)=O)c1 227830713 OMFCDSZCEBVXLS-SECBINFHSA-N 283.240 -0.361 5 20 CBBD CC(C)(NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230869693 IWKJLXUCOWTLBZ-UHFFFAOYSA-N 267.245 -0.434 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@@H](O)C1 234882959 OCDDWSKMKNQIFO-UWVGGRQHSA-N 282.252 -0.219 5 20 CBBD Cc1cc(=O)n(Cc2nnnn2C)cc1[N+](=O)[O-] 331007096 CFFVAMYMQXZNML-UHFFFAOYSA-N 250.218 -0.363 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1C=C[C@H](CO)C1 341729725 HALIMWFYWYQZFB-IUCAKERBSA-N 266.257 -0.156 5 20 CBBD CC(C)(C(=O)NCc1nc(O)n[nH]1)n1cc([N+](=O)[O-])cn1 443523824 QVHZMESITXYBCF-UHFFFAOYSA-N 295.259 -0.334 5 20 CBBD O=C(NCc1nc[nH]n1)c1cnc(O)c([N+](=O)[O-])c1 445176954 HPXCTDFKBLBVQQ-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN3C(=O)OC[C@@H]3C2)c1[N+](=O)[O-] 493445074 QDXPZFPGMPGZEJ-ZETCQYMHSA-N 295.255 -0.097 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC(N2CC[C@@H](O)C2)C1 593507881 OTXNQBXZKRRUOL-SECBINFHSA-N 267.289 -0.417 5 20 CBBD NCCN(Cc1ccc([N+](=O)[O-])cc1F)C[C@@H](O)CO 595901709 IBIBJUOKSOSAPE-LLVKDONJSA-N 287.291 -0.152 5 20 CBBD CN1CC[C@@H](Cn2cc([N+](=O)[O-])c(C(=O)O)n2)C1=O 692727683 HNSBMABCMKHDRJ-LURJTMIESA-N 268.229 -0.032 5 20 CBBD CC(C)COC[C@@H](O)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839696590 NYQHVNFNRRSODC-IVZWLZJFSA-N 260.290 -0.199 5 20 CBBD CCON(C)C(=O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 845717377 NMTGHIISTLVAJB-UHFFFAOYSA-N 297.271 -0.090 5 20 CBBD O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)NOCCO 857715278 CFIYKSOURWLBAR-UHFFFAOYSA-N 298.255 -0.244 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2ccnn2C)C1 1042705797 YRCXGQQJCGTUDU-VXGBXAGGSA-N 293.327 -0.272 5 20 CBBD CN(C)C[C@H](O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 1117684148 FXQPCWKXOZFWRL-SSDOTTSWSA-N 283.288 -0.577 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H](N2CC[C@@H](O)C2)C1 1261818838 JDFYHPIHNGKGGK-DTWKUNHWSA-N 295.299 -0.401 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](C)C(=O)N(C)C)c1[N+](=O)[O-] 1321192858 LPXDNZMTJICBRU-ZETCQYMHSA-N 283.288 -0.157 5 20 CBBD C[C@@H](CS(C)(=O)=O)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1324864018 BGKIHEVXDLAZDU-LURJTMIESA-N 290.301 -0.177 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@]1(O)CCNC1 1580562317 OWBIVVIAVSYJDR-ZDUSSCGKSA-N 295.295 -0.186 5 20 CBBD O=C(N[C@@H](CF)C(=O)O)c1cc([N+](=O)[O-])cnc1O 1608397849 AXXQDJVPTJPYMU-LURJTMIESA-N 273.176 -0.152 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N 6621422 VHDFELNNKPITGX-UHFFFAOYSA-N 296.239 -0.211 5 20 CBBD NS(=O)(=O)NCCOc1ccc([N+](=O)[O-])cc1 68940339 ODOLCCRGZJYEDU-UHFFFAOYSA-N 261.259 -0.233 5 20 CBBD COC(=O)[C@@H](CNc1c([N+](=O)[O-])ncn1C)OC 292267965 LKJTZVXMFBAPPR-ZCFIWIBFSA-N 258.234 -0.072 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@@H](CCO)C1 330529581 FTGLDNPNDPARRN-JTQLQIEISA-N 295.295 -0.013 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCC(=O)NC1CC1 351675721 WHWTZUYRXLTDJO-UHFFFAOYSA-N 281.272 -0.424 5 20 CBBD NC(=O)[C@H](CO)NC(=O)CCc1cccc([N+](=O)[O-])c1 353005533 RWNYLFDALDIBMT-JTQLQIEISA-N 281.268 -0.510 5 20 CBBD O=C(NCC[C@@]1(O)CCCOC1)c1c[nH]nc1[N+](=O)[O-] 593880015 LZYMLZAEJATJCY-NSHDSACASA-N 284.272 -0.021 5 20 CBBD CCN(CCn1cc([N+](=O)[O-])cn1)CC(=O)NC 746671341 IUEIXPBDKUJSFG-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD CN1C[C@@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CC1=O 748120148 SSLADFQSBAIVJO-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(OC)c1)C(N)=O 760063702 HCIQPLVWMBNXMI-MRVPVSSYSA-N 297.267 -0.167 5 20 CBBD CN(C)C(=O)COC(=O)c1cc([N+](=O)[O-])cnc1N 779102762 BJSUQWDPUWQSGS-UHFFFAOYSA-N 268.229 -0.183 5 20 CBBD CCN(CC)CC(=O)N1CCN(CC[N+](=O)[O-])CC1 791053432 STJNXBKHMQSMEH-UHFFFAOYSA-N 272.349 -0.251 5 20 CBBD O=[N+]([O-])CCN(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 791053743 FVMUVZXCMYPBTJ-QWRGUYRKSA-N 292.357 -0.069 5 20 CBBD C[C@H](O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839662146 VSWPFBLMUNIKSQ-IVZWLZJFSA-N 257.290 -0.823 5 20 CBBD COC[C@@H](CCO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1253647369 YORZOLIERPJTII-MRVPVSSYSA-N 286.288 -0.236 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCN2CCC[C@H]2C1 1317997160 SSIZHSYTGCGMIM-UWVGGRQHSA-N 294.315 -0.071 5 20 CBBD CCOC(=O)[C@H]1CNCCN1CCn1cc([N+](=O)[O-])cn1 1327205286 CGXCJAGOTDXYLY-LLVKDONJSA-N 297.315 -0.372 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 1348511647 SZBDFYRYGHSXPS-QMMMGPOBSA-N 282.304 -0.707 5 20 CBBD O=C(NC[C@H]1CCO[C@H]1C(=O)O)c1cc([N+](=O)[O-])n[nH]1 1601524911 MQGLWXXHLRITOJ-SVGQVSJJSA-N 284.228 -0.463 5 20 CBBD CO[C@@]1(C(=O)O)CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 1606700559 NUNUIMHBQFTMTQ-NSHDSACASA-N 298.255 -0.058 5 20 CBBD O=C(Nc1cccc(-c2nn[nH]n2)n1)[C@@H]1C[C@H]1[N+](=O)[O-] 1609566723 BIOQUQJZILUUBL-IYSWYEEDSA-N 275.228 -0.135 5 20 CBBD NS(=O)(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1 40223356 NIFYMIBGBJCNEK-UHFFFAOYSA-N 273.270 -0.387 5 20 CBBD O=C1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CN1 104088014 NRGSSWAGHIKDLB-ZCFIWIBFSA-N 252.230 -0.069 5 20 CBBD C[C@H](C[S@@](C)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 182786373 KKTFPPCVGQUEPK-LWESTGQBSA-N 274.302 -0.326 5 20 CBBD Cc1[nH]nc(C(=O)N(CC(N)=O)C(C)C)c1[N+](=O)[O-] 264275507 MQPNUBWQQYDERZ-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD NC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)CCN1 265499224 HUDUVNDXAFDERS-QMMMGPOBSA-N 285.691 -0.093 5 20 CBBD CNC(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 267839231 MORACSOKSVLFFM-UHFFFAOYSA-N 282.304 -0.252 5 20 CBBD CCc1nn(C)c(NCC(=O)NCCO)c1[N+](=O)[O-] 288978243 VAPKSYZDMRPELE-UHFFFAOYSA-N 271.277 -0.589 5 20 CBBD O=C(NCCn1ncnn1)c1ccc([N+](=O)[O-])cc1O 436885875 FOAAGVMVXNRJBM-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD C[C@H](O)CN(Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)CO 443343116 GAFQRMPZXFSYJR-IUCAKERBSA-N 272.305 -0.108 5 20 CBBD COC(=O)[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C1CC1 548955383 FFEZNAWLJIUAJB-ZETCQYMHSA-N 268.229 -0.001 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)ccc1NC(CO)CO 738357123 BZVMEFVAUGDIKK-UHFFFAOYSA-N 280.244 -0.460 5 20 CBBD NC(=O)CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N 791311725 JCUUSSFQBRVUTF-UHFFFAOYSA-N 256.193 -0.469 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN([C@@H]2CCC[C@H]2O)CC1 839666823 UHYLEGFYOBBUKV-DDHJBXDOSA-N 283.328 -0.291 5 20 CBBD CN(CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])S(C)(=O)=O 855167900 STAHFFKHIGXVJM-HTQZYQBOSA-N 279.318 -0.951 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C2 861871363 LMRPINZQKCFBJK-DTWKUNHWSA-N 293.235 -0.717 5 20 CBBD CN(Cc1nncn1C)C(=O)c1cc([N+](=O)[O-])n[nH]1 1324103305 OQLQDMYDCLXQAT-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD CNC(=O)Cc1noc(Cn2ccc([N+](=O)[O-])n2)n1 1332760142 HYXPCRAHLZCDPA-UHFFFAOYSA-N 266.217 -0.489 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCO[C@H]1C(=O)O 1601029110 VEDFQRDPCAFKKQ-YLWLKBPMSA-N 284.228 -0.700 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NC(N)=O 3520645 QTBTYPKRONMNSB-SCSAIBSYSA-N 271.185 -0.072 5 20 CBBD CNC(=O)CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 27231217 DLXOUXUBFLQNNF-UHFFFAOYSA-N 279.300 -0.142 5 20 CBBD COC[C@@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 37875210 MKGNXYGJCLIBFP-SCZZXKLOSA-N 258.278 -0.223 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 42319432 OGWDLJCSFURZRV-YFKPBYRVSA-N 269.213 -0.426 5 20 CBBD O=C(O)[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 49871663 NAWIOSTVXOMXJC-ZETCQYMHSA-N 254.202 -0.325 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 74122315 LJFBTUVLTQOEEU-VIFPVBQESA-N 281.272 -0.342 5 20 CBBD CN(CC(=O)N1CCOCC1)c1ncc([N+](=O)[O-])cn1 273565843 CLPPMYZELUZYFW-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD Cc1nn(C)c(N2CCC(O)(CO)CC2)c1[N+](=O)[O-] 313637093 LJUBXWSZFATSHK-UHFFFAOYSA-N 270.289 -0.040 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 330627724 XRAVNQGMDZGYOX-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD CCN1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 332707643 YKLDLMFHFDQJDS-UHFFFAOYSA-N 267.245 -0.410 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CCNC1=O 340453183 BYCBRBKSARUSTB-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD Nc1nc(NCc2nnc3n2CCC3)ncc1[N+](=O)[O-] 341813905 LEXDSHRVPCXMGV-UHFFFAOYSA-N 276.260 0.117 5 20 CBBD CN(C)C1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 345308960 UXHXIJSEZHSDGL-UHFFFAOYSA-N 280.284 -0.471 5 20 CBBD CN(C)C(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 351704055 VNZONTQBRPIQEW-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD CN(CC(N)=O)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-] 360946998 QQQYWJXYOAIRGB-UHFFFAOYSA-N 293.326 -0.019 5 20 CBBD COC(=O)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 534509391 ISXYYDJTYXYSEO-UHFFFAOYSA-N 289.269 -0.217 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H]1O 556976985 FUIZEJLHFCVTPU-UWVGGRQHSA-N 282.300 -0.320 5 20 CBBD COCCNCCNC(=O)c1cc([N+](=O)[O-])cnc1O 571880954 RLMHDKPVICHTSZ-UHFFFAOYSA-N 284.272 -0.339 5 20 CBBD Nc1nc(N2CC[C@H]3NC(=O)CC[C@@H]3C2)ncc1[N+](=O)[O-] 596458332 HOZMAICKOZSEPK-HTQZYQBOSA-N 292.299 0.072 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@]1(C)CO 598447094 HBFDLBBVTYEXCO-LDYMZIIASA-N 283.288 -0.337 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)Nn1c(O)nnc1O 816732324 BQWIYXHPZWOSIJ-UHFFFAOYSA-N 295.211 -0.010 5 20 CBBD CC(C)N(CCS(C)(=O)=O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840405093 YAQRXKFFIHPSSD-RKDXNWHRSA-N 278.330 -0.067 5 20 CBBD C[C@@H](C[S@](C)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116837465 HFDGLPKJYYKLLP-AAODDVHNSA-N 260.275 -0.185 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@H]([C@H](C)N)C2)c1[N+](=O)[O-] 1118139945 DBUAKYRRZQNGHY-CBAPKCEASA-N 297.315 -0.175 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1c([N+](=O)[O-])c(C)nn1C 1118269924 UEQRDAJFNUIVHW-RKDXNWHRSA-N 298.299 -0.141 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1299898414 YHHOYBFUYBHMRO-LDYMZIIASA-N 297.267 -0.714 5 20 CBBD COC(=O)CCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1322846399 QORYAPJYDGFBJZ-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCNC1CC1 1326282253 MCURJZMKRWTAJI-UHFFFAOYSA-N 254.250 -0.946 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc(CC(=O)O)cc1[N+](=O)[O-] 1610143527 XUEUZDCUSQDVQF-SNVBAGLBSA-N 297.267 -0.259 5 20 CBBD O=C1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1 32774692 WTYXIEZBQQABTB-NSHDSACASA-N 295.295 -0.234 5 20 CBBD CS(=O)(=O)NCCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 44861010 TXBHORFAGRPZFH-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)CC(=O)NC1CC1 90512421 GMWHLEVKBCGSGI-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc(F)cc1[N+](=O)[O-] 159802296 WMIZSGBUMHBALG-QMMMGPOBSA-N 286.215 -0.002 5 20 CBBD O=C(NC[C@@H]1CN2CCN1CC2)c1n[nH]cc1[N+](=O)[O-] 179184771 MBIGKSDUJIXHJZ-MRVPVSSYSA-N 280.288 -0.953 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](O)[C@H](O)C1 277567508 QDMGITMAUORKGW-AOOOYVTPSA-N 295.251 -0.903 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1nc[nH]n1 285488090 ADXVDNGKEPQTEQ-SCSAIBSYSA-N 251.206 -0.073 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCn1ccnc1 354235808 MFIOTQXUAVWBLU-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@@](C)(O)CO)c1[N+](=O)[O-] 355288825 KDNALXOHYXCZCF-LLVKDONJSA-N 286.288 -0.257 5 20 CBBD CCCc1[nH]nc(C(=O)N(C)C[C@@H](O)CO)c1[N+](=O)[O-] 355636281 WAPCXBGDJMVXJF-SSDOTTSWSA-N 286.288 -0.304 5 20 CBBD Cn1nnnc1CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 356916038 JJQQNORUBYRMNU-UHFFFAOYSA-N 288.223 -0.086 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCC(=O)N(C)C2=O)c1[N+](=O)[O-] 425095390 VSRIIKVGAIKCAQ-LURJTMIESA-N 295.255 -0.496 5 20 CBBD CN(C)[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 563363567 HPCIHVHJRQAFLS-RYUDHWBXSA-N 296.327 -0.637 5 20 CBBD CC[C@@H](NC(=O)c1ccnc(NC)c1[N+](=O)[O-])C(=O)NC 566464285 DBSNJKYYALXVRE-MRVPVSSYSA-N 295.299 0.286 5 20 CBBD CC(CO)(CO)CSc1ncc([N+](=O)[O-])c(N)n1 583392665 MRHWKQXJQRUZDM-UHFFFAOYSA-N 274.302 0.050 5 20 CBBD Cc1[nH]c(=NCCc2nc(N)n[nH]2)ccc1[N+](=O)[O-] 590567608 PLRBVVIBVBQRAD-UHFFFAOYSA-N 263.261 0.075 5 20 CBBD O=C1NCCC[C@H]1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 591735397 YYVMPAMLMHFOKS-GXSJLCMTSA-N 297.315 -0.732 5 20 CBBD CNS(=O)(=O)CCn1cc([N+](=O)[O-])c(C)cc1=O 598710315 PSFQIMQDPHJLFW-UHFFFAOYSA-N 275.286 -0.386 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1cnc(O)c([N+](=O)[O-])c1 600808822 SGQAGRXKYQSDHT-VIFPVBQESA-N 296.283 -0.508 5 20 CBBD CNC(=O)c1ccc(N[C@@H](COC)C(N)=O)c([N+](=O)[O-])c1 758304184 YISMDMZEMDVFNS-VIFPVBQESA-N 296.283 -0.133 5 20 CBBD Nc1ccc(C(=O)NN2CC(=O)NC2=O)cc1[N+](=O)[O-] 807287774 KYQIJIHJOMILQM-UHFFFAOYSA-N 279.212 -0.626 5 20 CBBD COC(=O)[C@@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 843089056 QOKPGNXMWDEXKA-QWRGUYRKSA-N 284.268 -0.248 5 20 CBBD CON1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 846976036 JEUDYVMRBQMJCE-UHFFFAOYSA-N 255.278 -0.030 5 20 CBBD Cc1nc(Cn2cc(C(=O)OCCC[N+](=O)[O-])nn2)no1 860920546 BEQRJHNVDFQQIS-UHFFFAOYSA-N 296.243 -0.159 5 20 CBBD COCC(=O)N1C[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]2C1 959787225 VGGZZABZPRROOA-LMLFDSFASA-N 297.311 -0.785 5 20 CBBD Cc1cnoc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991292261 FBWZCSPRXIISHA-RKDXNWHRSA-N 294.267 -0.411 5 20 CBBD C[C@@H]1NC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1116145476 VQURAKSMRPPECA-POYBYMJQSA-N 283.244 -0.908 5 20 CBBD NCC(F)(F)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261494814 GGGHVBGBIZGRMC-UHFFFAOYSA-N 290.226 -0.533 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CC[C@@H](CO)C1 1319629590 CZWUAZNYTIGXQB-SECBINFHSA-N 281.268 -0.403 5 20 CBBD Cn1nnc2c1CC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C2 1326780551 JGYIFQYQWWCMBP-LURJTMIESA-N 291.271 -0.266 5 20 CBBD O=c1ccn(-c2cc(-c3nn[nH]n3)ncn2)cc1[N+](=O)[O-] 1582808307 DADXQMRIDXUDOV-UHFFFAOYSA-N 286.211 -0.284 5 20 CBBD O=C(O)[C@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1602208962 UQLHQJCZMRNHDQ-VHSXEESVSA-N 270.241 -0.337 5 20 CBBD COC(=O)[C@@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])o1 1606324598 VTCMHKBLJJFJLX-RXMQYKEDSA-N 286.196 -0.066 5 20 CBBD Cc1cccc(C(=O)NC(CO)CO)c1[N+](=O)[O-] 87751845 RHMBYMHCAKUJGP-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](O)C(N)=O)c1 228486429 ACVLSBCLIASVAS-SECBINFHSA-N 267.241 -0.521 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCOC1 229685160 YZXWEFIDAXATKZ-NSHDSACASA-N 269.257 -0.186 5 20 CBBD CC(C)[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 264354835 DONCMIVFKRYEBW-SNVBAGLBSA-N 283.288 -0.193 5 20 CBBD NC(=O)C[C@@H](N)C(=O)NCCNc1ccccc1[N+](=O)[O-] 269585782 CGLIHFPXEUKTCL-MRVPVSSYSA-N 295.299 -0.674 5 20 CBBD C[C@@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])nn1C 356472158 YMLNAVMOQQYDIF-ZETCQYMHSA-N 279.260 -0.262 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 356724157 BTQQPGCWJREYRA-JGVFFNPUSA-N 295.299 -0.027 5 20 CBBD CCN(CC(N)=O)C(=O)c1cnc(O)c([N+](=O)[O-])c1 356921722 RKTDTCFPMCGJLS-UHFFFAOYSA-N 268.229 -0.357 5 20 CBBD NC(=O)C1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCCC1 360370751 DTXYTPXKGHPXOO-UHFFFAOYSA-N 296.287 -0.652 5 20 CBBD CCN(CCC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362525819 OVPATOKDKBTBTC-UHFFFAOYSA-N 271.233 -0.491 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCN2CCOC[C@H]2C1 368820015 ZZWWXIQJTHNTAN-SNVBAGLBSA-N 281.316 -0.155 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN2C(=O)NC[C@@H]2C1 531226953 QDIIYHJSEDZGNN-SECBINFHSA-N 293.283 -0.217 5 20 CBBD CN(C)C(=O)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 547729800 CYJZUTAFKHAIAF-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCO)cc1 554720301 MEEAJRQPHDYOAW-UHFFFAOYSA-N 274.298 -0.050 5 20 CBBD N[C@H]1C[C@@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 575331433 WHJWSATYOSJZES-ZJUUUORDSA-N 277.284 -0.262 5 20 CBBD C[C@@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)NCCF 578376961 BFFCLQVVBJXTMU-ZCFIWIBFSA-N 299.262 -0.224 5 20 CBBD CN1C(=O)CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1=O 581675876 GYTCPZOUDLDMEZ-UHFFFAOYSA-N 293.235 -0.259 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 588865171 XMSSTLLEFCDXLJ-QMMMGPOBSA-N 283.284 -0.047 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 592198821 OYKQFOSXJUGEKQ-VHSXEESVSA-N 298.299 -0.353 5 20 CBBD O=C(NC1(C(=O)O)CCOCC1)c1cc([N+](=O)[O-])n[nH]1 595999027 HWEDTPRGQFENBD-UHFFFAOYSA-N 284.228 -0.319 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)C1CCN(S(N)(=O)=O)CC1 814036847 MBNWFLBKPGGYIG-SSDOTTSWSA-N 295.317 -0.890 5 20 CBBD CC(C)[C@@H](CO)ONC(=O)c1cc([N+](=O)[O-])n[nH]1 857285605 GWLCZYYLQBSJIK-SSDOTTSWSA-N 258.234 -0.004 5 20 CBBD O=C(N[C@H]1C[C@H](CNCc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 983654486 OECUJMGBGGQKKZ-YJFSRANCSA-N 295.299 -0.281 5 20 CBBD CN1CCN(C(=O)CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1123996367 XOTJVGVVEYZCBF-UHFFFAOYSA-N 295.299 -0.573 5 20 CBBD Cc1nn(C)c(C(=O)N2CCn3cnnc3C2)c1[N+](=O)[O-] 1318361352 CFFQWAPGPVOZGP-UHFFFAOYSA-N 291.271 -0.116 5 20 CBBD CCNCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1327073704 PYGMFNXNQBETBW-UHFFFAOYSA-N 256.266 -0.698 5 20 CBBD C[C@H](OC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 5991095 LZHGRJJPGIKGBJ-ZETCQYMHSA-N 295.251 -0.258 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 128389134 KYVYOGBORSRWFD-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD NC(=O)NC1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 175759074 VYDQATLFUPXWKR-UHFFFAOYSA-N 282.304 -0.076 5 20 CBBD O=C1C[C@@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CCN1 177927850 RNOUQECOHQAOIL-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD CCNCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 236923839 NIRVUAYDHWWNKK-UHFFFAOYSA-N 255.278 -0.175 5 20 CBBD COc1cc(S(=O)(=O)NCCN)ccc1[N+](=O)[O-] 237087809 FMBCKCMHQQJFGI-UHFFFAOYSA-N 275.286 -0.160 5 20 CBBD COCCNCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 237288649 VRCUFXLDAZIXBB-UHFFFAOYSA-N 298.299 -0.891 5 20 CBBD C[C@H]1CNCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 262055715 XFZHQKXDUMTESF-ZETCQYMHSA-N 254.250 -0.993 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 264473557 UYBSNYIAVMHXJZ-SSDOTTSWSA-N 281.272 -0.023 5 20 CBBD CCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1nnn[nH]1 268245352 WBXNFRBYUSITHB-MRVPVSSYSA-N 294.275 -0.038 5 20 CBBD CN(C[C@H](O)CO)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 275845364 GHRRBTAJEUODAH-JTQLQIEISA-N 297.267 -0.655 5 20 CBBD CN1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 299731904 ZCCUBKTZPHQMMI-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD NC(=O)[C@H](O)CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 312299016 UCVKKLGYOHXBNX-XICOKMJESA-N 279.252 -0.430 5 20 CBBD CC(C)N1C(=O)C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 343993916 AJRISNKZLNBLHC-LURJTMIESA-N 295.255 -0.416 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)OC 347876248 CGEDASGSYZYRBK-MRVPVSSYSA-N 271.229 -0.159 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@](F)(CO)C1 355854241 HDWAFFMZQHJRCK-VIFPVBQESA-N 258.209 -0.136 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CC[C@H](CO)O2)c1[N+](=O)[O-] 356542884 GOLSUXUUIZOMMC-HTQZYQBOSA-N 284.272 -0.104 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@]1(CCO)CCOC1 447066044 JBSUZYYOARZQQJ-LLVKDONJSA-N 284.272 -0.400 5 20 CBBD Cc1[nH]nc(C(=O)NCC(C)(CO)CO)c1[N+](=O)[O-] 552424603 HVNBDJLIVJTGHV-UHFFFAOYSA-N 272.261 -0.653 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 564087260 LKGGFRZUMMJTEE-HTQZYQBOSA-N 270.245 -0.679 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@@H](O)[C@H](CO)C2)n1 567977733 KIMOUYGKRRSTRI-IONNQARKSA-N 297.267 -0.214 5 20 CBBD Nc1n[nH]c(CCN=c2[nH]cc([N+](=O)[O-])s2)n1 596236856 MZHJQYZXBJNDQW-UHFFFAOYSA-N 255.263 -0.172 5 20 CBBD CO[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 616029391 BKHXARPTAHNHIW-ZETCQYMHSA-N 256.218 -0.237 5 20 CBBD Cc1ccc(NC(=O)C(=O)NOCC(N)=O)cc1[N+](=O)[O-] 785383390 FNLBGGZLIGLRIV-UHFFFAOYSA-N 296.239 -0.625 5 20 CBBD C[C@@H](COC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O)[N+](=O)[O-] 813114047 YAPVNDNNFAOJGB-JVXZTZIISA-N 299.283 -0.085 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)Cc1nc2ncccn2n1 814037704 DYSJLEWWQKFJIL-ZETCQYMHSA-N 265.229 -0.125 5 20 CBBD CC(C)N(CC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 820015361 NRBFJLFEUKTQFA-JTQLQIEISA-N 286.288 -0.053 5 20 CBBD CC[C@H](CN1CCOCC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 928646337 JWOQEGDVBGHJIE-GMTAPVOTSA-N 271.317 -0.121 5 20 CBBD O=C(NCC1CN(Cc2ncccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031661882 LTYIHWVDAUAQMH-GHMZBOCLSA-N 291.311 -0.310 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCNC[C@@H]1CO 1122125183 YRQBMBUFIQIWFP-GFCCVEGCSA-N 279.296 -0.070 5 20 CBBD Cc1ccc(=O)n(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1252238807 VTSBIWPHUWVZTA-JTQLQIEISA-N 279.256 -0.282 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](CO)c2cnn(C)c2)c1[N+](=O)[O-] 1319886963 BFHAYSHLRLFYCO-QMMMGPOBSA-N 294.271 -0.177 5 20 CBBD COC(Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O)OC 1322445665 KNSOTYMMHFXOEV-UHFFFAOYSA-N 271.229 -0.526 5 20 CBBD CN1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1323367765 OJAIFPLHUGFMDD-UHFFFAOYSA-N 280.284 -0.470 5 20 CBBD NC(=O)c1ccnc(N2C[C@H]3C[C@@]3(CO)C2)c1[N+](=O)[O-] 1327601138 LLYPHKBZSKGMQL-KRTXAFLBSA-N 278.268 -0.093 5 20 CBBD O=C(O)c1ncn(CCn2ccc([N+](=O)[O-])n2)n1 1602580508 ZARKKYMVDBTPMO-UHFFFAOYSA-N 252.190 -0.219 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCC(N)=O)c1 42185789 WFXRUNPZYDPYMM-UHFFFAOYSA-N 269.213 -0.582 5 20 CBBD COC(=O)[C@@H]1CN(CCn2c([N+](=O)[O-])cnc2C)CCO1 133785015 TWAZMAAPNAZQCA-JTQLQIEISA-N 298.299 -0.026 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CNC(=O)C1 230724367 VBKDKXFBYXPEJE-RXMQYKEDSA-N 265.229 -0.810 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CN3CCN2CC3)c1[N+](=O)[O-] 269629682 VTFDNAWEERISSO-SECBINFHSA-N 294.315 -0.644 5 20 CBBD COC[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)OC 272636748 BYMHMWPZIIZKGG-SECBINFHSA-N 272.261 -0.431 5 20 CBBD CN(CC(N)=O)c1ccc([N+](=O)[O-])cc1S(C)(=O)=O 276099086 SBNOBKNUWQTOSG-UHFFFAOYSA-N 287.297 -0.080 5 20 CBBD C[C@@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340014636 UEVRSCJOWWGVKW-QMMMGPOBSA-N 269.257 -0.356 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCC[C@H]1O 341837294 PUUHSDXLVRZEAB-JGVFFNPUSA-N 269.261 -0.442 5 20 CBBD CCn1cc(S(=O)(=O)NCCNC)c([N+](=O)[O-])n1 353218979 QLCZXPXJDJNJBW-UHFFFAOYSA-N 277.306 -0.691 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCO[C@H](CN)C1 358514565 VKIYNKKIXBGWTH-SNVBAGLBSA-N 297.315 -0.324 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@]12CCOC2=O 364449547 VESWVXVPZKFKQD-SOCHQFKDSA-N 254.242 -0.040 5 20 CBBD Cc1nn(C)c(N2CC(N3CC[C@@H](O)C3)C2)c1[N+](=O)[O-] 593506772 BMBKKKXAAKRASU-SNVBAGLBSA-N 281.316 -0.108 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCn1cncn1 603959381 CEJDQIFHTFAGIF-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCc1cnn[nH]1 610663306 MSAFWMBVXNZFSS-UHFFFAOYSA-N 263.217 -0.181 5 20 CBBD COCC[C@H](NC(=O)N=c1cc[nH]cc1[N+](=O)[O-])C(N)=O 611599045 JQCFLIMXBXPJFG-QMMMGPOBSA-N 297.271 -0.576 5 20 CBBD O=C(O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 740482727 BFBGXPVWDVGKEK-UHFFFAOYSA-N 267.197 -0.266 5 20 CBBD CCn1ncn(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1=O 816737251 FSUUYAPAWWRASY-UHFFFAOYSA-N 281.232 -0.612 5 20 CBBD O=C(O)C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 833220200 VMCICTOHUDAAGY-SNVBAGLBSA-N 284.272 -0.033 5 20 CBBD Nc1nsc(N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)n1 839700345 RPUZZSPFLNAAEO-RNFRBKRXSA-N 298.328 -0.566 5 20 CBBD C[C@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC(=O)NC1CC1 840672002 AMSMYOMAHUPQQW-UIISKDMLSA-N 285.256 -0.429 5 20 CBBD Cc1ccncc1S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842393891 BFCGNXRDVMLWMA-HTQZYQBOSA-N 285.281 -0.140 5 20 CBBD CC1(C)C[C@](C)(NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 848154118 IZFZVMNKCWNDDD-NSHDSACASA-N 297.271 -0.213 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H](C2OCCO2)C1 927995468 BCCVLHHLCUJJEZ-IWSPIJDZSA-N 256.258 -0.127 5 20 CBBD CC(=O)NC[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1254794413 SQEXBYVCEGJHSV-JTQLQIEISA-N 281.272 -0.274 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@H]2C[C@]2(CO)C1 1320882362 SXMZCTGAFWPCIH-LHLIQPBNSA-N 252.230 -0.228 5 20 CBBD Cn1ccnc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1325254296 HCRRLOIODXWFTO-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@H]2NCC[C@H]2C1 1326305261 DQLSDHWGYPXOSU-IUCAKERBSA-N 280.288 -0.603 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)NCc1nnn[nH]1 44928486 BLDVADPCHXXVKB-UHFFFAOYSA-N 278.228 -0.197 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC[C@@H](O)C1 61705828 JDTLITUSKOJYTP-SSDOTTSWSA-N 253.214 -0.510 5 20 CBBD O=C1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCN1 65769144 BXBSUMOVLHPOQH-UHFFFAOYSA-N 267.245 -0.860 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 167607297 XEUKUJDIKUMIPV-WCBMZHEXSA-N 284.272 -0.601 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C)CN1 237615788 HJLYDTPTBZYAMO-JGVFFNPUSA-N 268.277 -0.605 5 20 CBBD NS(=O)(=O)c1cccc(N2CC[C@@H](O)C2)c1[N+](=O)[O-] 272547701 QXDLYLYSERCHRS-SSDOTTSWSA-N 287.297 -0.187 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 344961372 CMZRLFXQDDVMQH-MRVPVSSYSA-N 296.287 -0.679 5 20 CBBD CNc1c(C(=O)N[C@H](CO)C(=O)OC)cccc1[N+](=O)[O-] 360937038 HZAIIQAIMJNCSD-MRVPVSSYSA-N 297.267 -0.100 5 20 CBBD CCC[C@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362524085 HIYLWHZXARGQRW-JTQLQIEISA-N 285.260 -0.054 5 20 CBBD NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1c1ncc([N+](=O)[O-])c(N)n1 365003093 XPDARSHMNRIBRX-OOZYFLPDSA-N 292.299 0.057 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN(C(=O)C2CC2)C1 422016317 POSBJWMVDKLTLW-UHFFFAOYSA-N 293.283 -0.170 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC[S@]1=O 581833793 XCFFYEBKTDJXCT-GLEHDBDLSA-N 298.324 0.165 5 20 CBBD COC(=O)[C@@](C)(CO)NCCn1ccc([N+](=O)[O-])n1 595527417 OVUHFAPHFSLQPE-SNVBAGLBSA-N 272.261 -0.695 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NCCN1CC[C@H](O)C1 599767358 WPIDQFXWWYPBGF-VIFPVBQESA-N 295.299 -0.400 5 20 CBBD CC(C)[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 725921011 CNPOPJRDGILXMC-SECBINFHSA-N 270.245 -0.156 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC(=O)[C@@H]1CCOC1 762862783 XIMRPUWPGDWSSF-MRVPVSSYSA-N 283.240 -0.060 5 20 CBBD CC(C)[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 820043614 BHDAZIZSHAAVNW-NXEZZACHSA-N 286.288 -0.149 5 20 CBBD O=C(N[C@H]1CC(=O)N(C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 839699398 WTNKQQNICAVETE-NBEYISGCSA-N 253.258 -0.469 5 20 CBBD NC(=O)C(=O)NC1CN(Cc2ccccc2[N+](=O)[O-])C1 1030882523 AHMDLFMNNWNQHS-UHFFFAOYSA-N 278.268 -0.620 5 20 CBBD CNC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1254799435 IYUGUCPFYASIQG-QMMMGPOBSA-N 267.245 -0.664 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CCNC1=O 1327048015 IHMRTPCBDNMKGV-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD C[C@@H]1CCN1C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1332157187 QWWOHNCRBHPQNJ-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD C[C@@]1(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC(=O)N1 1345619315 RESADNWSJQIVBO-JQWIXIFHSA-N 297.315 -0.590 5 20 CBBD Nc1cc(N2CCO[C@H](C(=O)O)C2)cc(CO)c1[N+](=O)[O-] 1605654738 NICJHPUXRMKSNE-JTQLQIEISA-N 297.267 -0.041 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 62119239 SYUIPRXCPPWWED-ZETCQYMHSA-N 268.229 -0.276 5 20 CBBD CCc1nn(C)c(N2CCN(CC(N)=O)CC2)c1[N+](=O)[O-] 92830744 CCAMJICLPCYBCT-UHFFFAOYSA-N 296.331 -0.502 5 20 CBBD COc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 227865565 DSOVMPOIJSNPLW-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD CCN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1=O 273364335 AYRFFMZCVUSZDT-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)C1CC(N)C1 294970473 XKLRKNCIZHNXHY-UHFFFAOYSA-N 253.262 -0.261 5 20 CBBD Cn1c(C(=O)NCCN2CCOCC2)ccc1[N+](=O)[O-] 330397514 PCHUMJJEPMQUKJ-UHFFFAOYSA-N 282.300 -0.005 5 20 CBBD Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@H](O)[C@H](O)C1 331299728 QHGNZMIMMVTQKW-PHIMTYICSA-N 295.295 -0.121 5 20 CBBD CN1CCO[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]21 331763718 JUBWXJJLLBWRPD-ZJUUUORDSA-N 295.299 -0.667 5 20 CBBD Nc1nc(NC[C@H](O)[C@H]2CCOC2)ncc1[N+](=O)[O-] 346435956 WHKYLJARYQFQJL-XPUUQOCRSA-N 269.261 -0.224 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](CO)O1 347667545 KSHLHHKNPJLVKJ-YUMQZZPRSA-N 284.272 -0.450 5 20 CBBD Nc1nc(N2C[C@H]3COC[C@H]3C2)ncc1[N+](=O)[O-] 367416451 BJEXXTJBVWOVCR-KNVOCYPGSA-N 251.246 0.050 5 20 CBBD COCCNCCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 415386418 PEASCYQISKQCFN-UHFFFAOYSA-N 283.288 -0.231 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CN(C)NC1=O 446306772 XCMXPDUMGDDCKI-MRVPVSSYSA-N 278.268 -0.022 5 20 CBBD Cn1cc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 548412630 OMMLLZVCLDKVSC-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 568727438 YOKFLYGTHYKKNA-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 588864288 DGILCUSPXBJRDV-SSDOTTSWSA-N 257.246 -0.160 5 20 CBBD CCOc1cncc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 592676418 IDODYLCWBSPFPX-UHFFFAOYSA-N 293.243 0.014 5 20 CBBD CN1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1=O 596135908 NCLGKDKVFXVSAM-UHFFFAOYSA-N 278.268 -0.028 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1CO 598909277 IAMBZHZQHGRLJS-IUCAKERBSA-N 283.288 -0.337 5 20 CBBD CCc1[nH]nc(C(=O)N2[C@@H]3CO[C@H]4[C@@H]3OC[C@H]42)c1[N+](=O)[O-] 618237914 DLJLRDXDYQGWTR-JJHYMCDRSA-N 294.267 -0.129 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3C[C@]3(CO)C2)c1 782616050 LRGCNRLVKUOYHX-YUSALJHKSA-N 282.300 -0.534 5 20 CBBD O=C(C1CCN(CC[N+](=O)[O-])CC1)N1CCOCC1 791053304 KRDKYVADVDPOQB-UHFFFAOYSA-N 271.317 -0.166 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCNCC1 830329697 CBIAKOJXXALLLO-UHFFFAOYSA-N 253.262 -0.468 5 20 CBBD CCN1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 849676876 KNVLTRCUNVZDER-SECBINFHSA-N 282.256 -0.045 5 20 CBBD O=C(CN1CCCS1(=O)=O)OCCC[N+](=O)[O-] 860914152 PXTXPBIAIREAEU-UHFFFAOYSA-N 266.275 -0.768 5 20 CBBD COC[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319721562 MMKFZQFIFJDQDP-MRVPVSSYSA-N 269.257 -0.092 5 20 CBBD Cn1cnc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 1319933114 ARQCDNIFFKQBIG-UHFFFAOYSA-N 265.233 -0.764 5 20 CBBD O=C1CNC(=O)N1CCn1cccc([N+](=O)[O-])c1=O 1321413323 GHXUPCJLYYQIES-UHFFFAOYSA-N 266.213 -0.692 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@H]2CCCNC2)c1=O 1326017414 AUUUYBGQWNDLGD-QMMMGPOBSA-N 280.284 -0.145 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1c[nH]nc1[N+](=O)[O-] 1329402050 GMPQKIINSNAFFA-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C(=O)O)C1 1598611915 VNPGHWWTTIZWKD-ZETCQYMHSA-N 297.271 -0.594 5 20 CBBD COC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 28483548 UXUNAMXUIYDBOG-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 28813850 HRVMQIQKIFXTRZ-UHFFFAOYSA-N 296.283 -0.072 5 20 CBBD C[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 67292555 RDTKVPFXKSSEFI-QMMMGPOBSA-N 283.288 -0.226 5 20 CBBD CCC[C@@H](O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 134409388 ZJAQLZIMRZKXND-GHMZBOCLSA-N 272.305 -0.097 5 20 CBBD CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1CC(=O)NC1=O 299490862 CQBPJAAJNFMRQP-ZETCQYMHSA-N 280.240 -0.200 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 339891750 LXXXHZZECZLPBP-SECBINFHSA-N 294.267 -0.767 5 20 CBBD CNC(=O)CN(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 342611704 FPCWQAWIRYRWEJ-UHFFFAOYSA-N 294.267 -0.262 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)NCCn2ncnn2)cc1 351600268 RTYAGZAGXMHTPU-UHFFFAOYSA-N 298.284 -0.440 5 20 CBBD O=C(O)CC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCC1 362700178 YFKLIIMVJIOVNZ-UHFFFAOYSA-N 283.244 -0.300 5 20 CBBD Cn1ccc(NCCNC(=O)c2cc([N+](=O)[O-])nn2C)n1 568397923 GRGFXOJOXRDTCB-UHFFFAOYSA-N 293.287 -0.096 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)[C@H](N)C[C@H]3C2)c1[N+](=O)[O-] 577887146 GKIIIQGYLOHIGA-DTWKUNHWSA-N 294.315 -0.615 5 20 CBBD CNc1nccc(C(=O)NCCCOCCO)c1[N+](=O)[O-] 578024731 DEBYOKIADGGINX-UHFFFAOYSA-N 298.299 0.160 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CO)CN(C)C 588863814 VLDRCNDQHPKCTO-VIFPVBQESA-N 285.304 -0.862 5 20 CBBD Cc1cc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 591740911 GHZPSIGBJUBOMO-LLVKDONJSA-N 280.288 -0.026 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@@H](O)C[C@@H]2CO)n1 592978991 ZGSHZTUOMSWAOD-SFYZADRCSA-N 297.267 -0.072 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2C[C@H]1CO2 600774975 HYHUHQWKNWDYBG-YUMQZZPRSA-N 252.230 -0.209 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@H]1CN2 602588663 NSHQZTQMYJZTJZ-IUCAKERBSA-N 265.273 -0.246 5 20 CBBD Cn1nnnc1COC(=O)CCn1cc([N+](=O)[O-])cn1 733470429 JJQUPDMMIXEPBH-UHFFFAOYSA-N 281.232 -0.552 5 20 CBBD COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCC(N)=O 753455479 CVIVLVASDDZPPF-UHFFFAOYSA-N 269.213 -0.172 5 20 CBBD CCCN(C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842320093 TZRQOKPXIFLOCO-RNFRBKRXSA-N 265.291 -0.646 5 20 CBBD NC(=O)[C@@H]1CCCN1C1CCN(CC[N+](=O)[O-])CC1 930073209 XEQMWOYOBIMLCF-NSHDSACASA-N 270.333 -0.323 5 20 CBBD CC(C)[C@](C)(NC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 1117251069 DWUWQUCAIOAGTC-NSHDSACASA-N 283.288 -0.042 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCn3cnnc3C2)n1 1319938458 HSEASADYJWRPAS-UHFFFAOYSA-N 263.261 -0.101 5 20 CBBD CN(Cc1nncn1C)C(=O)Cn1ccc([N+](=O)[O-])n1 1327684184 ARTHWUZDWVNOSX-UHFFFAOYSA-N 279.260 -0.422 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CCCN(C)C2=O)c1[N+](=O)[O-] 1329162522 VCXATJNSXTWLRN-QMMMGPOBSA-N 295.299 -0.013 5 20 CBBD O=C(N[C@@H]1CCNC[C@@H]1F)c1cc([N+](=O)[O-])n[nH]1 1580615222 BUMUCKJDQQTIOD-NTSWFWBYSA-N 257.225 -0.252 5 20 CBBD CC[C@@H](COC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 1595183613 RWJOSHQRBJEIQJ-LURJTMIESA-N 272.217 -0.160 5 20 CBBD COC[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 37875212 MKGNXYGJCLIBFP-PSASIEDQSA-N 258.278 -0.223 5 20 CBBD O=C(Cn1cnnn1)NCCOc1ccc([N+](=O)[O-])cc1 68185863 LZQVDBHTONUGQS-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD CC[C@H]1C(=O)NCCN1Cn1nccc1[N+](=O)[O-] 106855718 AOSYLQLBXNKTBX-QMMMGPOBSA-N 253.262 -0.041 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1C(=O)O 111248048 VSRGCRCMCSRHSK-JGVFFNPUSA-N 282.256 -0.030 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN[C@H](C)C1 155081893 DOMTVSKALZADEV-MRVPVSSYSA-N 267.289 -0.080 5 20 CBBD COCC[C@@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 231682536 SZXDYJARUZZEDP-LLVKDONJSA-N 286.288 -0.305 5 20 CBBD Cc1c(CNC(=O)CNC(=O)CN)cccc1[N+](=O)[O-] 231857066 PKNJSUNCRFXRCE-UHFFFAOYSA-N 280.284 -0.406 5 20 CBBD CC[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 271011000 ZTRCZUQHSIEYRD-ADEWGFFLSA-N 284.316 -0.145 5 20 CBBD O=C(NCCCN1C(=O)CCC1=O)c1cc([N+](=O)[O-])[nH]n1 285463946 UJMMWXIDNPRDSP-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC(O)C1 331609266 PAUXQGINEIXBKG-RFBVYIQQSA-N 270.289 -0.393 5 20 CBBD C[C@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340014635 UEVRSCJOWWGVKW-MRVPVSSYSA-N 269.257 -0.356 5 20 CBBD CC(C)[C@@](C)(NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 341985824 NQTQBSYMOYLGME-LLVKDONJSA-N 283.288 -0.042 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@](C)(C(N)=O)C1 358369086 YCUVXDGWVGPRCX-LBPRGKRZSA-N 295.299 -0.176 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cccc([N+](=O)[O-])c1N 358908886 UGXRKCOSGCYFNW-GFCCVEGCSA-N 297.267 -0.169 5 20 CBBD CNCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1 422779413 IPYKYVUVYUEZHD-UHFFFAOYSA-N 294.311 -0.031 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1Cc1c([N+](=O)[O-])ncn1C 426158460 CNZFLXBVVMVSPO-MRVPVSSYSA-N 267.289 -0.009 5 20 CBBD O=C1C[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CN1 543567283 ILPGRDCZHRAQPE-LURJTMIESA-N 293.235 -0.058 5 20 CBBD C[C@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)N(C)C 567750931 MIAYKKZKOSVAGT-LURJTMIESA-N 281.272 -0.222 5 20 CBBD COc1ccc(OCCNC(CO)CO)c([N+](=O)[O-])c1 577526460 CUTOMEUGILGRJB-UHFFFAOYSA-N 286.284 -0.075 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 597654993 XBVNWBCWAIMDIJ-SSDOTTSWSA-N 285.304 -0.467 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21)C1CC1 976016450 MWCGDACGTRFPBF-NZFPMDFQSA-N 279.296 -0.365 5 20 CBBD COc1nnccc1NC(=O)Cn1cnc([N+](=O)[O-])n1 1117591614 XQSLFTDAUPIDMB-UHFFFAOYSA-N 279.216 -0.376 5 20 CBBD CCn1nccc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1118797892 JUYHXOHAAAYKTN-UHFFFAOYSA-N 279.260 -0.281 5 20 CBBD Cc1nn(C)c(C(=O)NCCNC(=O)N(C)C)c1[N+](=O)[O-] 1320052044 DCZRZXKXMRVJCC-UHFFFAOYSA-N 298.303 -0.362 5 20 CBBD NC[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCCO1 1326166496 OHWSNOOYNSJXEY-ZETCQYMHSA-N 269.261 -0.492 5 20 CBBD CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCN(C)C(=O)C1 1342657615 DMIVSVDYAKYBEJ-QMMMGPOBSA-N 282.304 -0.086 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H](C(N)=O)C1 68467445 JEIHDWQXTWJYEN-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD NC(=O)[C@@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CCO1 153825984 GUCCIYNYWNEUKK-RYUDHWBXSA-N 295.295 -0.186 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)OCC1CC1 171077862 JSZZVTZVYTUIEN-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD C[S@](=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 230696020 SKWIWVYHOGFBAN-SFHVURJKSA-N 272.286 -0.320 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H](O)C(F)(F)F)c1 236532333 NMUANVMADOYGAB-JGVFFNPUSA-N 298.221 -0.335 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CC(=O)NC2CC2)c1[N+](=O)[O-] 264299308 RHTUDGQJXGIHHI-UHFFFAOYSA-N 281.272 -0.023 5 20 CBBD CN(C)CCN(C)CCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 290564136 GBYZDQXLFLZABR-UHFFFAOYSA-N 298.347 -0.069 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@](C)(CO)C(=O)O 313534726 PKCAWWYURXBZNG-SNVBAGLBSA-N 271.229 -0.501 5 20 CBBD C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCS1(=O)=O 351991431 UTZGIAZZHZNGDS-RITPCOANSA-N 288.285 -0.377 5 20 CBBD CCC(=O)N1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 355107553 CKRQKRHWMFJVDK-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1n[nH]cc1[N+](=O)[O-] 362397043 QMNPXVZYWKVKIO-BDAKNGLRSA-N 295.299 -0.089 5 20 CBBD O=C(O)CC1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 398321982 WTKVMEZCXNPKSF-UHFFFAOYSA-N 268.229 -0.085 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1[C@@H]2CNC[C@@H]21 495112704 SLIDTJBEVLVWQU-VROVMSAKSA-N 265.273 -0.566 5 20 CBBD NC[C@H]1CC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)O1 566190712 LGGGBSYEYSJARV-ZJUUUORDSA-N 283.288 -0.586 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCNC1CC1 568636112 RVUBTDHHNXBTTA-UHFFFAOYSA-N 268.277 -0.555 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1NC(=O)Cn1nnnc1CN 568747023 ZZTWOPLCAKQLKG-UHFFFAOYSA-N 291.271 -0.013 5 20 CBBD CC(CO)(CO)C(=O)OCCn1cc([N+](=O)[O-])cn1 767098022 JSTDCVWLQWIVEW-UHFFFAOYSA-N 273.245 -0.675 5 20 CBBD Cc1nonc1CNC(=O)NCCn1cc([N+](=O)[O-])cn1 769227002 CFBHWPKHMWJAOX-UHFFFAOYSA-N 295.259 -0.018 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)c1n[nH]cc1[N+](=O)[O-] 820539643 UYJLKFKLCDWEEM-UHFFFAOYSA-N 285.260 -0.594 5 20 CBBD C[C@H]1C[C@@H](NCC[N+](=O)[O-])C(=O)N1c1cnn(C)c1 905146920 SWBMKHFKJYEZIX-WCBMZHEXSA-N 267.289 -0.220 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@@H]2CCOC2=O)c1=O 1319028644 HFZVPKAPPBZZJP-SSDOTTSWSA-N 295.251 -0.191 5 20 CBBD O=C(CCc1nc[nH]n1)NCCn1cc([N+](=O)[O-])cn1 1319840857 OCZTZRIZJZBBKM-UHFFFAOYSA-N 279.260 -0.342 5 20 CBBD C[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 1320195368 FQWNYAGACVRIDJ-LURJTMIESA-N 255.234 -0.829 5 20 CBBD CC(C)(C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1325439230 UMEGHSAOHOBRQW-PHDIDXHHSA-N 250.276 -0.104 5 20 CBBD Cc1nc(=NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])n(C)[nH]1 1342435724 WLTJRRVFYOUDAQ-UHFFFAOYSA-N 265.233 -0.263 5 20 CBBD Cn1nccc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1581839343 AGTCKGAQPSEKJK-UHFFFAOYSA-N 275.232 -0.247 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CC[C@H]1C(=O)O 1601383096 FZFVNNVNSDFVPO-SFYZADRCSA-N 268.229 -0.229 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C(=O)O)O1 1607478376 XURODYDIXYLASG-FSPLSTOPSA-N 283.244 -0.355 5 20 CBBD Cc1nn(CCC(=O)OCC(N)=O)c(C)c1[N+](=O)[O-] 102505779 KYYNECVWGXVMTB-UHFFFAOYSA-N 270.245 -0.173 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 189756501 MQQXNAATOOPNHF-QMMMGPOBSA-N 283.288 -0.544 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CC1=O 263819194 TYEGILYICMJAOD-LURJTMIESA-N 280.240 -0.344 5 20 CBBD Cc1ccc(NC(=O)[C@@H](CO)NC(N)=O)cc1[N+](=O)[O-] 270756060 KMPYUSMKMXEOJP-MRVPVSSYSA-N 282.256 -0.129 5 20 CBBD CN(CC(N)=O)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 272312638 SBKQQJZXDJUWPL-UHFFFAOYSA-N 281.224 -0.119 5 20 CBBD COC(=O)[C@@H]1CNC(=O)CN1C(=O)c1ccc([N+](=O)[O-])[nH]1 344898216 ZZFJYUXWVRKRTH-ZETCQYMHSA-N 296.239 -0.964 5 20 CBBD CN(C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@@H]1O 354554447 SVZWYOKBZJXXBX-UWVGGRQHSA-N 299.287 -0.808 5 20 CBBD O=C(N[C@@H](CO)C1CCOCC1)c1cc([N+](=O)[O-])n[nH]1 354617846 GPOFVGWTXYHEMN-VIFPVBQESA-N 284.272 -0.165 5 20 CBBD CNC(=O)c1ccc(N2C[C@@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 355549363 VSLFCWCPFBKVSV-ZJUUUORDSA-N 295.295 -0.114 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@@H](C)CN1 356926265 SQLGKBIEJOVXFQ-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD COC[C@@H](CO)NC(=O)CCn1cc([N+](=O)[O-])nc1C 357704359 DCCPCGJVYFUTTE-SECBINFHSA-N 286.288 -0.387 5 20 CBBD Cc1nn(CCC(=O)NCCC(N)=O)c(C)c1[N+](=O)[O-] 359701395 TZAQFOSQPJHYFH-UHFFFAOYSA-N 283.288 -0.210 5 20 CBBD C[C@H]1CNCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 432516990 YMLLPEBMEMYEEM-GXSJLCMTSA-N 294.311 -0.129 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@@H](CO)[C@H](O)C1 561784838 NAQOLDHVJGWQRK-CMPLNLGQSA-N 297.311 -0.568 5 20 CBBD CNC[C@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 577274736 LQAGOYVVJSQFDB-QMMMGPOBSA-N 255.278 -0.237 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 600458542 MSXPEKNXGDTGRZ-SSDOTTSWSA-N 298.251 -0.046 5 20 CBBD CN1CC[C@@H](OC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 766963144 IAGLJVKYMBQBJX-SSDOTTSWSA-N 268.229 -0.284 5 20 CBBD O=C(NC[C@@H](O)CN1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 840403752 WXASHOWPFZSXJZ-GMTAPVOTSA-N 271.317 -0.385 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 931279877 RLGCEEPHFMHJEP-NDBYEHHHSA-N 295.343 -0.356 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2ncccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020139267 WIBNIKPRJHTQCI-GWOFURMSSA-N 291.311 -0.121 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2nncn2C)C1 1042705243 ODFPCVYJEDCBGG-NXEZZACHSA-N 294.315 -0.877 5 20 CBBD CC(C)=CCNC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323585557 LSKDLLSVFMCAJS-UHFFFAOYSA-N 295.299 -0.010 5 20 CBBD C[C@H](O)[C@@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589995175 IVKIQMGFRGMMJY-UHNVWZDZSA-N 253.222 -0.087 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1597399880 PARIHTZXBZWCPQ-NSHDSACASA-N 298.255 -0.458 5 20 CBBD COC[C@](C)(NCCn1cc([N+](=O)[O-])cn1)C(=O)OC 182599783 LBWLFMMKRKOWIB-NSHDSACASA-N 286.288 -0.041 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCCN1 182619923 ALJJHJSANMHBBO-SECBINFHSA-N 253.262 -0.341 5 20 CBBD O=C1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2O)CN1 226711472 ZXEXIGMJEFFUGL-ZCFIWIBFSA-N 265.225 -0.081 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 227885217 UPUWLHAMDIUNBJ-UHFFFAOYSA-N 253.218 -0.823 5 20 CBBD CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])cnc1O 263927301 BDYKCEYVUZKIQK-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD COC[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 280087689 SXRBEOONLJTEGZ-ZETCQYMHSA-N 271.229 -0.568 5 20 CBBD COCC[C@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 282011678 XYZNGNMMDXAGEY-ZCFIWIBFSA-N 257.250 -0.224 5 20 CBBD Cc1cc(C(=O)N[C@@H](CO)C(N)=O)cc([N+](=O)[O-])c1 286427916 PUJRTYQRJNWJLK-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD C[C@H]1COCCN1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 330621573 MLKGEUVQSRYQGK-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCC[C@H]1C(N)=O 347100095 UBVILAHTOKNOBW-ZETCQYMHSA-N 281.272 -0.192 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCCNC1=O 356146933 ITBMGRVCHNVNMV-SSDOTTSWSA-N 281.272 -0.273 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@]1(O)CCN(C)C1 358046265 KOKOBGQZODHOQO-GFCCVEGCSA-N 297.315 -0.717 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 429318697 RZJNNSWJGIJHQP-SSDOTTSWSA-N 254.250 -0.993 5 20 CBBD O=C(NC(CO)CO)c1cc([N+](=O)[O-])cc2c1OCCO2 526946376 KRDIRNRMHNBFSR-UHFFFAOYSA-N 298.251 -0.551 5 20 CBBD CNS(=O)(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 544846528 UOAZOAUIFBMNSZ-QMMMGPOBSA-N 287.301 -0.487 5 20 CBBD COCCN(CCC(=O)OC)c1ncc([N+](=O)[O-])c(N)n1 751257978 IIYNIGLGJAESQE-UHFFFAOYSA-N 299.287 -0.017 5 20 CBBD Cc1cc(=O)n(CC(=O)NCCC(=O)O)cc1[N+](=O)[O-] 832857802 ACHGBAVPZYOJMD-UHFFFAOYSA-N 283.240 -0.344 5 20 CBBD C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839686136 LEVBBTKQBUVKIH-FNCVBFRFSA-N 276.314 -0.314 5 20 CBBD COC(=O)[C@@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843065200 KEPWPBNNIROSSD-GHMZBOCLSA-N 284.268 -0.248 5 20 CBBD CN1CCN(C(=O)CNc2ccnc(O)c2[N+](=O)[O-])CC1 853264563 IETBCYPIYAMLBD-UHFFFAOYSA-N 295.299 -0.119 5 20 CBBD CON1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 854855803 GJYVNYRKQSTQIF-UHFFFAOYSA-N 255.234 -0.363 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ccnc(O)c1[N+](=O)[O-] 1100706087 MQBPLQYRAZFBIC-UHFFFAOYSA-N 297.271 -0.877 5 20 CBBD C[C@H](CN1CCN(C)CC1)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1339549780 SLYJKHVLRRZHOE-SECBINFHSA-N 296.331 -0.316 5 20 CBBD O=[N+]([O-])c1cnn(-c2cncc(-c3nn[nH]n3)n2)c1 1593487801 QTTYOWPCMIWXOX-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD NC(=O)COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 28292201 NETLFBGRGANIOV-UHFFFAOYSA-N 281.224 -0.647 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 48731294 HNDDREPJDULSHM-SSDOTTSWSA-N 270.245 -0.141 5 20 CBBD COC(=O)c1cc(C(=O)N[C@@H](C)C(N)=O)cc([N+](=O)[O-])c1 53324705 FOJSEXJVQPDFCV-LURJTMIESA-N 295.251 -0.015 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H](CN)C1 122626775 GDJKYSXFBVFFFU-MRVPVSSYSA-N 267.289 -0.362 5 20 CBBD NC(=O)COCCNC(=O)Cc1cccc([N+](=O)[O-])c1 269563887 ZMJAZPNJZWZDPH-UHFFFAOYSA-N 281.268 -0.245 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 282106843 FGSKYYFQQGNMLX-MRVPVSSYSA-N 281.272 -0.520 5 20 CBBD COC(=O)c1cc(C)nc(NC[C@@H](O)C(N)=O)c1[N+](=O)[O-] 289819270 ZXJPTYCOQNBCMH-SSDOTTSWSA-N 298.255 -0.657 5 20 CBBD Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@H](O)[C@@H](O)C1 331299729 QHGNZMIMMVTQKW-QWRGUYRKSA-N 295.295 -0.121 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](O)C1CC1 331415933 CFXHZDFIZYWRNB-VIFPVBQESA-N 268.273 -0.013 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H](O)[C@@H]1CCOC1 346418491 KQDLCWJWTLHCRS-XCBNKYQSSA-N 296.283 -0.102 5 20 CBBD COC(=O)[C@H]1C[C@H](OC)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352959113 UOYLRMMTCFOWIN-POYBYMJQSA-N 298.255 -0.280 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)c1cc([N+](=O)[O-])nn1C 356164077 ZDBBYAGZUFIZEU-SECBINFHSA-N 297.315 -0.221 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H]1C 373563099 TTWQCUCQWFPLNQ-FNCVBFRFSA-N 256.258 -0.081 5 20 CBBD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCCO 494823252 PXMIKGKYVIHPGA-MRVPVSSYSA-N 285.304 -0.064 5 20 CBBD Nc1nccc(C(=O)NCCN2CC[C@H](O)C2)c1[N+](=O)[O-] 600809189 VUJQKXASNJTUGU-QMMMGPOBSA-N 295.299 -0.632 5 20 CBBD CCOC(=O)CN(C)C(=O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840673081 HNDVZSXZFNJZLQ-HTQZYQBOSA-N 288.256 -0.784 5 20 CBBD CCOCCN1CC(OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 842339093 UYWBTZUOOQDERN-NXEZZACHSA-N 258.274 -0.085 5 20 CBBD CCN(CC)S(=O)(=O)CC(=O)OCCC[N+](=O)[O-] 860920884 IWPNWSRVCIELTI-UHFFFAOYSA-N 282.318 -0.132 5 20 CBBD C[C@H](O)CN1CCN(c2c([N+](=O)[O-])cnn2C)CC1 892316747 WHFPLSYTIJPFRJ-VIFPVBQESA-N 269.305 -0.169 5 20 CBBD CN(C)CCNC(=O)C1CCN(CC[N+](=O)[O-])CC1 929952987 KVFSHRDQKXLFQS-UHFFFAOYSA-N 272.349 -0.347 5 20 CBBD Cn1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1022063577 DRVKBLDHJLXFBM-WRWGMCAJSA-N 293.327 -0.178 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CN)C1 1118141221 VBGCFTXDOLEITJ-ZETCQYMHSA-N 253.262 -0.251 5 20 CBBD CNC(=O)NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 6901671 KYHGDNZAWXHJIP-UHFFFAOYSA-N 255.234 -0.136 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 49864776 QSOKEDNYPZTKJT-ZETCQYMHSA-N 269.213 -0.152 5 20 CBBD C[C@H](CO)NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 129212770 PYURSOFWJGKWGF-MRVPVSSYSA-N 281.268 -0.178 5 20 CBBD CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 159239390 GBPRJSNBRSSNIZ-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD C[C@H]1C(=O)NCCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 189297775 RBPBYAPPYNFTEC-ONGXEEELSA-N 297.315 -0.637 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 227050765 GTYVPDHYNJCARK-JTQLQIEISA-N 282.252 -0.213 5 20 CBBD CC[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 271011001 ZTRCZUQHSIEYRD-JLLWLGSASA-N 284.316 -0.145 5 20 CBBD CN(CCOCCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 337487390 JHHCGEQRHZFULV-NSHDSACASA-N 288.304 -0.907 5 20 CBBD CN(CCO)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 340037124 YHHHIAHBGDWACL-UHFFFAOYSA-N 256.262 -0.023 5 20 CBBD CN(C)c1n[nH]c(NC(=O)c2cc([N+](=O)[O-])nn2C)n1 340845366 ZQIXIFAXHPBEPG-UHFFFAOYSA-N 280.248 -0.235 5 20 CBBD CN(CC(N)=O)C(=O)c1cccc([N+](=O)[O-])c1N 344933131 FPOZAEKWTPPSLL-UHFFFAOYSA-N 252.230 -0.266 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NCc3nc(O)n[nH]3)nn12 347853479 AOGPZDIKFHBVEV-UHFFFAOYSA-N 276.216 0.073 5 20 CBBD COCCN1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1 564188811 PUQHZCLKJOXOKF-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD O=C(O)[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CCO1 582304014 WRBYFRNYZAWLEG-SSDOTTSWSA-N 293.239 -0.073 5 20 CBBD CCN(CC(=O)N(C)C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 610367555 XTZDWGPYJNRLSP-LLVKDONJSA-N 299.331 -0.438 5 20 CBBD Nc1nc(N2CCN(CCCCO)CC2)ncc1[N+](=O)[O-] 741748968 LIKZFTPEBVXSGH-UHFFFAOYSA-N 296.331 -0.139 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1c([N+](=O)[O-])cnn1C 783753290 DPPNSQBGVAVVJO-SSDOTTSWSA-N 281.272 -0.369 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1C[C@H](C)OC1=O 808202537 NYYAQSIBQGGBFW-POYBYMJQSA-N 282.256 -0.080 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1OC 816328948 ZUHFASDHJSIQGX-SECBINFHSA-N 297.267 -0.560 5 20 CBBD CC1(C)COC(=O)[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 816583906 WQJMYUIOSGNTQY-ZETCQYMHSA-N 268.229 -0.001 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)c1ccn2nnnc2c1 851046748 RVVTVBSNNBVCPG-LURJTMIESA-N 251.202 -0.054 5 20 CBBD NC(=O)CC(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 1055746678 AQBJUFBHXALMHU-UHFFFAOYSA-N 293.283 -0.486 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N(C)CCCNC(=O)C(N)=O 1095718983 KRBSZKTXFNHLNK-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD NC(=O)NC1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1319067476 ZZIDPYOXRWAJJN-UHFFFAOYSA-N 296.287 -0.549 5 20 CBBD CNC[C@@H]1CCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1326584297 VOQJFHDOAJATLD-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD CNC[C@@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1346014052 JZCMXPWAURWLHN-SECBINFHSA-N 282.300 -0.272 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)[C@H]1C 104892712 ATBUAPXFGRVPJH-SSDOTTSWSA-N 281.272 -0.553 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1O 249602981 YWLVQTFFFGLTPC-JLLWLGSASA-N 284.316 -0.145 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CN2C[C@H](O)[C@@H](O)C2)c1 278799883 OOPSMFZSQKKHHL-WOPDTQHZSA-N 268.269 -0.334 5 20 CBBD CS(=O)(=O)C1CN(c2ncc([N+](=O)[O-])cn2)C1 337949076 UZRPFMAJKBTZHI-UHFFFAOYSA-N 258.259 -0.382 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 579789174 NIIYKDXXTOHWKI-UHFFFAOYSA-N 255.234 -0.522 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 592934652 ZJOSRKZUTXCLMO-RNFRBKRXSA-N 298.255 -0.686 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](C(=O)O)O1 593756162 XURODYDIXYLASG-IYSWYEEDSA-N 283.244 -0.355 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1nnc(O)o1 595546298 CRBXDZJMERJZTG-UHFFFAOYSA-N 295.255 -0.023 5 20 CBBD O=C(CO)N1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596180445 SSUDEERYQYDDQS-UHFFFAOYSA-N 282.256 -0.664 5 20 CBBD C[C@@H](CC(N)=O)Nc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 820232128 DRGTZXNETOTEHE-YFKPBYRVSA-N 292.259 -0.154 5 20 CBBD Cn1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1020138848 DRVKBLDHJLXFBM-DDHJBXDOSA-N 293.327 -0.178 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2cnsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022063414 BHKXQWGKWLPLCY-BKFJMODKSA-N 297.340 -0.060 5 20 CBBD CN(C(=O)C(N)=O)C1CN(Cc2ccc([N+](=O)[O-])cc2)C1 1043715013 SAYLMJCACFNKDH-UHFFFAOYSA-N 292.295 -0.277 5 20 CBBD CN1CCN(CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1116420283 RLRFDCKDVWHNJW-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD Cc1nnsc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936264 DGCNKOJGTSGTJT-HTQZYQBOSA-N 285.329 -0.282 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCCN 1326289325 RLMINRQZBOHBNC-UHFFFAOYSA-N 255.278 -0.045 5 20 CBBD NC1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 1327073325 SYEXDNPRDYORPF-UHFFFAOYSA-N 280.284 -0.294 5 20 CBBD Cn1nccc1[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)O 1574472549 NAWSUTHZZBAKHT-NJUXHZRNSA-N 268.229 -0.673 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N[C@H]1CNOC1 1580788470 DHFAQRBEORHSOK-LURJTMIESA-N 253.218 -0.563 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN[C@@H]3C[C@@H]32)nc1 1580876073 ZSVLWUOPANIHGD-BDAKNGLRSA-N 284.297 -0.275 5 20 CBBD O=C(O)C1(O)CN(c2ncc([N+](=O)[O-])cc2F)C1 1608578963 BUEKLQVWLSDTHQ-UHFFFAOYSA-N 257.177 -0.235 5 20 CBBD CC(=O)N1CC(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 188598563 PCDPLPGRPRTTJS-UHFFFAOYSA-N 281.272 -0.614 5 20 CBBD CCN(CC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 189717706 ASSXXIOTRLSDRG-UHFFFAOYSA-N 255.234 -0.875 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@H](O)C2)n1 236616223 KTHKNKLUHNYFLE-OCAPTIKFSA-N 269.213 -0.770 5 20 CBBD NC[C@H]1CCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 238011120 RYCKLWLQTNQDIC-RKDXNWHRSA-N 282.304 -0.180 5 20 CBBD Cc1cc(NCC(=O)NCCO)ncc1[N+](=O)[O-] 268306980 ITQVHPNBQLOFFM-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD CNC(=O)N[C@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 341530845 MFXBFBGQPHYMKO-ZETCQYMHSA-N 266.261 -0.108 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CCOCCO)c1=O 357670257 ZVJGJSVMULTOKN-UHFFFAOYSA-N 286.240 -0.448 5 20 CBBD COC(=O)C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 363332453 YCWLEPIALSQAEF-IWSPIJDZSA-N 272.257 -0.558 5 20 CBBD NCCNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1 428736453 HNWRXCWFCQAQEX-QMMMGPOBSA-N 296.283 -0.133 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-] 443040941 WQBHJKIQBRTZGH-CAHLUQPWSA-N 281.272 -0.119 5 20 CBBD O=C(O)c1ccnc(N2C[C@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 592978906 JBBVRZAAPNSRNO-RNFRBKRXSA-N 283.240 -0.380 5 20 CBBD C[C@@H](CO)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599243620 HDAFEHJVIVHDAD-ZCFIWIBFSA-N 278.290 -0.765 5 20 CBBD O=C(c1cc2c(cc1[N+](=O)[O-])OCO2)N1C[C@H](O)[C@@H](O)C1 600217084 OFKNXIMTIOKXQE-IUCAKERBSA-N 296.235 -0.499 5 20 CBBD CCN(C)S(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])n1C 744239581 UAIOJFVVAXHQNO-UHFFFAOYSA-N 290.301 -0.140 5 20 CBBD CNC[C@@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 843078598 QUMMENGPWZDQSM-VXGBXAGGSA-N 269.301 -0.202 5 20 CBBD C[C@@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)COC(=O)N1 860993554 HVKSGNCJFMBDCL-SNVBAGLBSA-N 284.228 -0.167 5 20 CBBD CCn1nncc1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1118898139 UMLNJPIRISKXFT-LLVKDONJSA-N 295.303 -0.447 5 20 CBBD C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H]1O 1319946704 DNWKXHSGELIWHD-XPUUQOCRSA-N 254.246 -0.219 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)NCC1CC1 1592937827 PIEJFNIWASOZAH-UHFFFAOYSA-N 292.259 -0.502 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CC(C(=O)O)C2)n1 1604018008 PJJKMKVPXWRFJM-UHFFFAOYSA-N 268.229 -0.032 5 20 CBBD CC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 49446427 YQQDWSGMJHVCKH-UHFFFAOYSA-N 269.261 -0.648 5 20 CBBD CC(C)[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 157646649 BLBHQOFUHVMYCE-VIFPVBQESA-N 256.262 -0.076 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1c1c([N+](=O)[O-])ncn1C 168541775 GJAHVOIIFZQIMQ-SFYZADRCSA-N 256.262 -0.086 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 269113316 YARPCSHVZIKQMM-MRVPVSSYSA-N 298.303 -0.385 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])CCN1 296378119 HNQYLBCZDTUAKB-QMMMGPOBSA-N 268.248 -0.003 5 20 CBBD CNC(=O)C1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 331764719 KCBCIYCNXYGPED-UHFFFAOYSA-N 295.299 -0.269 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC1(CCO)CC1 349224311 NUDOFDCDOJYCBC-UHFFFAOYSA-N 254.246 -0.027 5 20 CBBD CN1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 351157841 AGDQDKQLJUOMLV-SECBINFHSA-N 293.283 -0.077 5 20 CBBD Cc1nccn1CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 386388678 SYHXQEOTHJRMSB-LBPRGKRZSA-N 294.315 -0.053 5 20 CBBD NC[C@@H]1CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 429184486 BQCIJSPHEHAHPP-YUMQZZPRSA-N 268.277 -0.570 5 20 CBBD C[C@@H]1CNCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 432514615 MXDZAUNEORSXCK-RKDXNWHRSA-N 267.289 -0.095 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[C@@H](OCCO)C1 549739613 DSZMZYJEVBZNCF-MRVPVSSYSA-N 284.272 -0.069 5 20 CBBD CCCNC(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 563905413 JZOJQLPPQUQZHV-UHFFFAOYSA-N 295.299 0.288 5 20 CBBD CN(C(=O)c1ccnc(N)c1[N+](=O)[O-])C1CC(O)C1 581141461 VNWLEUAFBFBIGS-UHFFFAOYSA-N 266.257 0.167 5 20 CBBD NC(=O)C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 588855907 REWLTSJYZWOHFY-LURJTMIESA-N 266.261 -0.331 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(c2ccc(N)c([N+](=O)[O-])n2)C1 596289360 OSYSVCNFPWHZPT-SFYZADRCSA-N 296.283 -0.068 5 20 CBBD COC[C@@H](OC)C(=O)NCCn1cc([N+](=O)[O-])cn1 597411394 XJTVVLMXFQZLFB-SECBINFHSA-N 272.261 -0.431 5 20 CBBD C[C@@H](C(=O)NC[C@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1F 597584350 FSBPWHKPUJNTNO-LDWIPMOCSA-N 299.258 -0.200 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CCN(C)C(=O)C2)c1[N+](=O)[O-] 619444582 DMHDOAAIIWTZRD-SSDOTTSWSA-N 281.272 -0.023 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCC1(CO)COC1 763680357 YLDYBOUJFLHBNE-UHFFFAOYSA-N 298.251 -0.691 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NOCCO 787282984 NCEVPPWMOMPMDP-UHFFFAOYSA-N 283.240 -0.635 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1COC(=O)C1 820073393 GQIGIKCWIRPARN-LURJTMIESA-N 254.202 -0.777 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329411737 GWFFYYOINCUEIL-LURJTMIESA-N 267.245 -0.345 5 20 CBBD O=C(NCCCn1cncn1)c1c[nH]nc1[N+](=O)[O-] 1329640367 WKJBPFVJMWCUEH-UHFFFAOYSA-N 265.233 -0.271 5 20 CBBD C[C@@H](C(=O)O)[C@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1603190564 VXFJRWMJVXOERB-XZBKPIIZSA-N 294.285 -0.793 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)COCC(=O)O 1610615740 ULWNNEZVKDOFEO-UHFFFAOYSA-N 258.190 -0.632 5 20 CBBD O=[N+]([O-])c1cnc(N[C@@H]2CCS(=O)(=O)C2)nc1 40454413 WCWALNFVMSZBOG-ZCFIWIBFSA-N 258.259 -0.016 5 20 CBBD CN(C)C(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 44867182 MRVDNUZHIUFTIY-UHFFFAOYSA-N 269.261 -0.662 5 20 CBBD COc1ncccc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 48247781 YWJIDMQQXLXAPG-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD CC(=O)N[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 79295441 BAYVMBNKFZPSQY-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CCC(=O)NC1 264153713 SPMRPAJLCMPMIX-LURJTMIESA-N 279.256 -0.221 5 20 CBBD COC(=O)N[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 270462154 APMHHYZRCPNGSG-ZETCQYMHSA-N 285.260 -0.348 5 20 CBBD O=C(NC[C@H](CO)[C@@H]1CCOC1)c1cc([N+](=O)[O-])[nH]n1 285878765 IKWKZSPNDDBYJV-HTQZYQBOSA-N 284.272 -0.307 5 20 CBBD COC(=O)c1cc(C)nc(N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 287539597 BNINZUDERHETDE-IUCAKERBSA-N 297.267 -0.373 5 20 CBBD C[C@@H](O)CN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@H](C)CO 289216879 VQMUYDFBALSWMC-RNFRBKRXSA-N 272.261 -0.478 5 20 CBBD CC(C)(O)[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330545962 PJGHTDUYHKDVQA-MRVPVSSYSA-N 283.288 -0.052 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCCNC1=O 330561950 IRVSVWMJCSAZLR-QMMMGPOBSA-N 267.245 -0.814 5 20 CBBD NC(=O)CN(CC(N)=O)C(=O)c1cc(F)cc([N+](=O)[O-])c1 354492963 MYAOLVCKIIQFSY-UHFFFAOYSA-N 298.230 -0.853 5 20 CBBD NC[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 358139322 RDTAUQWMYSKMML-SNVBAGLBSA-N 255.278 -0.549 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@H](CN)C2)c1[N+](=O)[O-] 358510774 MENRVFNOKLZRSM-ZETCQYMHSA-N 269.261 -0.574 5 20 CBBD Cc1nc(CCNC(=O)CCn2cc([N+](=O)[O-])cn2)n[nH]1 358607396 KKWHHRIMUCFFCQ-UHFFFAOYSA-N 293.287 -0.033 5 20 CBBD CNC(=O)OCCOC(=O)Cn1cc([N+](=O)[O-])cn1 495840752 LMDYQVRVNYZMAK-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD CO[C@@H]1COC[C@@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 570155591 NUJXGPKCNNQGCL-GARJFASQSA-N 286.288 -0.844 5 20 CBBD Cc1nn(C)c(N2CC[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 583476688 RZJCKVMRMQVCKP-IUCAKERBSA-N 270.289 -0.184 5 20 CBBD Cc1cc(OCC(=O)NC[C@@H](O)C(N)=O)ccc1[N+](=O)[O-] 597586877 RLVUONSDEIZDEG-SNVBAGLBSA-N 297.267 -0.756 5 20 CBBD Nc1nc(=NCCC2CS(=O)(=O)C2)[nH]cc1[N+](=O)[O-] 615718906 LFNRHZXKCHFOKW-UHFFFAOYSA-N 287.301 -0.765 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1C[C@@H](O)C1 720983300 ZTNBQBKKOHBIIM-OCAPTIKFSA-N 254.246 -0.322 5 20 CBBD C[S@@](=O)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 742300524 WOEVKOPDEOQACF-QGZVFWFLSA-N 293.326 -0.353 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1N1CC[C@H](CO)C1 823620023 GPQLTGCQBWFFBO-ZETCQYMHSA-N 291.271 -0.012 5 20 CBBD COC(=O)[C@@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 848119977 VFHQMGSBBRQFEB-GMTAPVOTSA-N 293.279 -0.053 5 20 CBBD CCS(=O)(=O)NC1CCN(CC[N+](=O)[O-])CC1 903012515 PUGZNCXXAQEEGB-UHFFFAOYSA-N 265.335 -0.333 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCCN(CCCO)CC1 981138123 LCNSPPVERUNYIM-GHMZBOCLSA-N 271.317 -0.432 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2F)C1 1059393985 VPDOEFHJNAOASR-IZLXSQMJSA-N 297.246 -0.327 5 20 CBBD Cc1cnc(NCCNC(=O)CNC(N)=O)c([N+](=O)[O-])c1 1093500637 FESLPFJOSXDRHU-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN1CCn1cc([N+](=O)[O-])ccc1=O 1601771883 HZWKYPQHUFIMEN-UWVGGRQHSA-N 297.267 -0.724 5 20 CBBD O=C(O)CCCONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1601994734 FYSWTBMJPSIBRV-UHFFFAOYSA-N 299.239 -0.331 5 20 CBBD CC[C@@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 133429283 SYSNYXRTHUZPPT-MWLCHTKSSA-N 285.304 -0.604 5 20 CBBD COC[C@@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)OC 234690500 CVKGAJNIZCEQDG-GHMZBOCLSA-N 288.304 -0.597 5 20 CBBD C[C@H]1CN[C@H](C)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 237442322 ACUVQDZZCZTGAN-ZJUUUORDSA-N 294.311 -0.035 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H](C)O 274729572 CLIRSRPYLUEOIM-QUBYGPBYSA-N 298.251 -0.047 5 20 CBBD C[C@H](O)CN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@H](C)CO 289216880 VQMUYDFBALSWMC-RQJHMYQMSA-N 272.261 -0.478 5 20 CBBD COC(=O)[C@@H]1C[C@H](OC)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 352959115 UOYLRMMTCFOWIN-XPUUQOCRSA-N 298.255 -0.280 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2nnnn2C)c1=O 356778566 HIVGAJOGSMRGGW-UHFFFAOYSA-N 294.227 -0.885 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]2C(N)=O)n1 427470046 FDRSWMINWBNJHZ-ZETCQYMHSA-N 281.272 -0.099 5 20 CBBD CC(C)(CO)C(=O)NCCn1cc([N+](=O)[O-])cn1 521639367 FFDUECAVSYRTCH-UHFFFAOYSA-N 256.262 -0.074 5 20 CBBD CNc1nccc(C(=O)NCC(=O)OC)c1[N+](=O)[O-] 566431045 DJFSYRKUULUXAD-UHFFFAOYSA-N 268.229 -0.066 5 20 CBBD CC(C)(C(=O)NC[C@H]1CNCCO1)n1cc([N+](=O)[O-])cn1 574311715 CGYGDMVPQMPYIF-SNVBAGLBSA-N 297.315 -0.369 5 20 CBBD NC(=O)NC(=O)CCCn1cc([N+](=O)[O-])cc(F)c1=O 576637160 WWWSZRYLOSWDQI-UHFFFAOYSA-N 286.219 -0.129 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2nccn2C)C1 1042704986 FQNANBZOQVYAGJ-GHMZBOCLSA-N 293.327 -0.272 5 20 CBBD CC1(C(=O)N2CC(O)(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 1042980923 DWNSSRBTKPODHG-RKDXNWHRSA-N 297.311 -0.859 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCN([C@H]3CCNC3)CC2)n1 1326583649 KJCIVEAJCPAXGQ-LBPRGKRZSA-N 294.359 -0.229 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1ncccn1 1336709446 WJUGCXLWAAFIMJ-UHFFFAOYSA-N 289.251 -0.137 5 20 CBBD O=C(O)[C@@H]1COCCN1c1ncc([N+](=O)[O-])cn1 88377539 GFKOVKCUZBVIOS-ZETCQYMHSA-N 254.202 -0.325 5 20 CBBD COCCN(CCO)C(=O)Cn1ccc([N+](=O)[O-])n1 164187080 HDZDEBGUUNFIQL-UHFFFAOYSA-N 272.261 -0.741 5 20 CBBD CN(C)C(=O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 177923419 PSUXDNLFPYTCGD-UHFFFAOYSA-N 298.303 -0.431 5 20 CBBD CCCNC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 194526538 KEWGCCRDPUOILH-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCNC1CC1 237576275 BSIHGBYSXBKZFY-UHFFFAOYSA-N 267.289 -0.032 5 20 CBBD NC(=O)c1cncc(NCCn2cc([N+](=O)[O-])cn2)n1 301700697 DFSXWCYYXKSJRM-UHFFFAOYSA-N 277.244 -0.208 5 20 CBBD COCCN(C)C[C@@H](O)Cn1cnc([N+](=O)[O-])n1 311139450 KXRPMMZATPXZJH-MRVPVSSYSA-N 259.266 -0.875 5 20 CBBD CCN(CCOC)C(=O)Cn1cnc([N+](=O)[O-])n1 339648855 DMPXTMUKSJXRAY-UHFFFAOYSA-N 257.250 -0.319 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2COC[C@@H]2O)n1 342403406 FNWNBPUWESCTPX-IUCAKERBSA-N 284.272 -0.357 5 20 CBBD C[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N1CCOCC1 342820688 KHUGOIDOBHGIIU-SSDOTTSWSA-N 296.287 -0.374 5 20 CBBD O=C(N[C@H]1CCCCNC1=O)c1n[nH]cc1[N+](=O)[O-] 343097460 IKARPUYPASQLKF-LURJTMIESA-N 267.245 -0.284 5 20 CBBD COC(=O)Cn1cc(CNc2ncc([N+](=O)[O-])cn2)nn1 354564586 AJWPJCKFEDXDHB-UHFFFAOYSA-N 293.243 -0.239 5 20 CBBD C[C@H]1C(=O)N(C)CCN1Cc1c([N+](=O)[O-])ncn1C 426158463 CNZFLXBVVMVSPO-QMMMGPOBSA-N 267.289 -0.009 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 548928311 VSSCDNYCBCYOKY-YFKPBYRVSA-N 255.234 -0.428 5 20 CBBD CN(C)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H]1O 574820588 ORXBYWLVFTWDNN-UWVGGRQHSA-N 269.305 -0.602 5 20 CBBD Cc1nn(C)c(N2CC[C@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 583476689 RZJCKVMRMQVCKP-RKDXNWHRSA-N 270.289 -0.184 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 592934651 ZJOSRKZUTXCLMO-NKWVEPMBSA-N 298.255 -0.686 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 600836773 BVRXCADHLLVINE-ZETCQYMHSA-N 299.239 -0.651 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 763707697 LCYQJJCPGZMGPF-SECBINFHSA-N 282.256 -0.986 5 20 CBBD CC1(C)COC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 846652786 UOQBKFVBWIFJNK-ZETCQYMHSA-N 268.229 -0.001 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@H]1CC(=O)N(c2cnn(C)c2)C1 860787391 KXOFESNLBDSJSX-IUCAKERBSA-N 296.283 -0.019 5 20 CBBD O=C(N[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 979736555 DSIQTOFQMLVONH-WCTZXXKLSA-N 291.254 -0.072 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](CN)C1 1118139028 ACMUBEKQDBSBMQ-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD C[S@](=O)CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1262199758 YPXIRRCBHYNDEA-KRWDZBQOSA-N 260.275 -0.184 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 1344393979 UTNKDBVQCOPWRI-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](O)C[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 1610404464 UCDJFPGXARPCRH-RNFRBKRXSA-N 298.255 -0.466 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CCOCC1 131766965 IFMOXSOUHSSKKM-UHFFFAOYSA-N 298.255 -0.459 5 20 CBBD CS(=O)(=O)NCCn1cc(Cl)cc([N+](=O)[O-])c1=O 158646686 KRHAFMSQGQVSAF-UHFFFAOYSA-N 295.704 -0.041 5 20 CBBD CNC(=O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 170901121 UZQNGLWKQSPSNX-UHFFFAOYSA-N 266.257 -0.039 5 20 CBBD C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](CO)O1 191870294 GRCBINWFKFDXNU-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD O=C1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CN1 230655695 PRTCFZDNBMBQFP-ZETCQYMHSA-N 265.225 -0.081 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC[C@@H]1CCNC1 262598100 WAGRWRYGPGAUQX-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD COC(=O)[C@@H](C)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 281221095 OMJKRCWHDLWEAZ-MRVPVSSYSA-N 297.267 -0.224 5 20 CBBD Cn1nnc(Cn2cc(Cl)cc([N+](=O)[O-])c2=O)n1 281539466 XCNFCTRREAEJKJ-UHFFFAOYSA-N 270.636 -0.018 5 20 CBBD CC(=O)N1CC(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 331942463 HQLZFYPSSOLUCR-UHFFFAOYSA-N 295.299 -0.127 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[S@](=O)C1 350867741 NHGJZYJFUZOOHE-PVDFSEMESA-N 284.297 -0.177 5 20 CBBD CNC(=O)CNC(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 351137926 CXJZMBSKZZGZIF-UHFFFAOYSA-N 298.230 -0.465 5 20 CBBD NS(=O)(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 352559350 HRUDOTVUSYRNGB-UHFFFAOYSA-N 273.270 -0.007 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 371047860 FRFNVXMUFHMERJ-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC1=O 518178519 YOCILKLKBQDNGG-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD C[C@@H](NS(=O)(=O)c1ncccc1[N+](=O)[O-])C(N)=O 594741775 GFBHQIYXPFJRGB-RXMQYKEDSA-N 274.258 -0.858 5 20 CBBD Cn1cc(C(=O)COC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 741324062 YYAGTTGPCZTENG-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD Cn1cc(C(=O)OCCn2cc([N+](=O)[O-])ccc2=O)nn1 808661642 WIJUFTSOWGSZKH-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD COC(=O)N(C)CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 855943843 FIOVJRIDROVIOU-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1C[C@@H](C(=O)O)C1 1118492254 IFUCSKBVQGZUSL-NGZCFLSTSA-N 298.299 -0.053 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H](OCCO)C1 1320537396 ALQPIXDFQOZYGL-VIFPVBQESA-N 298.299 -0.058 5 20 CBBD COc1cnc(N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)nc1 1323721883 RDMYRHRFCQMZTL-UHFFFAOYSA-N 293.243 -0.352 5 20 CBBD NCC[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332449491 GDTJNUYXBRUWNG-VIFPVBQESA-N 282.304 -0.226 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC(O)(C(=O)O)C1 1600720683 TYXIPGSEDSUBEB-UHFFFAOYSA-N 298.255 -0.852 5 20 CBBD O=C(N[C@H]1CCO[C@H]1C(=O)O)c1cc([N+](=O)[O-])n[nH]1 1601569973 HJNHVRLVRCAZRH-MHTLYPKNSA-N 270.201 -0.710 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N[C@H](CO)C(=O)O 37451231 WANIRFPXAKAOFM-SSDOTTSWSA-N 284.224 -0.465 5 20 CBBD CCOCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 48244637 PVSTYUXXZOYEBU-UHFFFAOYSA-N 257.250 -0.271 5 20 CBBD CO[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)O 227274782 QEORYVQUIPFEPS-MRVPVSSYSA-N 271.229 -0.237 5 20 CBBD NC(=O)CC(=O)NCCNc1ccccc1[N+](=O)[O-] 265809431 LXKZOVZPEHGMJQ-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](C)O 276235448 NRJKBKBZEPMLLJ-LDWIPMOCSA-N 297.267 -0.171 5 20 CBBD CN(C)CC[C@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 352119219 CTUHLPMZTBNEKS-NSHDSACASA-N 285.304 -0.250 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CCC(N)=O)c1=O 354267378 ULPMVTQJTMDAQY-UHFFFAOYSA-N 269.213 -0.582 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)OC 359488506 YKKUKFSKCUXYHM-LURJTMIESA-N 286.244 -0.754 5 20 CBBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1C[C@H](O)C[C@@H]1CO 368201057 MREAXHRFDKPDHI-RKDXNWHRSA-N 282.252 -0.132 5 20 CBBD CN1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2O)C(=O)N1 393958475 ZMOKBIQVLRJGNI-SSDOTTSWSA-N 280.240 -0.625 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(=O)N(CC2CC2)C1 516847173 CNGMYISAHWEDIB-UHFFFAOYSA-N 293.283 -0.020 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)C[C@H]1CN 563101643 KEQTVOSKDVQDGS-SNVBAGLBSA-N 296.331 -0.799 5 20 CBBD CC(=O)N1CC(Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1 565225007 BCCCDCOYJIUPEC-UHFFFAOYSA-N 279.256 -0.269 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 592306040 AETYQTSJRNNJKM-GMSGAONNSA-N 296.283 -0.116 5 20 CBBD O=C(NC1[C@H]2CNC[C@H]12)c1cc([N+](=O)[O-])cnc1O 592338486 WEUQRGPIDULIGG-YUMQZZPRSA-N 264.241 -0.357 5 20 CBBD CN1C[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CC1=O 748120146 SSLADFQSBAIVJO-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD CCNC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])n1C 761057445 XRCJJHZOTIETDE-UHFFFAOYSA-N 298.255 -0.064 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 783753637 BMTHJRWSJFCTGD-LURJTMIESA-N 267.245 -0.379 5 20 CBBD CON(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])n1C 817660040 DHPVGPPBKMELRW-UHFFFAOYSA-N 270.245 -0.317 5 20 CBBD CCOCCONC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 819239566 MSGSPIBPHJVVHW-SNVBAGLBSA-N 274.277 -0.290 5 20 CBBD O=C(O)C[C@@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 833222855 DAKDIKQSRYOQBU-ZETCQYMHSA-N 297.227 -0.814 5 20 CBBD CN(C)C[C@H](CO)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 854467336 FFXUPLLWXLPPOK-PWSUYJOCSA-N 297.311 -0.333 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1OCCCO1 1116727885 HFEMDXJAMLZVIN-UHFFFAOYSA-N 270.245 -0.179 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NC(CO)CO 1320112037 DZPJDAVVJFBXGW-UHFFFAOYSA-N 269.257 -0.281 5 20 CBBD CN[C@H](C)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 1326582876 UOBOGTABIPQJNI-SSDOTTSWSA-N 256.266 -0.700 5 20 CBBD CN(C)C(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 1329015548 AFCLUMROTCNMBU-UHFFFAOYSA-N 267.245 -0.610 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1341460186 MSICMEDGYPTFOS-LLVKDONJSA-N 285.304 -0.629 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCN[C@H]3C[C@H]32)n1 1579970215 RXYHLEXMNDDBGP-NKWVEPMBSA-N 287.301 -0.937 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C1CC1 1590986428 XEWSZHRIGVLFKO-UHFFFAOYSA-N 292.259 -0.408 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)c1nn(C)cc1[N+](=O)[O-] 263341945 XVJYXOKJXQGCRQ-RXMQYKEDSA-N 256.218 -0.127 5 20 CBBD COC(=O)C(C)(C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299472592 CJICDJMXSHANHD-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD CN(CCNS(C)(=O)=O)c1ncccc1[N+](=O)[O-] 301265740 IFKLXAHNIJXMAD-UHFFFAOYSA-N 274.302 -0.025 5 20 CBBD Nc1c(C(=O)NCCc2nc(=O)o[nH]2)cccc1[N+](=O)[O-] 392143168 GHEAYKHHTQIVDY-UHFFFAOYSA-N 293.239 -0.174 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 412427512 OSTJXJFQPNLYBB-HTRCEHHLSA-N 298.251 -0.205 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 425093482 SHPQVUDOPFFKIH-YFKPBYRVSA-N 281.228 -0.805 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 425097365 YHFWHRFZYMCURB-QMMMGPOBSA-N 295.255 -0.945 5 20 CBBD O=C1C[C@H](NCCO)C(=O)N1c1cccc([N+](=O)[O-])c1 570859721 FPUMAARBZLHSCZ-JTQLQIEISA-N 279.252 -0.191 5 20 CBBD CNc1nccc(C(=O)N(C)C(C)(C)C(N)=O)c1[N+](=O)[O-] 594365317 GLFUGLDXUYSWRW-UHFFFAOYSA-N 295.299 0.367 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 597654559 UJLDWSBYAUBWHB-SECBINFHSA-N 283.284 -0.047 5 20 CBBD COC(=O)COCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 600395126 FIKSJHHOSPVLES-UHFFFAOYSA-N 272.217 -0.763 5 20 CBBD NC(=O)N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 779428399 CEHYURFIXGJOPT-UHFFFAOYSA-N 267.249 -0.832 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCOC(=O)CS(C)(=O)=O 920117236 XRLOAUDHOMWVFY-UHFFFAOYSA-N 291.285 -0.312 5 20 CBBD C[C@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C)N1 923285899 HNSUHFXORFMARU-JFGNBEQYSA-N 283.332 -0.166 5 20 CBBD Cc1nc(NCCN(C)C(=O)C(N)=O)ccc1[N+](=O)[O-] 1101935037 BCJRHWXPGWICFC-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD CC1=NO[C@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261744191 XZEZUGOHAXTBMJ-ZETCQYMHSA-N 268.233 -0.533 5 20 CBBD Cn1nncc1C[S@](=O)CCn1cc([N+](=O)[O-])cn1 1325940663 PTNHCDDVLDZBBK-LJQANCHMSA-N 284.301 -0.131 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1601763471 IBECQUXTADMSRJ-WDSKDSINSA-N 284.228 -0.775 5 20 CBBD C[C@@H](CNS(=O)(=O)c1ncccc1[N+](=O)[O-])C(=O)O 1603193332 IVTSFUBQURCKFB-LURJTMIESA-N 289.269 -0.011 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccn(CC(=O)O)n2)n1 1605501081 CPWHKDNDXIADTH-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCOC1 41367349 RYTPLHRTAGEDDZ-QMMMGPOBSA-N 254.246 -0.056 5 20 CBBD COCCCNC(=O)CN(C)CCn1ccc([N+](=O)[O-])n1 176218645 LCDGCTMMPPOENZ-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD COCCN(C)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 344278948 YSVBTGUZYPVYOE-UHFFFAOYSA-N 299.331 -0.055 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCCC1 359815413 UPMRLVZOBOCDFH-UHFFFAOYSA-N 293.283 -0.076 5 20 CBBD CC[C@]1(O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 495194071 NNGSRXUOCYYIJJ-RYUDHWBXSA-N 284.316 -0.001 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](CO)[C@@H](O)C2)n1 581491450 TYHLFBNFAIHMGM-XVKPBYJWSA-N 297.267 -0.133 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 600462783 ZGLZNXUSSFIUNZ-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 811835035 LWFCIHOHUZFPRY-SSDOTTSWSA-N 293.283 -0.244 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC(C)(C)C(=O)O 1320895289 RXZZFIICQGLMBH-UHFFFAOYSA-N 256.218 -0.079 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](C)C(=O)NCCF)c1[N+](=O)[O-] 1325190385 SHSKGMKFVTZNRK-LURJTMIESA-N 287.251 -0.170 5 20 CBBD NC(=O)CC1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 1326892576 RHCVGTAITAMDKO-UHFFFAOYSA-N 280.240 -0.357 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H](O)C(=O)O 1574751356 NKZZUPCSDVNAGH-ZETCQYMHSA-N 286.244 -0.948 5 20 CBBD CN(CC(=O)O)c1ccc([N+](=O)[O-])cc1S(N)(=O)=O 1604121586 NHZIZFJHBZIVEG-UHFFFAOYSA-N 289.269 -0.237 5 20 CBBD CC(C)(C)NC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603028 LYRJJJWBISDZLW-UHFFFAOYSA-N 270.249 -0.189 5 20 CBBD NC(=O)[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75618500 JOPJPZIPFSHDCK-NXEZZACHSA-N 283.288 -0.898 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C)N1 154087205 JDYBFYGBYUACHU-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD O=C1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])CCN1 162346832 NHGGVYRJEANYEW-UHFFFAOYSA-N 266.213 -0.376 5 20 CBBD O=C(Cn1cnnn1)NCCc1ccccc1[N+](=O)[O-] 266003114 AACLOBFZBZLLQI-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD Cc1nn(C)c(NC[C@H]2CC(C(N)=O)=NO2)c1[N+](=O)[O-] 276352819 YCUSSLJTBHLZNV-ZCFIWIBFSA-N 282.260 -0.321 5 20 CBBD Cn1nncc1CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 344415443 IEZALDQAFHMZDE-UHFFFAOYSA-N 277.244 -0.138 5 20 CBBD COC(=O)[C@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 348110128 MCWPNERSTDSAST-NSHDSACASA-N 284.272 -0.287 5 20 CBBD C[C@@H]1C(=O)NCCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 351766952 SQJKYSHLGSTJBZ-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD CCOC(=O)c1ccnc(N(C)C[C@@H](O)CO)c1[N+](=O)[O-] 355742983 NLCRVXLGIUFWMK-MRVPVSSYSA-N 299.283 -0.044 5 20 CBBD CC(C)(C(=O)NCCC(N)=O)n1cc([N+](=O)[O-])cn1 359702058 XHVWZFIQCYYJFK-UHFFFAOYSA-N 269.261 -0.482 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1CO 360853720 JVFSDVDUGJBCPW-IUCAKERBSA-N 268.273 -0.122 5 20 CBBD COC(=O)[C@](C)(O)CNc1c([N+](=O)[O-])ncn1C 361674831 UAIIWWGZHGVOSF-SECBINFHSA-N 258.234 -0.336 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H]1O 573653701 RQLIIXHWGOLERK-UWVGGRQHSA-N 268.273 -0.330 5 20 CBBD CN(C)C(=O)CSc1ncc([N+](=O)[O-])c(N)n1 578906648 QRSOHTAHLOBOMC-UHFFFAOYSA-N 257.275 0.147 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 590369430 GHODHUCSHZUOOP-QMMMGPOBSA-N 270.289 -0.414 5 20 CBBD O=C(O)CN1CC[C@H](n2cnc([N+](=O)[O-])c2)C1=O 596011135 DEZATSDUWPHABN-LURJTMIESA-N 254.202 -0.351 5 20 CBBD NC(=O)c1cc(N[C@@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 596184687 UALOUKZNEVRXMA-ZETCQYMHSA-N 264.241 -0.006 5 20 CBBD Nc1ccc(NC[C@H]2CCCNC2=O)nc1[N+](=O)[O-] 596270243 XMBDGSCHDRTIEK-SSDOTTSWSA-N 265.273 0.510 5 20 CBBD C[C@H](CO)CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 599243619 HDAFEHJVIVHDAD-LURJTMIESA-N 278.290 -0.765 5 20 CBBD Nc1nc(N2CCC(N)(CO)CC2)ncc1[N+](=O)[O-] 733895830 NCSJRKOUJRJOST-UHFFFAOYSA-N 268.277 -0.743 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 779541516 MSQAUZQESVAJGF-UHFFFAOYSA-N 281.228 -0.528 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C(=O)O)C2)n1 821298673 WFUXMBKTCRLAMW-LURJTMIESA-N 268.229 -0.125 5 20 CBBD CN(CCNc1ccc([N+](=O)[O-])cc1)C(=O)C(N)=O 1101944803 NOXUQWSBLKHKCF-UHFFFAOYSA-N 266.257 -0.050 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N(C)CCN(C)C(=O)C(N)=O)n1 1105544049 YPORYDHKKBBQFX-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD C[C@H](O)CCN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345311 OUABCBOHYZUETO-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD COC[C@H](CO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1261211086 JJIZQUJBTLAPHI-ZETCQYMHSA-N 272.261 -0.626 5 20 CBBD CC(=O)OC[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 1320905891 KOPGTUJIYYVRNH-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)NC2CC2)c1[N+](=O)[O-] 1322153196 UVYZYDNXBFXPPX-UHFFFAOYSA-N 267.245 -0.365 5 20 CBBD Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)o1 1340948752 NMMFKEMLTKPTNN-UHFFFAOYSA-N 252.190 -0.061 5 20 CBBD CO[C@@H]1CNC[C@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 1579123745 RUBHJZFTGKXHSO-HTRCEHHLSA-N 269.261 -0.955 5 20 CBBD CNS(=O)(=O)CCn1nc(C)c([N+](=O)[O-])c1C 24700752 XKJGEVIPZNEPTN-UHFFFAOYSA-N 262.291 -0.043 5 20 CBBD COC(=O)[C@@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75716177 LMMJMIXODWYVBG-QWRGUYRKSA-N 298.299 -0.210 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])cn1)[C@H](C)C(N)=O 174851706 RZSQDZPFDQGBGZ-SECBINFHSA-N 285.304 -0.387 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NCCn1cc([N+](=O)[O-])cn1 193570186 PIXGFPIMSZSDMY-WCBMZHEXSA-N 267.289 -0.095 5 20 CBBD NC(=O)COCCNC(=O)c1cccc([N+](=O)[O-])c1O 227047492 BZXARGMIZQLHSN-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)O1 268287387 CPSJPPHAKGIITE-IYSWYEEDSA-N 282.260 -0.588 5 20 CBBD CCN(CCOCCO)C(=O)Cn1cc([N+](=O)[O-])cn1 282646502 XMGJKXCOOIBKNO-UHFFFAOYSA-N 286.288 -0.351 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285035821 PIBMRIYTINWUGN-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD CCc1[nH]nc(C(=O)N2CCO[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 345875974 YRSIXYFNEVFIFN-SSDOTTSWSA-N 297.271 -0.793 5 20 CBBD COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])cnc1N 351726359 DHWHUXMQRMQVIG-ZETCQYMHSA-N 284.272 -0.301 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 519619968 XCVNUJQBLHWFHU-LURJTMIESA-N 280.240 -0.580 5 20 CBBD C[C@@H](O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 536634487 AJTPYJLAEBQNBA-ZCFIWIBFSA-N 261.259 -0.351 5 20 CBBD COC(=O)C[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 547752191 KESDWVJIMLFKHU-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD CC(C)(CNC(=O)c1ccnc(N)c1[N+](=O)[O-])OCCO 566462014 LKFZHVJWHGTBRU-UHFFFAOYSA-N 298.299 0.089 5 20 CBBD NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCC1 586800351 FWFHASJWJJXZHF-UHFFFAOYSA-N 253.218 -0.544 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 588866124 AHXYJRDJERFGMX-VIFPVBQESA-N 283.284 -0.047 5 20 CBBD CCc1[nH]nc(C(=O)N2CCOCCN2)c1[N+](=O)[O-] 597707508 MOPWIVBLOPASTO-UHFFFAOYSA-N 269.261 -0.143 5 20 CBBD O=C(NCCn1ccnn1)c1cnc(O)c([N+](=O)[O-])c1 618393318 KTIAKQRTPYNYHV-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD Cc1cc(NC(=O)CN2CCN(CC[N+](=O)[O-])CC2)no1 791053156 IQEBDSUUVCOQCJ-UHFFFAOYSA-N 297.315 -0.184 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)CCCN1C(=O)CNC1=O 814040742 KPAOTIBTOHNAKX-SSDOTTSWSA-N 273.245 -0.473 5 20 CBBD CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1OC 839724771 CSHPZMLPAYNRSM-ZOZBQHSOSA-N 258.274 -0.040 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1ncc([N+](=O)[O-])n1 863374939 GQEIIEMTEHCXDW-LURJTMIESA-N 286.248 -0.953 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC(N2CCOCC2)C1 894365031 XIIIWVXZZLOYSL-UHFFFAOYSA-N 267.289 -0.151 5 20 CBBD NS(=O)(=O)CCn1cc([N+](=O)[O-])cc(F)c1=O 1119599681 KHKNFAKEVTUAME-UHFFFAOYSA-N 265.222 -0.816 5 20 CBBD CCc1noc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126938913 MUTXDWUORQUXSL-HTQZYQBOSA-N 283.288 -0.497 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC(n2cncn2)C1 1321049385 SXZYYIPVRDVZPQ-UHFFFAOYSA-N 289.255 -0.139 5 20 CBBD N[C@@H](CO)Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 1326919749 XGYKMEIYSJSAPP-SSDOTTSWSA-N 264.245 -0.567 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1c[nH]nc1[N+](=O)[O-] 1340015690 FBYNRPMZSNOYTI-IUCAKERBSA-N 295.299 -0.089 5 20 CBBD NC(=O)C[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 1342950619 HUMOCJYRKUUCJU-SECBINFHSA-N 267.289 -0.011 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1ccncn1 1346865610 FSNQVWQHZWZFCS-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD O=C(O)CCCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 1574700253 LDBZONOAQXGAHS-UHFFFAOYSA-N 285.260 -0.053 5 20 CBBD CC[C@@H](CO)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590448002 HPWBGFMYJAUGAR-YFKPBYRVSA-N 253.222 -0.085 5 20 CBBD O=C(O)c1cn(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nn1 1602501099 NSKUBJFCHRVWAZ-HTRCEHHLSA-N 281.228 -0.975 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1C[C@H]1C(=O)O 1608380519 OJOSOZZPWQIJHM-PHDIDXHHSA-N 269.217 -0.977 5 20 CBBD O=C(O)c1cnc(N[C@H]2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 1608978872 WQKDKWCBCRXVRQ-VJKWBMGZSA-N 283.240 -0.016 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NC(CO)CO 87750949 MSJMWNYZGBLSTI-UHFFFAOYSA-N 270.241 -0.557 5 20 CBBD CC[C@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 134393127 XPJKEZZCBWIREF-KOLCDFICSA-N 272.305 -0.097 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C(F)(F)F 225112960 MIGABYXXWDUOLU-ZCFIWIBFSA-N 282.178 -0.169 5 20 CBBD CNC(=O)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 270906535 PKAOWVVMMKKOBJ-UHFFFAOYSA-N 282.260 -0.585 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285411754 UXHVYKYFOCGUCH-VIFPVBQESA-N 281.272 -0.086 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])[nH]n1)[C@H]1CC(=O)NC1=O 286090960 UETUUNQMNAUWNZ-LURJTMIESA-N 281.228 -0.805 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1=O 330860709 PMYOUVKALARDGZ-SSDOTTSWSA-N 252.230 -0.117 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@H]3C(=O)NC[C@@H]32)c1[N+](=O)[O-] 337155579 UVJSDUTUASXKFH-SFYZADRCSA-N 293.283 -0.023 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC(O)(C2CC2)C1 365280716 PCABCISCZSTXNV-UHFFFAOYSA-N 252.230 -0.085 5 20 CBBD CN1C[C@@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)OC1=O 496599428 INJXZMQEOKSWKG-ZETCQYMHSA-N 284.228 -0.215 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2CC[C@H](CO)[C@H](O)C2)n1 581491447 TYHLFBNFAIHMGM-GMSGAONNSA-N 297.267 -0.133 5 20 CBBD CNC(=O)CN(C)c1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 821632905 OEAGRSXSKZFMNT-UHFFFAOYSA-N 291.271 -0.043 5 20 CBBD CN(CCN1CCOCC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839631925 OHFUZPBFULVFLE-NXEZZACHSA-N 257.290 -0.558 5 20 CBBD C[C@H](N)CN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 858643002 UCGDIPFKNMCNFL-ZETCQYMHSA-N 274.302 -0.043 5 20 CBBD O=C(NC1CN(C(=O)CC(F)(F)F)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280480 QZTZHFLWFXFLGB-RNFRBKRXSA-N 295.217 -0.069 5 20 CBBD Cn1cnnc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020138961 JTZFROUGVMXKCD-ZYUZMQFOSA-N 294.315 -0.783 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCc1cnccn1 1116479560 FHCOBRCCHKYQCM-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD CC(C)n1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1126936859 VDKUSJLMVBCCTM-GHMZBOCLSA-N 296.331 -0.270 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ncnn1C 1338899450 LBVOPYUUBAKROX-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2CCNC[C@@H]2C1 1358274400 KMOAFMVWXUXNGY-VHSXEESVSA-N 279.300 -0.141 5 20 CBBD CCN(CC(=O)O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1605414973 JTLFSLTXRQTOSB-UHFFFAOYSA-N 283.240 -0.310 5 20 CBBD O=C(Cn1cnnn1)NCCNc1ccccc1[N+](=O)[O-] 8146226 AIRXNNCUODBCML-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD CCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 65836560 GPAZGAYZNRLODI-UHFFFAOYSA-N 269.261 -0.648 5 20 CBBD C[C@H](O)CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)CO 190836884 DXRGRXIZCHQSOF-QWRGUYRKSA-N 299.327 -0.180 5 20 CBBD CCc1nn(C)c(NCCS(=O)(=O)NC)c1[N+](=O)[O-] 231005307 CCXVQSMDAGMCGL-UHFFFAOYSA-N 291.333 -0.148 5 20 CBBD C[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H]1CN 237509103 QLCQBBMJVAMBQO-RKDXNWHRSA-N 282.304 -0.228 5 20 CBBD C[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H]1CN 237509134 QLCQBBMJVAMBQO-BDAKNGLRSA-N 282.304 -0.228 5 20 CBBD CC(C)COC[C@H](O)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 341815340 WXHIKAXXABULLY-MRVPVSSYSA-N 285.304 -0.166 5 20 CBBD CN(Cc1nnnn1C)c1cccc(C(N)=O)c1[N+](=O)[O-] 342589013 XZJSKWDCZOGUBS-UHFFFAOYSA-N 291.271 -0.146 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)N2CCC2)c1 352123069 JHWKDNSVXPKBQP-UHFFFAOYSA-N 275.290 -0.669 5 20 CBBD Nc1nc(N2CC[C@H](n3cncn3)C2)ncc1[N+](=O)[O-] 363785082 XKJZNYNJRBJLJD-ZETCQYMHSA-N 276.260 0.010 5 20 CBBD Cn1cc([C@H](CO)NCCn2cc([N+](=O)[O-])cn2)cn1 494810280 RKJIHHWOMQWNFF-NSHDSACASA-N 280.288 -0.152 5 20 CBBD COC[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])OC 549189776 ATBGYYUERRFTOP-LURJTMIESA-N 258.234 -0.291 5 20 CBBD COCC1(O)CN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C1 598629174 YQHKVJUEWPSVDJ-UHFFFAOYSA-N 297.267 -0.026 5 20 CBBD COC(=O)COCCNC(=O)Cn1cc([N+](=O)[O-])cn1 600404545 XEEZOSZRUJSIEG-UHFFFAOYSA-N 286.244 -0.903 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CN2C[C@H](O)[C@H](O)C2)cc1 776588675 AJOVJWJPFDTTKD-UTUOFQBUSA-N 268.269 -0.334 5 20 CBBD CCn1ncn(NC(=O)c2cc([N+](=O)[O-])ccc2N)c1=O 820392144 UWMPZBLEVJIGJE-UHFFFAOYSA-N 292.255 -0.061 5 20 CBBD CN1C[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 825576136 XORNCICUUGBXGU-CABZTGNLSA-N 293.279 -0.025 5 20 CBBD CN(CC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 828108134 LXLCXMNWSZYHMC-UHFFFAOYSA-N 271.233 -0.483 5 20 CBBD COC(=O)[C@@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 895095317 IHUNXOKSRCOYTR-PRJMDXOYSA-N 274.298 -0.231 5 20 CBBD C[C@@H]1NC(=O)[C@H](C)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1C 911805513 AQFWTKGSNGSMMR-KVEIKIFDSA-N 255.274 -0.225 5 20 CBBD CN(C1CCN(CC[N+](=O)[O-])CC1)S(C)(=O)=O 929892989 BERYVUUUCPAQBU-UHFFFAOYSA-N 265.335 -0.381 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N(C)CCNC(=O)C(N)=O 1100294833 RFLLEVRKVCGEMI-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD CNC(=O)[C@@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 1326503822 WDZAYSNVSMJLRD-MNOVXSKESA-N 283.284 -0.675 5 20 CBBD CC1(C)CN(C(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1343187141 WSPYATHVGLMVJW-UHFFFAOYSA-N 295.299 -0.224 5 20 CBBD O=[N+]([O-])Cc1nnc(N2CCOCC2)n1C[C@@H]1CCOC1 1346829856 OQKGBUYOVMIWFB-JTQLQIEISA-N 297.315 -0.072 5 20 CBBD CN1CC[C@@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C 1350999878 FQKHZQJXLNGVTI-SSDOTTSWSA-N 253.262 -0.238 5 20 CBBD Cn1cncc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592590347 XWDHWFSDDOLTIB-UHFFFAOYSA-N 275.232 -0.247 5 20 CBBD O=C(O)Cc1noc(Cn2ccc(=O)c([N+](=O)[O-])c2)n1 1595139976 KOMZZUOZFKJINN-UHFFFAOYSA-N 280.196 -0.185 5 20 CBBD O=C(O)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 37435132 QPWLEQQJVJETHT-MRVPVSSYSA-N 268.229 -0.133 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@@H](CN)C1 122584574 JHMFFUWMRHHEBO-QMMMGPOBSA-N 268.273 -0.097 5 20 CBBD O=C(NCc1n[nH]c(=O)[nH]1)c1cccc([N+](=O)[O-])c1O 156055687 HUZNBHKAMXZGQU-UHFFFAOYSA-N 279.212 -0.358 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)N1CCNC1=O 294227953 OAEKAWUQHAQWBG-UHFFFAOYSA-N 280.240 -0.383 5 20 CBBD CS(=O)(=O)CCNc1ncc([N+](=O)[O-])cc1C(N)=O 299038161 BYOMUIRMRNONKP-UHFFFAOYSA-N 288.285 -0.455 5 20 CBBD CN1CCO[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)C[C@H]21 331755625 HOZBFMHIENUTSA-NEPJUHHUSA-N 281.316 -0.194 5 20 CBBD Nc1nc(N2CCC(NCCO)CC2)ncc1[N+](=O)[O-] 342244763 GNFFQNGZQLLESX-UHFFFAOYSA-N 282.304 -0.482 5 20 CBBD O=C1CCCC(=O)N1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 342457071 UBOGUSOAMVCVHO-VIFPVBQESA-N 282.256 -0.309 5 20 CBBD CCCN1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 343402853 MPQKFJJHYRBZRU-UHFFFAOYSA-N 282.304 -0.260 5 20 CBBD CCN(C[C@@H](C)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 352233368 YDVRWVYYOVPLSP-MWLCHTKSSA-N 272.305 -0.145 5 20 CBBD CCCc1[nH]nc(C(=O)NCCOCC(N)=O)c1[N+](=O)[O-] 353180648 IBJAMKXDDJRZQR-UHFFFAOYSA-N 299.287 -0.498 5 20 CBBD CN(C)c1noc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 356406342 LFLWYVAAIFGLTH-UHFFFAOYSA-N 295.259 -0.443 5 20 CBBD O=c1scnn1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 424145964 ZZOIWCCCDUKAEY-ZETCQYMHSA-N 271.258 -0.529 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 444340033 IOYNCMDDOJRGAW-YFKPBYRVSA-N 267.245 -0.501 5 20 CBBD C[C@H]1OC(=O)N[C@@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 496988704 YSUDCFBOZCSIPK-SVRRBLITSA-N 284.228 -0.169 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(N2CC[C@@H](O)C2)C1 593855989 SSGZOJQJTNYRMD-LLVKDONJSA-N 295.299 -0.931 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 600318359 MTQXRHFTFXKSPG-YFKPBYRVSA-N 256.218 -0.049 5 20 CBBD C[C@@H]1C(=O)NCCN1c1ccc2ncc([N+](=O)[O-])n2n1 611370812 RNHXLTHDPJDARP-SSDOTTSWSA-N 276.256 -0.038 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)NC(N)=O 761052195 BMOVUECCWDUSBU-YFKPBYRVSA-N 284.228 -0.327 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H](CCO)C2CC2)c1 763060453 UMCGJSLDDLGMCE-RYUDHWBXSA-N 284.316 -0.097 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 821510488 HRRBONFGJCHTFW-MRVPVSSYSA-N 295.251 -0.310 5 20 CBBD CN(C(=O)c1cnon1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 955088459 KFGRVDIBNUCTCY-VXNVDRBHSA-N 295.255 -0.982 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cccnc1 990071443 NPVDWXSRKSXUOC-GHMZBOCLSA-N 290.279 -0.313 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnnn2C)C1 1042704927 CCPJZAYJHSUQNJ-GHMZBOCLSA-N 294.315 -0.877 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CO)[C@@H](O)C1 1116789015 VOKOFTISOSADOI-CBAPKCEASA-N 284.272 -0.856 5 20 CBBD C[C@@H](CS(C)(=O)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116854503 IJRCYXQZKMPUSA-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1C[C@@H]2C[C@]2(CO)C1 1116942197 KNAIGJBLWSNEQD-QUBYGPBYSA-N 252.230 -0.228 5 20 CBBD O=[N+]([O-])c1c(NC[C@@H](O)Cn2ccnn2)ccnc1O 1118596892 SJOHAGDOTBBNTH-SSDOTTSWSA-N 280.244 -0.240 5 20 CBBD CN(CC(N)=O)c1cc(N)c([N+](=O)[O-])c(-c2nn[nH]n2)c1 1591044099 HUKRERMPSNFQTL-UHFFFAOYSA-N 292.259 -0.721 5 20 CBBD COC[C@@](C)(CC(=O)O)NC(=O)c1cc([N+](=O)[O-])n[nH]1 1599147004 BYUHSBWIEBPMAI-SNVBAGLBSA-N 286.244 -0.073 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 112669686 OGBIEJGGVUEBMS-VIFPVBQESA-N 283.240 -0.063 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC(=O)NC1 230688672 JFDBDSVUVQSDTP-ZCFIWIBFSA-N 279.256 -0.420 5 20 CBBD CCOC(=O)COCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 295569211 AXJHXGABBHNOII-UHFFFAOYSA-N 286.244 -0.373 5 20 CBBD CCn1cc(S(=O)(=O)NCC[C@H](C)O)c([N+](=O)[O-])n1 339049637 UCVNIAPJYQGFMC-ZETCQYMHSA-N 292.317 -0.140 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1[C@@H]2CNC[C@@H]12 366599683 OFEZKWGBFROZDT-HTQZYQBOSA-N 251.246 -0.875 5 20 CBBD O=C(NCCn1ccccc1=O)c1c[nH]nc1[N+](=O)[O-] 549183012 HGADBAUYBQGHPY-UHFFFAOYSA-N 277.240 -0.090 5 20 CBBD CN1C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 554857425 NCLUEUGIZZTOQE-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD COC[C@H]1C[C@@H](O)CN1c1ncc([N+](=O)[O-])cn1 593498092 TXQXKNOZSVYPTO-VXNVDRBHSA-N 254.246 -0.029 5 20 CBBD Cc1cccc([N+](=O)[O-])c1NC(=O)CNC(CO)CO 594001862 BLJHQBCRMOFTAM-UHFFFAOYSA-N 283.284 -0.215 5 20 CBBD C[C@H](O)C(=O)N1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596179569 XBCMSYLSCCEXMM-QMMMGPOBSA-N 296.283 -0.275 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 787166931 GLZHOXHNIIKASF-SECBINFHSA-N 282.256 -0.593 5 20 CBBD COC[C@H]1CCCN1NC(=O)Cn1cnc([N+](=O)[O-])n1 862602262 HGSJNTQUFPAGOX-MRVPVSSYSA-N 284.276 -0.672 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1O 863945470 FRUQUPZWZUJSRE-ZCFIWIBFSA-N 298.255 -0.167 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CNCCO1 1326141228 HLHGWVHTKNUZOY-VIFPVBQESA-N 283.288 -0.796 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CCNC1 1349152280 IGRUJLUATREIHG-ZETCQYMHSA-N 253.262 -0.238 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCOCCN 1579868181 ADLLHUNJVHRICV-UHFFFAOYSA-N 285.304 -0.467 5 20 CBBD CC[C@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1589524847 GMSHFWLPHKRLOC-MRVPVSSYSA-N 297.267 -0.017 5 20 CBBD Cc1cnc(NCCS(N)(=O)=O)c([N+](=O)[O-])c1 90692020 ZYXKHVCSUXTMQW-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD CN1C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CCC1=O 133639657 AUKSOXAOQJESEM-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CNC(=O)CCN(C)CCn1cc([N+](=O)[O-])cn1 174844146 ZKJQXLVYGWPWCM-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD NC(=O)[C@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 228681511 IUXRARSVPVCQJO-NXEZZACHSA-N 269.257 -0.936 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](CO)O1 302785267 VFHUDOMCKMINLT-BQBZGAKWSA-N 269.261 -0.447 5 20 CBBD CC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])n2C)C1 346492563 QFPWLLLAXKLYQK-UHFFFAOYSA-N 266.257 -0.106 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])c1)NCCCN1CCCC1=O 350340400 DLLGOVPDRWIQFL-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 350478085 MSTWVNWFTWUGDU-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356486984 VWTNQJYLRUAVKN-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)Cn1cnc([N+](=O)[O-])n1 357904351 CNLZXFHMAFVZPE-SECBINFHSA-N 298.303 -0.977 5 20 CBBD Cc1nn(C)c(N2CC[C@H](S(N)(=O)=O)C2)c1[N+](=O)[O-] 358904109 QCEPQDAWQXIAII-ZETCQYMHSA-N 289.317 -0.496 5 20 CBBD CC1(C)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](CO)O1 421931683 IOLDOQSLQIVZDJ-ZETCQYMHSA-N 284.272 -0.070 5 20 CBBD CCCN(CC(N)=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 429180424 XZTOQLUODGPZSO-JTQLQIEISA-N 285.304 -0.651 5 20 CBBD Cn1c(C(=O)NC[C@@H]2CN3CCN2CC3)ccc1[N+](=O)[O-] 437306107 LNRYXOMRMRWFBF-SNVBAGLBSA-N 293.327 -0.337 5 20 CBBD O=C1CC[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C(=O)N1 444969587 XCTJOQMECMHJGC-ZCFIWIBFSA-N 294.223 -0.770 5 20 CBBD CC[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 548082345 XSKLZQIOMYFDNH-LURJTMIESA-N 254.246 0.073 5 20 CBBD COC(=O)C[C@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 599161983 DPVGOGVMNPBABR-ZETCQYMHSA-N 298.255 -0.575 5 20 CBBD CNC(=O)CC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 776282566 AECXYYVYFACSPF-UHFFFAOYSA-N 295.251 -0.127 5 20 CBBD Cc1cc(C(=O)N[C@@H](CO)C(N)=O)c(N)c([N+](=O)[O-])c1 804355951 RUUKKKKCWZZGNG-ZETCQYMHSA-N 282.256 -0.939 5 20 CBBD C[C@H](CN1CCOCC1)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840673635 WMDYBGVTMYQINJ-OPRDCNLKSA-N 258.274 -0.085 5 20 CBBD O=C(NS(=O)(=O)C[C@@H]1CCCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 842299739 SILATKHOZBUWJS-DJLDLDEBSA-N 292.313 -0.333 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CC(=O)N(C)C[C@H]1C 1263019972 DGXPSJKVDBODSB-MRVPVSSYSA-N 282.304 -0.258 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1nnc([C@H](C)[N+](=O)[O-])n1C 1350589436 UXSUSBZPUHFPLL-YUMQZZPRSA-N 282.304 -0.180 5 20 CBBD C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C(=O)O)O1 1599928738 WBTYPPJKZOBZAE-IUCAKERBSA-N 284.272 -0.035 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](C(=O)O)[C@@H](C)O 1600748332 MEYRYDLFPDJSBG-ANLVUFKYSA-N 286.244 -0.950 5 20 CBBD Cc1nc(N2CC[C@](O)(C(=O)O)C2)ncc1[N+](=O)[O-] 1777509330 CMYLKHCZCAFXCN-SNVBAGLBSA-N 268.229 -0.281 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[C@H](O)C1 35187304 IRLJPFPVPGAKCW-QMMMGPOBSA-N 267.241 -0.120 5 20 CBBD Cn1c(C(=O)NCc2nc[nH]n2)ccc1[N+](=O)[O-] 37921099 CCRLQJLKFVLIGJ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C(C)(C)C1=O 154882338 DTBCZTVAJHCGDH-UHFFFAOYSA-N 295.299 -0.130 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1nnn[nH]1 230870037 UHBGXRUGPNGJLG-UHFFFAOYSA-N 264.205 -0.985 5 20 CBBD NC[C@H]1CCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 237982186 RYCKLWLQTNQDIC-BDAKNGLRSA-N 282.304 -0.180 5 20 CBBD N[C@@H]1CC[C@@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 248586074 GDIMCROPUZEUFC-DVVUODLYSA-N 279.300 -0.013 5 20 CBBD COC(=O)[C@@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 267798288 KNRPTDIRFSLSKP-JTQLQIEISA-N 284.272 -0.335 5 20 CBBD CCN(CCOCCO)c1ncc([N+](=O)[O-])c(N)n1 336924763 KHCSRRZEZSGGQU-UHFFFAOYSA-N 271.277 -0.198 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1[C@@H]2CNC[C@@H]12 368645798 HOGRRBGSGGIPBA-RNFRBKRXSA-N 251.246 -0.875 5 20 CBBD Cc1nn(C)c(C(=O)OC[C@@H]2CNC(=O)O2)c1[N+](=O)[O-] 495717265 NSEIDHLRKKLPFG-LURJTMIESA-N 284.228 -0.098 5 20 CBBD CNc1ccc(C(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 532567395 RHSSWMCDDJBASD-UHFFFAOYSA-N 296.283 -0.525 5 20 CBBD CNc1nccc(C(=O)N[C@@H](C)C(N)=O)c1[N+](=O)[O-] 573337257 KUCLKEZHOWKFOZ-YFKPBYRVSA-N 267.245 -0.365 5 20 CBBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)NC1CNC1 583312544 SMBKKHGKNGHAMC-UHFFFAOYSA-N 292.295 -0.359 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CN(C)CCO1 586799497 KKQNCYACKQSVNC-CBAPKCEASA-N 283.288 -0.233 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 592910769 LORFNGZRMHGDRB-YUMQZZPRSA-N 297.267 -0.081 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2cccnc2[N+](=O)[O-])C1 609564214 WOMRCRJAHAPQSR-ZETCQYMHSA-N 272.286 -0.143 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@](O)(C(=O)O)C1 706461199 WRHVYYJLDIKKNK-NSHDSACASA-N 284.272 -0.379 5 20 CBBD CN(C)CCN(C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839772266 AZKXOHCCSGVCLH-VXGBXAGGSA-N 286.376 -0.007 5 20 CBBD COC[C@@H](NC(=O)Cc1ccc(F)cc1[N+](=O)[O-])C(N)=O 844449147 DUXWWZVITZHZEO-SECBINFHSA-N 299.258 -0.107 5 20 CBBD CON1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1 853671830 JSGDCSQPHUCULH-UHFFFAOYSA-N 281.272 -0.228 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H]2C[C@H]1C(=O)O2 861871246 HWUKTYUSPBHISW-SFYZADRCSA-N 280.240 -0.374 5 20 CBBD O=C(NC1CN(C(=O)C2=COCCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991281451 UCZOHZXZHMUVFZ-GHMZBOCLSA-N 295.295 -0.327 5 20 CBBD CC(=O)NCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1115931873 GHRPZRMLEPZGSF-UHFFFAOYSA-N 255.234 -0.508 5 20 CBBD CNC(=O)CN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1320107947 HQTRZFWQUGMAJV-UHFFFAOYSA-N 269.261 -0.545 5 20 CBBD COC[C@@](C)(NC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 1322598336 AZUOOKYTLFRVOI-SNVBAGLBSA-N 286.244 -0.452 5 20 CBBD N[C@H](CO)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 1574263093 ULTCBHNQUKBSMF-GFCCVEGCSA-N 294.311 -0.437 5 20 CBBD CNC[C@@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N 1578647956 WVBSGXPBFPCLSC-SECBINFHSA-N 282.300 -0.171 5 20 CBBD Nc1nccc(C(=O)NCCC(=O)O)c1[N+](=O)[O-] 1594664856 BWUGZCJKKUXEET-UHFFFAOYSA-N 254.202 -0.224 5 20 CBBD O=C(O)C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 1608689697 JWIVACHBKRSQDM-SSDOTTSWSA-N 296.239 -0.662 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccccc1[N+](=O)[O-] 40218737 OTIURTJPVRSBSB-UHFFFAOYSA-N 273.270 -0.387 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 167607041 XEUKUJDIKUMIPV-SCZZXKLOSA-N 284.272 -0.601 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1CCn1ccc([N+](=O)[O-])n1 189565131 CLINGQDELMIGSP-MWLCHTKSSA-N 298.299 -0.210 5 20 CBBD Cc1c(C(=O)NC[C@@H](O)C(N)=O)cccc1[N+](=O)[O-] 227865334 BVTOKVNQEZBCIP-SECBINFHSA-N 267.241 -0.521 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(=O)O 262572338 CUGUVVQNDWGAIY-SSDOTTSWSA-N 295.251 -0.086 5 20 CBBD C[C@H](O)CCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266512030 BMQQXPAEODFRPC-ONGXEEELSA-N 272.305 -0.145 5 20 CBBD COc1ccc(CNC(=O)NC(CO)CO)cc1[N+](=O)[O-] 266701913 GQACJOWJVBGOQO-UHFFFAOYSA-N 299.283 -0.244 5 20 CBBD Cc1cc(OCC(=O)N[C@@H](CO)C(N)=O)ccc1[N+](=O)[O-] 286425842 POSSWDGEDIFKID-VIFPVBQESA-N 297.267 -0.756 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 353976715 SBLBFOWMPSHCKO-MRVPVSSYSA-N 298.255 -0.774 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](CO)O1 355077734 ZLWHMEMKCGGGQY-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CN(CCN)C[C@H](O)CO 595901114 AAVSOOWSPNARAK-LBPRGKRZSA-N 299.327 -0.283 5 20 CBBD CN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 598294005 NNSSIBRGAUZAFT-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CNC(=O)C1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCCC1 751240759 WNKHRBJOVOHIAL-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OCC(=O)N1CCC1 781667212 JLVVJXTYEDXEKO-UHFFFAOYSA-N 280.240 -0.039 5 20 CBBD C[C@H](O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 791793222 IQXFYXHBMPLMPW-ZETCQYMHSA-N 256.214 -0.320 5 20 CBBD CON1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 818026910 OIIBIFGSSLLMBP-UHFFFAOYSA-N 269.261 -0.503 5 20 CBBD COCC(=O)N(C)CCCNc1ncc([N+](=O)[O-])c(N)n1 1109354695 QLMGJHGIOJNDSR-UHFFFAOYSA-N 298.303 -0.126 5 20 CBBD CC(C)(CNC(=O)Cn1cnc([N+](=O)[O-])n1)OCCO 1327716568 DUEDNNSSMOWZEL-UHFFFAOYSA-N 287.276 -0.910 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1574059759 FKCHNCKLDULCJU-RXMQYKEDSA-N 275.242 -0.259 5 20 CBBD NC1=CCN(c2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])N1 1581905962 GXCXZSAFQPZCHU-UHFFFAOYSA-N 274.244 -0.100 5 20 CBBD C[C@H](CC(=O)O)NC(=O)NCCn1cc([N+](=O)[O-])cn1 1589001249 INFAQTPMXIIQST-SSDOTTSWSA-N 285.260 -0.046 5 20 CBBD O=[N+]([O-])c1cc(N(CCO)CCO)ccc1-c1nn[nH]n1 1593472180 XDGMGBQSOPOQRO-UHFFFAOYSA-N 294.271 -0.434 5 20 CBBD C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C(=O)O)O1 1599860375 FRYLCTMTKRAONP-XUTVFYLZSA-N 258.230 -0.648 5 20 CBBD O=C(O)c1cc(C(=O)N[C@@H]2COC[C@H]2O)cc([N+](=O)[O-])c1 1602247063 IQYYUZVLIFBJPR-NXEZZACHSA-N 296.235 -0.218 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1C[C@@H](O)C[C@@H](C(=O)O)C1 1608159406 QSMVLVIPCHDPNU-RQJHMYQMSA-N 270.245 -0.400 5 20 CBBD O=C1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CN1 1609587200 IPHFAIMCFAQZFM-RXMQYKEDSA-N 290.243 -0.530 5 20 CBBD CC(C)NC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 44954913 QAIHAJQYRQXCDV-UHFFFAOYSA-N 270.245 -0.141 5 20 CBBD COC(=O)C(C)(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 48225004 SKZZGSKUGCGATQ-UHFFFAOYSA-N 271.233 -0.746 5 20 CBBD CCNC(=O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75642595 ILWUCBVTSOWPLN-SNVBAGLBSA-N 285.304 -0.780 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cc(F)ccc1[N+](=O)[O-] 90261396 SDSPJVNFTTXUFV-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD Cc1nn(CC(=O)N[C@@H](C)C(=O)N(C)C)cc1[N+](=O)[O-] 181822960 OUSYSCATJPGODD-QMMMGPOBSA-N 283.288 -0.307 5 20 CBBD N[C@@H]1CC[C@H]2CN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]12 185130939 GDIMCROPUZEUFC-JMJZKYOTSA-N 279.300 -0.013 5 20 CBBD CN(CC(=O)N[C@@H]1COC[C@H]1O)c1ccccc1[N+](=O)[O-] 297011504 QZYSQJSLYJVRDM-BXKDBHETSA-N 295.295 -0.093 5 20 CBBD COC(=O)CNC(=O)c1ccc(NCCO)c([N+](=O)[O-])c1 298290855 YBYVWWIIIHMXED-UHFFFAOYSA-N 297.267 -0.098 5 20 CBBD CNC(=O)CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 330662716 SJQKIZMPSYXCLZ-UHFFFAOYSA-N 295.299 -0.573 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)OC 347856547 APYPBSRAVUWDNN-QMMMGPOBSA-N 298.255 -0.510 5 20 CBBD Cn1cnc(CNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 359028524 IDDBLCFPRZVOPM-UHFFFAOYSA-N 277.244 -0.138 5 20 CBBD O=C1C[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CN1 440474978 DEYZIALPRGNOEV-QMMMGPOBSA-N 292.251 -0.462 5 20 CBBD CNc1nccc(C(=O)N[C@@H](CCO)COC)c1[N+](=O)[O-] 563379777 XVSPAPQHRQIFRK-QMMMGPOBSA-N 298.299 0.159 5 20 CBBD CCNCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 575401696 IHRRIXXARODYRJ-UHFFFAOYSA-N 282.300 -0.128 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 600217240 UWTVJKZQZDWUDC-BQBZGAKWSA-N 270.245 -0.942 5 20 CBBD O=C(Cn1cnnn1)Nc1cc(C(=O)O)cc([N+](=O)[O-])c1 739358302 LVAFXSBNMKUSPP-UHFFFAOYSA-N 292.211 -0.082 5 20 CBBD CO[C@H](C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 847892863 INVSNTZWNSLNLT-ZCFIWIBFSA-N 289.269 -0.170 5 20 CBBD CCn1ncn(NC(=O)CCC(C)(C)[N+](=O)[O-])c1=O 854627665 ODXSLCFESDHMAI-UHFFFAOYSA-N 271.277 -0.030 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCOCCN1 854691524 MOSLLEYLAKQVAQ-UHFFFAOYSA-N 267.245 -0.451 5 20 CBBD CC(=O)N(C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1066569622 KUEOSYCCSOINGH-NXEZZACHSA-N 257.290 -0.022 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1N 1118270177 XCUCLIKIDWDLFC-DTWKUNHWSA-N 282.304 -0.228 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1324477286 GCPTXLLVJRASDW-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCc1nc[nH]n1 1333182338 PHKHRCJMFPDQEL-UHFFFAOYSA-N 252.190 -0.347 5 20 CBBD COCC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 1334962630 QVBZCSBAJSZZOY-UHFFFAOYSA-N 254.246 -0.104 5 20 CBBD C[C@H](C[S@](C)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1337707051 HEJFSZQOGJPTME-NEXAQPNMSA-N 260.275 -0.185 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N1CC(F)C1 1343184277 LGSAZFVDWDIAEF-UHFFFAOYSA-N 285.235 -0.912 5 20 CBBD O=C(O)CCSCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1602029214 PRCOFXJXMHUJJC-RNFRBKRXSA-N 262.287 -0.024 5 20 CBBD O=C(O)[C@@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 50162202 LGMKACUUEACWRE-ZETCQYMHSA-N 268.229 -0.133 5 20 CBBD C[C@@H](C(N)=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 81078623 YHQOEIBVHILGQY-VIFPVBQESA-N 279.300 -0.014 5 20 CBBD CC(CO)(CO)NC(=O)Cc1ccccc1[N+](=O)[O-] 126030561 BXOZFZMHMHNOHF-UHFFFAOYSA-N 268.269 -0.003 5 20 CBBD CN1CC[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1=O 152610079 RVUHCAGSPLQJEQ-SECBINFHSA-N 295.299 -0.127 5 20 CBBD CC(C)[C@@H]1CN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 153727129 SMQHZYZKKMIKFH-JTQLQIEISA-N 296.331 -0.015 5 20 CBBD O=C1NC[C@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 190334147 VPUXFEAGXKUVQL-LURJTMIESA-N 297.296 -0.802 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[C@H](CO)O1 349625516 FDTLIARCIKQEDT-NXEZZACHSA-N 298.299 -0.244 5 20 CBBD CCn1cc(S(=O)(=O)NC2CC(N)C2)c([N+](=O)[O-])n1 359287107 NMVHJRBDTNHTQJ-UHFFFAOYSA-N 289.317 -0.421 5 20 CBBD C[C@H]1NCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 434707105 PTKGJDNDSUQESQ-SFYZADRCSA-N 268.277 -0.557 5 20 CBBD COCCOC1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 444072885 JDEXSQSEZNINBJ-UHFFFAOYSA-N 269.261 -0.181 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)C1CC(N)C1 569843443 AGUXQNKKRREYTD-UHFFFAOYSA-N 253.262 -0.110 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@]12CCNC2 574037257 JSAVBXOPMYYDJF-PWSUYJOCSA-N 279.300 -0.093 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@H]1C 581370839 DQTYQVICKUMNBV-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD COc1cc(C(=O)NC[C@@H](O)C(N)=O)cc([N+](=O)[O-])c1C 590337629 KWELSDJHDRMRGI-SECBINFHSA-N 297.267 -0.512 5 20 CBBD COC(=O)[C@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 592549924 PTVKUHSMENWCLY-SNVBAGLBSA-N 296.283 -0.100 5 20 CBBD CCS(=O)(=O)NC(=O)CCn1cc([N+](=O)[O-])nc1C 732604596 FRQIIVJWBKAPNE-UHFFFAOYSA-N 290.301 -0.044 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NS(=O)(=O)CCCF 747132386 GYLWZFKTUIAAGF-UHFFFAOYSA-N 294.264 -0.403 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)NC(N)=O)n1 755577481 YNTWHYSOSAUETK-YFKPBYRVSA-N 299.243 -0.449 5 20 CBBD NC(=O)NC[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840311781 XXFIPQLFWXHKPW-IWSPIJDZSA-N 270.289 -0.299 5 20 CBBD NS(=O)(=O)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840404259 YKJVAHWYLHNGCJ-IWSPIJDZSA-N 291.329 -0.679 5 20 CBBD O=[N+]([O-])c1c(N2C[C@H](O)[C@@H](CO)C2)ccnc1F 882443312 ZPSPUNMIOPQACI-SVRRBLITSA-N 257.221 -0.082 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(N)(CO)CC1 1252590220 QGDAGEMSPONNMK-UHFFFAOYSA-N 255.278 -0.382 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 1320513246 JLWWVOXVBXFBLV-JTQLQIEISA-N 269.261 -0.886 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2C[C@]2(CO)C1 1320699232 NGCXXHULDVXFDA-JOYOIKCWSA-N 280.284 -0.059 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 1325268168 KMLQJIZHIXTDNZ-SNVBAGLBSA-N 269.261 -0.886 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](CO)[C@H](O)C1 1344550229 WITIINRYZRXFTQ-HTRCEHHLSA-N 270.245 -0.867 5 20 CBBD CO[C@H]1CN[C@@](C)(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1573960180 GDFACNJZNFQKEW-ZYHUDNBSSA-N 297.315 -0.326 5 20 CBBD O=C(O)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCOCC1 1602049563 GHTPTDSIPSLNOX-RKDXNWHRSA-N 272.257 -0.256 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](CF)C(=O)O 1608276490 BBJPUSZSTBAXPF-ZCFIWIBFSA-N 272.192 -0.276 5 20 CBBD Cn1c(C(=O)NCCCS(N)(=O)=O)ccc1[N+](=O)[O-] 40383119 KTGSNWSMKPTRIX-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD CCc1nn(C)c(NCCCS(N)(=O)=O)c1[N+](=O)[O-] 91560261 QSPXXZXVZUYIBP-UHFFFAOYSA-N 291.333 -0.019 5 20 CBBD O=C(O)COCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 93227192 INLGUEQOCLXKPG-UHFFFAOYSA-N 257.202 -0.246 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 194332362 QPEFAIVBWKYYSM-KCJUWKMLSA-N 295.299 -0.178 5 20 CBBD O=C(NC[C@@H]1CCCS1(=O)=O)c1cc([N+](=O)[O-])n[nH]1 354033904 NNUJTDTXNJEXSC-LURJTMIESA-N 288.285 -0.375 5 20 CBBD CCN1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 452952089 LVSSMLHTZLBTQU-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 542837120 IMHUAGXHDMNLFT-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCn2c(O)nnc2C1 570936218 VYBFZIKMWMLDQS-UHFFFAOYSA-N 279.216 -0.729 5 20 CBBD COCCC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 761948694 MSGPUFBFRVBCKX-UHFFFAOYSA-N 271.229 -0.060 5 20 CBBD Cn1c(C(=O)N[C@H]2CCOC2=O)ccc1[N+](=O)[O-] 788050089 PGULVEQCPFSHSW-LURJTMIESA-N 253.214 -0.021 5 20 CBBD CN(C(=O)C(N)=O)C1CN(Cc2ccccc2[N+](=O)[O-])C1 1043714037 MKHULKMIBBYGPM-UHFFFAOYSA-N 292.295 -0.277 5 20 CBBD COCC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1062395959 WLUUNMOBMBUQTJ-RKDXNWHRSA-N 285.300 -0.547 5 20 CBBD O=C1CN(c2cc(-c3nn[nH]n3)sc2[N+](=O)[O-])CCN1 1593399708 PZORFOSZRNTDJK-UHFFFAOYSA-N 295.284 -0.227 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CCO1 43701086 NZJWPHJXHVZIGD-MRVPVSSYSA-N 297.223 -0.791 5 20 CBBD CC(=O)NCCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 65842957 BLOUSEMLQZLLLT-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)N(C)C 76268151 JGOIZDACDSABAR-YFKPBYRVSA-N 254.250 -0.144 5 20 CBBD C[C@](O)(CO)CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] 90287847 GDTXALPVASXTTG-GFCCVEGCSA-N 294.267 -0.014 5 20 CBBD CN1C(=O)C[C@H](Nc2ncc([N+](=O)[O-])cn2)C1=O 115263663 YUCSNHBCUPCDRZ-LURJTMIESA-N 251.202 -0.446 5 20 CBBD CNCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 121615758 GGHLGNOHYUNQJA-UHFFFAOYSA-N 268.273 -0.518 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 229974569 QRWGIXIGMITTOH-SECBINFHSA-N 267.241 -0.900 5 20 CBBD CC1(C)CC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 266611044 RFGFKTIJBWLPGK-VIFPVBQESA-N 296.283 -0.063 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1COC[C@@H]1O 342426067 FNWYXCRPXZBYTM-BDAKNGLRSA-N 270.245 -0.991 5 20 CBBD COC(=O)C[C@@]1(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCOC1 354690137 IFWMCCYPNXXOCS-NSHDSACASA-N 298.255 -0.230 5 20 CBBD CN1CCNC[C@@H]1CNc1ncc([N+](=O)[O-])s1 394830677 ULYIHYRNCLKPKX-SSDOTTSWSA-N 257.319 0.367 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCOC1 563408397 XXKCRSKTNGTMPC-SNVBAGLBSA-N 268.229 -0.703 5 20 CBBD NC(=O)c1ccc(N2CC[C@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1 582519180 INZYYXOYEMIDTM-BXKDBHETSA-N 295.295 -0.127 5 20 CBBD CNc1nccc(C(=O)N2CC(OC)C2)c1[N+](=O)[O-] 594289186 HTCCCUIAGFPLKQ-UHFFFAOYSA-N 266.257 0.502 5 20 CBBD O=C1NC[C@@H]2CN(c3cccnc3[N+](=O)[O-])CCN2C1=O 610770293 WYBPDKISSRSPNS-MRVPVSSYSA-N 291.267 -0.863 5 20 CBBD C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)N(C)C 766969225 QOYFSVNPCKRJNJ-ZCFIWIBFSA-N 270.245 -0.038 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCCCNC(N)=O)n1 780370503 SFZRFJNYTLAANJ-UHFFFAOYSA-N 271.233 -0.457 5 20 CBBD O=CN1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2O)CC1 816270172 UUOUXQHDDKNRTQ-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@H]2CO1)[C@@H]1C[C@H]1[N+](=O)[O-] 839605127 JCZRKHNBUPKMLK-UKKRHICBSA-N 269.301 -0.369 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@H]3NCC[C@H]3C2)c1 923360127 WIEXXRIYPPFYGV-CYZMBNFOSA-N 295.343 -0.164 5 20 CBBD O=C(NC1CN(C(=O)Cc2ccco2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991294188 UHQOBPHYELTNQB-GHMZBOCLSA-N 293.279 -0.186 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccsn1 994455053 OGEAWUGKCCMANW-VXNVDRBHSA-N 296.308 -0.251 5 20 CBBD NC(=O)CC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1 1110112034 HUKZRBKSYDEAEE-UHFFFAOYSA-N 293.283 -0.074 5 20 CBBD CCN[C@H](C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 1118085946 OLBQLIFMUAFFIF-SSDOTTSWSA-N 256.266 -0.700 5 20 CBBD COC[C@@H](CCO)NC(=O)c1c([N+](=O)[O-])cnn1C 1319886814 CXIFMTMOZTYDKJ-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD CS(=O)(=O)CC[S@](=O)CCn1cc([N+](=O)[O-])cn1 1340810086 XJNCWUDJISICHM-QGZVFWFLSA-N 295.342 -0.415 5 20 CBBD NC(=O)CSc1ccc([N+](=O)[O-])c(N)c1-c1nn[nH]n1 1592730621 RFFDVKBZYPTNFF-UHFFFAOYSA-N 295.284 -0.066 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NCC(=O)NCC(=O)O 91557067 ASYTVNSZXQQPCR-UHFFFAOYSA-N 285.260 -0.268 5 20 CBBD O=C1CN(S(=O)(=O)c2csc([N+](=O)[O-])c2)CCN1 119333990 ZFUNPIYTVBSEIP-UHFFFAOYSA-N 291.310 -0.223 5 20 CBBD C[S@@](=O)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 171850272 NEVFVLUVRQFMAK-GOSISDBHSA-N 274.302 -0.324 5 20 CBBD COCCN1CCN(c2c([N+](=O)[O-])ncn2C)CC1=O 271056277 BIEXJWQGWNZTCO-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD CN1CCN(CCNc2ncc([N+](=O)[O-])c(N)n2)CC1 298682145 AEAHZCPJEYWKFS-UHFFFAOYSA-N 281.320 -0.374 5 20 CBBD CC(C)(CNC(=O)Cn1ccc([N+](=O)[O-])n1)OCCO 336843356 WQENWGFDWIEOQY-UHFFFAOYSA-N 286.288 -0.305 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1COC[C@@H]1O 342504706 WLNHFBSRQJEJOQ-IUCAKERBSA-N 282.256 -0.596 5 20 CBBD O=[N+]([O-])c1cnn(CCN2[C@H](CO)CC[C@@H]2CO)c1 347325958 ZWUBESRXISWXRO-AOOOYVTPSA-N 270.289 -0.391 5 20 CBBD COC1(C)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 353012132 NWRNTIXJYVWHQF-SNVBAGLBSA-N 270.289 -0.127 5 20 CBBD CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 359815473 VBFVDTIJPCINIF-UHFFFAOYSA-N 268.229 -0.135 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@@H](C)CN)c([N+](=O)[O-])n1 447239509 NICXVXRROIWVII-ZETCQYMHSA-N 291.333 -0.316 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)OC[C@H]2C1 495816297 IDXALCQRCSNETL-ZCFIWIBFSA-N 281.228 -0.406 5 20 CBBD CN1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(=O)N1 538681465 RTXXOCIMLCCTFH-VIFPVBQESA-N 278.268 -0.401 5 20 CBBD COC[C@@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 564836476 CRBWQCRPDFVPBD-GFCCVEGCSA-N 297.315 -0.466 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 618923938 MOJQDTDGBVGNHP-SNVBAGLBSA-N 292.251 -0.348 5 20 CBBD COC[C@@](C)(O)C(=O)OCCn1ccc([N+](=O)[O-])n1 748128235 BSVGZNUHDOLYGF-SNVBAGLBSA-N 273.245 -0.268 5 20 CBBD NC(=O)c1ccnc(N2CC[C@@](F)(CO)C2)c1[N+](=O)[O-] 1117647624 JFLKTAVIZAIUOO-NSHDSACASA-N 284.247 -0.001 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(S(N)(=O)=O)CC1 1322426679 ZHSISCFQHQGCQI-UHFFFAOYSA-N 289.317 -0.414 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)OCCCO 1334936423 NGDNZZNAEGDDCO-UHFFFAOYSA-N 256.214 -0.318 5 20 CBBD O=[N+]([O-])CCN1CCC[C@@H](n2cc(CO)nn2)C1 1341498544 KUZDRZNXBMKGBL-SNVBAGLBSA-N 255.278 -0.316 5 20 CBBD O=C(Nc1c[nH]nc1-c1nn[nH]n1)[C@@H]1C[C@H]1[N+](=O)[O-] 1582650003 LIOFCNAZPMLMNJ-NQXXGFSBSA-N 264.205 -0.807 5 20 CBBD C[C@H]1C[C@@H](C(=O)O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1589269186 RPYHTZRDGMDTBJ-JGVFFNPUSA-N 297.271 -0.245 5 20 CBBD CC(C)[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589480673 SILRPCNEUAPRHB-ZETCQYMHSA-N 267.249 -0.012 5 20 CBBD CC[C@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 134393168 XPJKEZZCBWIREF-MWLCHTKSSA-N 272.305 -0.097 5 20 CBBD C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H](CO)O1 191870272 GRCBINWFKFDXNU-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 274243153 UVMPZSSFNXXPAT-SSDOTTSWSA-N 284.224 -0.436 5 20 CBBD O=C(CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)NCCO 275018098 ZKCRCGCLWZRCHF-UHFFFAOYSA-N 283.240 -0.861 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1nc[nH]n1 285488086 ADXVDNGKEPQTEQ-BYPYZUCNSA-N 251.206 -0.073 5 20 CBBD CN1CCC(O)(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 286281755 VZLADYJGNPFRBK-UHFFFAOYSA-N 283.288 -0.496 5 20 CBBD C[C@@](O)(CO)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 338624884 SDLXDBGFAFAIMV-JTQLQIEISA-N 271.229 -0.832 5 20 CBBD CC[C@H](C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339345268 FMVGCVHHZLNWDD-XPUUQOCRSA-N 285.260 -0.198 5 20 CBBD CCN(CCO)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 347791909 JTXDVIILQUVDHS-UHFFFAOYSA-N 285.304 -0.778 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[S@]1=O 353229703 LUKQFGDJLRCFHE-FWCARGHBSA-N 272.286 -0.089 5 20 CBBD COCCN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])nn1C 356465033 VKLFEYCVUQZVKY-UHFFFAOYSA-N 299.331 -0.022 5 20 CBBD Cn1nnnc1Sc1ncc([N+](=O)[O-])cc1C(N)=O 356735086 WKRAAKVZAKCNGG-UHFFFAOYSA-N 281.257 -0.237 5 20 CBBD COC(=O)[C@@H](CF)NC(=O)c1cc([N+](=O)[O-])nn1C 360495110 FWLWXBWYIDFAFB-RXMQYKEDSA-N 274.208 -0.431 5 20 CBBD O=C(N[C@@H]1CC[S@@](=O)C1)c1cnc(O)c([N+](=O)[O-])c1 445009651 MZNAQXRUBJJKHQ-QOLSBQFWSA-N 285.281 -0.054 5 20 CBBD CNc1nccc(C(=O)Nc2nc[nH]n2)c1[N+](=O)[O-] 561116408 XTFQZWFZAMDWKR-UHFFFAOYSA-N 263.217 0.402 5 20 CBBD Cn1c(C(=O)NCCN2CC[C@@H](O)C2)ccc1[N+](=O)[O-] 600531871 MYXUJEDEOZNRBJ-SECBINFHSA-N 282.300 -0.270 5 20 CBBD Cc1cc(C(=O)NN2CC(=O)NC2=O)c(N)c([N+](=O)[O-])c1 743286379 BQKYYHWNBVYIPL-UHFFFAOYSA-N 293.239 -0.318 5 20 CBBD O=C1CC(CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])=NN1 854487610 MUMQMLNUWHHQKW-HTQZYQBOSA-N 254.246 -0.576 5 20 CBBD O=C(O)C1=NO[C@H](Cn2cccc([N+](=O)[O-])c2=O)C1 1601738998 BJDFCJWTAIUNKM-LURJTMIESA-N 267.197 -0.014 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)C[C@@H](O)C2)n1 1602403985 ANROMTDTMZMDJC-KNVOCYPGSA-N 283.240 -0.380 5 20 CBBD O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@@H](CO)C(=O)O 1608365056 GOCJOTXPNWAVBM-QMMMGPOBSA-N 286.215 -0.162 5 20 CBBD COC(=O)CNC(=O)COc1cccnc1[N+](=O)[O-] 16246938 FKKSRVKEXAZVJC-UHFFFAOYSA-N 269.213 -0.342 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 64336504 MWZQARNGAHATPR-YFKPBYRVSA-N 256.218 -0.082 5 20 CBBD COC(=O)[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 112669305 KIBKIXPSTJSBNR-SECBINFHSA-N 298.255 -0.808 5 20 CBBD CO[C@@H]1C[C@@H](CO)N(Cc2c([N+](=O)[O-])ncn2C)C1 344894730 FIYSZSYWMJSWRF-DTWKUNHWSA-N 270.289 -0.090 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H](C)O 354698607 TYFSVQDKGMGFBS-LHLIQPBNSA-N 298.251 -0.047 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 356008062 PWLZPJVZWDLQHY-YFKPBYRVSA-N 268.229 -0.440 5 20 CBBD Nc1nc(N2CCC[C@@]3(CNC(=O)C3)C2)ncc1[N+](=O)[O-] 361173035 ZLVHVZHIMVLLEC-GFCCVEGCSA-N 292.299 0.074 5 20 CBBD NC[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCCO1 583993449 CKMNQFYUYIRGDU-NSHDSACASA-N 297.315 -0.242 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2ccc([N+](=O)[O-])cc2O)n1 590551666 QTSXHJAERULVBL-UHFFFAOYSA-N 292.255 -0.027 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](O)C(=O)NC 808048166 KPSRJLMBPLWGJI-ZETCQYMHSA-N 271.277 -0.362 5 20 CBBD COC(=O)N1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839627412 OJJWDDQWLOQSDR-IWSPIJDZSA-N 271.273 -0.001 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnon2)C1 950056159 VECXBXJLTUFWOS-GHMZBOCLSA-N 295.299 -0.233 5 20 CBBD Cc1ncoc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030293230 IENWDCOMZXVOOW-NXEZZACHSA-N 280.284 -0.051 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(CNCCCO)CC1 1205229569 FATAACUYTAABHC-VXGBXAGGSA-N 285.344 -0.138 5 20 CBBD COC[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)OC 1323544120 OVKMRVISBVUDIM-ZCFIWIBFSA-N 286.244 -0.754 5 20 CBBD CN[C@H](C)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1326276812 YLSQOLLUSNOYHD-SECBINFHSA-N 282.300 -0.129 5 20 CBBD CCn1cnnc1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1340017711 UWAUTSUACHAQRZ-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@]1(C(=O)O)CCOC1 1574428435 CIEIEBPLWPQVRY-NSHDSACASA-N 298.255 -0.540 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 43700687 KDVWGICPBQZOCN-MRVPVSSYSA-N 269.213 -0.152 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CC(O)(C2CC2)C1 89664128 NYDLOSLHBNTQSZ-UHFFFAOYSA-N 279.252 -0.120 5 20 CBBD O=C(O)C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 91292506 LEHYHAAFTTVUCC-MRVPVSSYSA-N 298.255 -0.507 5 20 CBBD C[C@@]1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 225187978 FZEWCLCLAHWMAL-SNVBAGLBSA-N 254.246 -0.225 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCO1 262339755 HSTOREMPEISMNE-SECBINFHSA-N 280.284 -0.023 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCN[C@@H](C(N)=O)C1 271616629 VYRFGNOCJRVGFU-SECBINFHSA-N 265.273 -0.438 5 20 CBBD O=C(NCC1(CO)CCOCC1)c1cc([N+](=O)[O-])[nH]n1 285871419 VUUJVSGEFBJFCT-UHFFFAOYSA-N 284.272 -0.163 5 20 CBBD O=C1CN(c2nccc(C(=O)O)c2[N+](=O)[O-])CCN1 311860914 QUJVPESJULTNAV-UHFFFAOYSA-N 266.213 -0.376 5 20 CBBD COCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])ccc1=O 312722060 IOTBAUZUTCFUJE-NSHDSACASA-N 285.300 -0.304 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1COC[C@@H]1O 342426073 FNWYXCRPXZBYTM-IUCAKERBSA-N 270.245 -0.991 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 343264088 QIUGYRQGRXCHON-SSDOTTSWSA-N 284.228 -0.668 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(F)F 354013306 FSFVKLRBTRPXFX-LURJTMIESA-N 276.199 -0.072 5 20 CBBD COC(=O)[C@H]1C[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 519534498 AREXGPKOWWZXOO-NGZCFLSTSA-N 298.299 -0.307 5 20 CBBD Cc1cc(=O)n(CCN2CCNCC2)cc1[N+](=O)[O-] 567808708 ZXEAXONZQXJJLB-UHFFFAOYSA-N 266.301 -0.030 5 20 CBBD O=C1C[C@@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CCN1 761211243 JBPXZXBZDGCWAF-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD CN1CCC[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 778769436 QWZIWRFXNYIRQO-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD CCC(=O)N1CCC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1074372816 IAOYAWNAPHFWIY-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD CC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093455826 XWYNOOVXPZFWQG-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H]1O 1319946703 DNWKXHSGELIWHD-SVRRBLITSA-N 254.246 -0.219 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1320414054 YYPDNUJMFNZGTG-BDAKNGLRSA-N 298.299 -0.060 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1c[nH]nc1[N+](=O)[O-] 1329567462 IOOZMQJXDKPLNT-SSDOTTSWSA-N 269.261 -0.886 5 20 CBBD COCC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCOCC1 1330461636 UWUMHLPCTAAAIY-UHFFFAOYSA-N 299.287 -0.502 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1337328967 XOUQJJDTMRCJFD-UHFFFAOYSA-N 299.287 -0.837 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 54333516 SUJVGABBWLNUFI-LURJTMIESA-N 256.218 -0.372 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 264760377 OESDHOYVTCPNHJ-VIFPVBQESA-N 281.316 -0.102 5 20 CBBD C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](O)[C@H](O)C1 278940968 YDMLIWIKDNHGFH-GGZOMVNGSA-N 295.295 -0.041 5 20 CBBD COC(=O)C1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCC1 344229113 NSCBWQYQHAMKCM-UHFFFAOYSA-N 297.271 -0.212 5 20 CBBD Cc1ccn(CCN2C(=O)CNC2=O)c(=O)c1[N+](=O)[O-] 348896711 ASQMSDLJIOKBJP-UHFFFAOYSA-N 280.240 -0.383 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[S@]1=O 352315452 VVGFTCHSUHPZLE-LILOVNGRSA-N 286.313 -0.229 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 570153385 SUACOFITWNZGRM-NSHDSACASA-N 285.256 -0.177 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)NCCN(C)C 573837162 OIXHPBNEXKNISP-QMMMGPOBSA-N 297.315 -0.281 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC[C@]1(O)CCCOC1 593881493 HRYSDPPGPOYELE-GFCCVEGCSA-N 298.299 -0.161 5 20 CBBD CO[C@H]1CS(=O)(=O)C[C@H]1N=c1cc[nH]cc1[N+](=O)[O-] 596434127 JCQOPZUXKCLMRF-SCZZXKLOSA-N 287.297 -0.364 5 20 CBBD CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCC1=O 598293837 LXBPFOUXWTUXMV-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN([C@@H]2CCOC2)CC1 619788861 NKJXNRUODUKOCZ-SECBINFHSA-N 295.299 -0.135 5 20 CBBD CN1CC[C@@H]1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 712587280 RTRJIVZEZDXTSM-MWLCHTKSSA-N 269.305 -0.554 5 20 CBBD O=C(O)[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 738550300 APSDJVCSRCJHDV-QMMMGPOBSA-N 256.218 -0.466 5 20 CBBD Cn1nnnc1CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 772878382 UFSOMXHKRJTEIJ-UHFFFAOYSA-N 291.271 -0.327 5 20 CBBD Cn1c(C(=O)N[C@@H]2COC(=O)C2)ccc1[N+](=O)[O-] 816677292 LNXBEBPQOQLNIP-LURJTMIESA-N 253.214 -0.021 5 20 CBBD CC(=O)N1CCC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1019014286 XSKNUHOWGIMVBV-NXEZZACHSA-N 267.285 -0.268 5 20 CBBD O=C1CO[C@H]2CCN(c3ccnc(O)c3[N+](=O)[O-])C[C@@H]2N1 1118537369 ZYEYYUSQFYPQKX-CBAPKCEASA-N 294.267 -0.211 5 20 CBBD CNC(=O)CNCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1205223821 JMLGKMHIKAMIAG-GHMZBOCLSA-N 298.343 -0.774 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](C(=O)O)C1CC1 1339062458 UNMFSYLULSGMFU-SSDOTTSWSA-N 268.229 -0.079 5 20 CBBD C[C@@H]1CCCN1C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1347107105 ZGNGQNJTIWAEOW-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CCOC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 31810611 ROZGBGMZDQMCOI-UHFFFAOYSA-N 269.213 -0.582 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CCN(C3CC3)C2)c1 44721356 DQZBFELZIMSSQJ-GWCFXTLKSA-N 295.343 -0.022 5 20 CBBD CC(C)[C@@H](CO)NC(=O)Cn1ccc([N+](=O)[O-])n1 92404320 YENSNIJWOKNDKO-MRVPVSSYSA-N 256.262 -0.076 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCC(=O)NCC1CC1 180871849 WUORHCVJRLQHBT-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1C(=O)NCC[C@H]1C 194332996 AQIUOFCYKKZQGE-HQJQHLMTSA-N 295.299 -0.259 5 20 CBBD COCCN(CC(=O)N(C)C)c1ncc([N+](=O)[O-])cn1 273226018 WCULAZGKHGKJLJ-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CCc1[nH]nc(C(=O)N(C)C[C@H](O)CO)c1[N+](=O)[O-] 278387575 JPRGIYGELSPEFY-LURJTMIESA-N 272.261 -0.695 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(=O)N[C@@H](C)C2)c1[N+](=O)[O-] 295828691 CMGBGWPDGZZASV-LURJTMIESA-N 281.272 -0.159 5 20 CBBD C[C@@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330987056 GJCNMAAMGWPYSH-PSASIEDQSA-N 281.268 -0.262 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)[C@H]1CCCO1 344855488 FCUHIQKTOAXHPY-RKDXNWHRSA-N 284.272 -0.553 5 20 CBBD O=C(CNc1ncnc2cccc([N+](=O)[O-])c12)NCCO 347410618 PSJGEIUMDLQQDZ-UHFFFAOYSA-N 291.267 0.058 5 20 CBBD CC[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 362254797 WBTTXXZMLQLCHG-YFKPBYRVSA-N 255.234 -0.678 5 20 CBBD NS(=O)(=O)c1ccc(N2CC(O)C2)cc1[N+](=O)[O-] 596107640 ZJOURYLHTWWBSQ-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD NC(=O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCC1 610892270 YZFXFEQGLJRRAN-UHFFFAOYSA-N 281.272 -0.437 5 20 CBBD CN1C[C@@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 772756931 JLCNGWDQAUESKL-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD O=C1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1 823729739 JYHOQSTUTSPCQG-NSHDSACASA-N 279.252 -0.413 5 20 CBBD CCC[C@H]1C(=O)NCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839717941 PSZCJIAXUJPNJS-HRDYMLBCSA-N 255.274 -0.221 5 20 CBBD CN(C)C[C@H](CO)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 854467337 FFXUPLLWXLPPOK-ZYHUDNBSSA-N 297.311 -0.333 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1 923425421 MYYRACBLOVWVSI-CMPLNLGQSA-N 283.332 -0.164 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]c1 1002420731 FTRXKFTYAVEJGP-GHMZBOCLSA-N 292.295 -0.132 5 20 CBBD NC(=O)CN1CCC2(CC1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1050517025 NBUASTVFSLJVEP-NXEZZACHSA-N 296.327 -0.939 5 20 CBBD CCN(C(=O)CCOC)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1079181887 LAUVVBGLUFYDEX-GHMZBOCLSA-N 299.327 -0.253 5 20 CBBD O=C(NCCNCC1CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126938906 MJYRBFXHJZROPG-GHMZBOCLSA-N 271.317 -0.216 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 1320977546 VQXFYDZGULPJKM-UHFFFAOYSA-N 292.255 -0.467 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(C[C@H]2CNCCO2)n1 1327023039 TZPYNORYSMOHQS-ZETCQYMHSA-N 294.271 -0.091 5 20 CBBD COCC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 52785128 FDPRGEBVZMJKNQ-ZETCQYMHSA-N 286.244 -0.603 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCOCC2)c1 266435660 LOEORPFPELZDSI-JTQLQIEISA-N 256.262 -0.516 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@@H]3C(=O)NC[C@@H]32)c1[N+](=O)[O-] 337155581 UVJSDUTUASXKFH-YUMQZZPRSA-N 293.283 -0.023 5 20 CBBD C[C@@H](CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1)C(=O)O 347399867 GGEMNMNMOXSKPF-ZETCQYMHSA-N 297.271 -0.102 5 20 CBBD CN(C)C(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])cn1 357134943 ZEKOYRSXRLEGFZ-UHFFFAOYSA-N 298.303 -0.431 5 20 CBBD Cn1ccc(S(=O)(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 359424459 NJHSFHWUZMVDLZ-UHFFFAOYSA-N 283.269 -0.054 5 20 CBBD NC(=O)[C@H](O)CNCCC(=O)Nc1ccccc1[N+](=O)[O-] 577221271 KPXUBADIHSMBPX-SNVBAGLBSA-N 296.283 -0.641 5 20 CBBD CC(=O)NCCN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 584352987 JMXKWIFAHTYXGB-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCc1cn[nH]c1 589541999 AYOCMZQMTSLTOH-UHFFFAOYSA-N 291.267 -0.162 5 20 CBBD C[C@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCNC1 595992007 NEXLBFXJOOFZTF-JTQLQIEISA-N 253.262 -0.341 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[C@H]1CN2 602588240 MYYMTTSGAKDQIO-BQBZGAKWSA-N 251.246 -0.485 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)Nn1c(O)nnc1O 820292999 YMSMNPBPKTXLSE-UHFFFAOYSA-N 280.200 -0.436 5 20 CBBD CS(=O)(=O)N1CCC[C@@H]1C(=O)OCCC[N+](=O)[O-] 860913881 LVDHVLSFLCWNDL-MRVPVSSYSA-N 280.302 -0.380 5 20 CBBD Cc1cnc(NC/C=C\CNC(=O)C(N)=O)c([N+](=O)[O-])c1 1107480763 SOVLGKBASVQUDC-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD CN1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1=O 1261508287 CFSSXRJTIOPINT-UHFFFAOYSA-N 294.267 -0.943 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] 1324271626 YTYGQWPQMTWTIW-ZETCQYMHSA-N 287.659 -0.176 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1cnc(O)[nH]1 1324400580 ZCUSGJYLQCWXFX-UHFFFAOYSA-N 280.244 -0.155 5 20 CBBD Cn1cncc1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1339924256 HIDVPSODSOHVCU-UHFFFAOYSA-N 277.240 -0.363 5 20 CBBD CC1(N)CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1346046890 MHEHTIUWHGPDBG-UHFFFAOYSA-N 268.277 -0.474 5 20 CBBD CCn1ncc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n1 1590968243 FPCXSJNRAVUJBC-UHFFFAOYSA-N 290.247 -0.369 5 20 CBBD NC1=CCN(c2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])N1 1592740415 JQZPQHXJHXWZJQ-UHFFFAOYSA-N 275.232 -0.705 5 20 CBBD O=C(O)c1nn(CCC2CS(=O)(=O)C2)cc1[N+](=O)[O-] 1602585750 YNWOYJCCEXJTET-UHFFFAOYSA-N 289.269 -0.076 5 20 CBBD O=C(NCC1(C(=O)O)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1608427866 KROGQHIMMKYKCQ-UHFFFAOYSA-N 298.255 -0.071 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCCN(CC(=O)O)CC1 61145992 PVXZZCAUKSRSNJ-UHFFFAOYSA-N 283.288 -0.075 5 20 CBBD NC(=O)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] 143889108 WCIRSFCNKQJAOX-UHFFFAOYSA-N 273.270 -0.252 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@@H](O)C1 161645462 BAPQICSQLIEDOR-SNVBAGLBSA-N 283.288 -0.042 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCN1CCCC1 172126664 NXKYKPKWEOFYLB-UHFFFAOYSA-N 294.311 -0.032 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CC1 173000179 CCESDCUIHFXIDD-UHFFFAOYSA-N 254.202 -0.475 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCN3CCC[C@@H]3C2)c1 173365744 CCJMQDKFHNTXMF-DGCLKSJQSA-N 295.343 -0.068 5 20 CBBD COC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 234762574 LZGQROMLQXQHES-ZETCQYMHSA-N 257.246 -0.330 5 20 CBBD COCCN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285744525 YHNMXJKVVPNHAB-UHFFFAOYSA-N 283.288 -0.278 5 20 CBBD COC(=O)N1CC(Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1 290735347 GKYSKUSOHHAYKW-UHFFFAOYSA-N 295.255 -0.049 5 20 CBBD CN1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 330668792 CNHFGRZQLMWKEA-JTQLQIEISA-N 294.311 -0.176 5 20 CBBD NCCN(CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 342404806 ZDCOCRQGBHIHRZ-UHFFFAOYSA-N 282.300 -0.553 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@H]2COC[C@H]2O)c1[N+](=O)[O-] 342469812 QUPHYVJWVWKJOG-NKWVEPMBSA-N 270.245 -0.542 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])o1)NCCO 344154476 CLEPBGSXVZUVNK-UHFFFAOYSA-N 257.202 -0.974 5 20 CBBD CN1CC[C@@H](Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)C1 352910510 DQGNKGVCJVSUSQ-MRVPVSSYSA-N 280.284 -0.193 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 362413649 ZMISEHSXNUMKMB-NSHDSACASA-N 298.255 -0.774 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 440964160 NLPBFMHJEJIQKK-GHMZBOCLSA-N 297.315 -0.637 5 20 CBBD O=C(NCCN1C[C@@H]2CC[C@H](C1)O2)c1cc([N+](=O)[O-])n[nH]1 456207805 UHCGTJIWBIWWDX-DTORHVGOSA-N 295.299 -0.089 5 20 CBBD CCO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 456816438 YBQNSLDZEPXMAZ-HTQZYQBOSA-N 270.245 -0.148 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 600457530 IXJHDHOTHOLHNB-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD C[C@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 748115537 FJUABRULJFPPGV-SSDOTTSWSA-N 291.285 -0.232 5 20 CBBD C[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820121852 FOUZHWHMAUHGAG-LURJTMIESA-N 269.213 -0.654 5 20 CBBD CNC(=O)[C@@H](O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 843112167 WUDZHCMTUYLVLN-MNOVXSKESA-N 283.284 -0.675 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C)O1 846484232 VFTVZHKTMUBYED-KDXUFGMBSA-N 272.257 -0.560 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2COCO2)c1[N+](=O)[O-] 861968825 GOCSFVIHHIORQA-ZCFIWIBFSA-N 256.218 -0.271 5 20 CBBD CN1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H](CO)C1 912736966 DOUVCMZQVPNALQ-JTQLQIEISA-N 273.333 -0.043 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](O)C[C@H]1CO 1338310757 FZARCEPJBLZFGE-UWVGGRQHSA-N 298.299 -0.556 5 20 CBBD O=C(O)C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 1601907787 XXCPNBAZNGSFRV-GHMZBOCLSA-N 298.299 -0.005 5 20 CBBD COC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 42238472 XJTVHWVTFXKEQU-ZCFIWIBFSA-N 256.218 -0.531 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCCCNC1=O 42479701 LKBTVLIDENZPQH-VIFPVBQESA-N 281.272 -0.424 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 48242932 VYTGYKIYHSUNOD-ZETCQYMHSA-N 269.261 -0.568 5 20 CBBD COC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])nc2C)CC1 119640162 NLEDAYSGYINMRF-UHFFFAOYSA-N 282.256 -0.078 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@H](O)[C@@H](O)C1 217316940 RZCOSDICXRGMPA-UWVGGRQHSA-N 268.225 -0.522 5 20 CBBD CNCCN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 237296242 KZDYXPFHHJKQEX-UHFFFAOYSA-N 255.278 -0.222 5 20 CBBD CN(CCN1CCOCC1)C(=O)c1c([N+](=O)[O-])cnn1C 330556933 FYZMPBOCUPDESW-UHFFFAOYSA-N 297.315 -0.268 5 20 CBBD Cc1nc(CCNC(=O)c2cc([N+](=O)[O-])cnc2N)n[nH]1 351580385 LSXODKDWCUKWIF-UHFFFAOYSA-N 291.271 -0.029 5 20 CBBD CN1CC[C@](O)(CNc2ncc([N+](=O)[O-])cn2)C1 358324664 UUEDIVCJUNDTAM-JTQLQIEISA-N 253.262 -0.137 5 20 CBBD Nc1ccc(NCCN2C(=O)CCC2=O)nc1[N+](=O)[O-] 405445611 SDPOHRJXFWCDCG-UHFFFAOYSA-N 279.256 0.133 5 20 CBBD CC[C@H](O)CNS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 490466566 XGBZBLGXBPIOJF-ZETCQYMHSA-N 292.317 -0.140 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2COC[C@@H]2OC)c1[N+](=O)[O-] 567122828 SQTQNSVEXYJSKB-BDAKNGLRSA-N 296.283 0.175 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@H]([C@H](C)N)C1 592308961 PHBNDTVNNFTAOA-WPRPVWTQSA-N 297.315 -0.326 5 20 CBBD CNc1nccc(C(=O)NCc2cn(C)nn2)c1[N+](=O)[O-] 594338055 ZAZZGMNGYDPSSU-UHFFFAOYSA-N 291.271 0.090 5 20 CBBD Nc1ccc(NC[C@@H]2CCCNC2=O)nc1[N+](=O)[O-] 596270244 XMBDGSCHDRTIEK-ZETCQYMHSA-N 265.273 0.510 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 597655612 YZSXSDFHDZNMME-MRVPVSSYSA-N 283.284 -0.047 5 20 CBBD Cn1ncc(COC(=O)Cn2cc([N+](=O)[O-])cn2)n1 802977635 VBPLBKCIDVFCDZ-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD Cn1nncc1C(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 803272359 WDPJXSVFZGOZDV-UHFFFAOYSA-N 294.227 -0.654 5 20 CBBD O=[N+]([O-])c1ccn(CCn2cnc(-c3nn[nH]n3)n2)n1 823647259 JDLLNJXPYMCPHR-UHFFFAOYSA-N 276.220 -0.737 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCn2cnnc2C1 1321214387 ZDTIYTMCMKYDCP-UHFFFAOYSA-N 290.239 -0.057 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1321811137 OVPSJSPAPHUUJP-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD CN(Cc1cn(C)nn1)c1nccc(C(N)=O)c1[N+](=O)[O-] 1328588069 ZPKRAOKVBBIGFE-UHFFFAOYSA-N 291.271 -0.146 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@@H](O)[C@@H](CO)C1 1331704523 XORPYKNMBPWODE-NXEZZACHSA-N 253.258 -0.225 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nnn(C)n1 1340697199 KQIFHBUNLQGOCY-UHFFFAOYSA-N 266.221 -0.738 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCNC[C@H]2O)n1 1578349823 AUNJAYLLUWMKQU-IONNQARKSA-N 283.288 -0.736 5 20 CBBD COC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1599276169 OWJDUSWJGWEPLK-ZETCQYMHSA-N 272.213 -0.538 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CC[C@@H](C(=O)O)C1 1600913108 IIYBFLGFHJBRAG-MRVPVSSYSA-N 283.288 -0.065 5 20 CBBD O=C1CN=C(NC(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)N1 1610887233 ODVQATOBLLBCKU-UHFFFAOYSA-N 292.207 -0.491 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CCO1 50845410 SOMKOMJKJDKFJC-ZETCQYMHSA-N 285.281 -0.017 5 20 CBBD O=C(Cn1cnnn1)Nc1cc([N+](=O)[O-])ccc1O 89531691 RHSCMFAEOLNKMX-UHFFFAOYSA-N 264.201 -0.074 5 20 CBBD CNC(=O)NC(=O)CCn1cc([N+](=O)[O-])c(C)cc1=O 177701025 WPLGKYGRKPRFFX-UHFFFAOYSA-N 282.256 -0.089 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H](O)CN1 238001483 BKHUZGBWWUCNBF-KOLCDFICSA-N 294.311 -0.154 5 20 CBBD Nc1nc(N(CCO)CCCO)ncc1[N+](=O)[O-] 266088102 CZUQXZFPLCPOGI-UHFFFAOYSA-N 257.250 -0.852 5 20 CBBD C[C@H](CO)CNC(=O)CCn1cc([N+](=O)[O-])cn1 268834312 LRNOLUJVLALGIF-QMMMGPOBSA-N 256.262 -0.074 5 20 CBBD C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](O)[C@H](O)C1 278864004 SEVOKZFEEVOTGL-GGZOMVNGSA-N 295.295 -0.041 5 20 CBBD NC(=O)CN1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 283919250 WZXVPXYRGOIUAB-UHFFFAOYSA-N 279.300 -0.216 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1CCNC1=O 340455186 VROGWPOSGJPSIM-SSDOTTSWSA-N 252.230 -0.117 5 20 CBBD O=C(NC[C@H]1CN2CCN1CC2)c1cc([N+](=O)[O-])n[nH]1 354206899 KUVSWKUFLIFMFB-QMMMGPOBSA-N 280.288 -0.953 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1Cc1c([N+](=O)[O-])ncn1C 361685453 FAIWDTDRSPFYSV-DTWKUNHWSA-N 270.289 -0.090 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 436872439 MWNDBJNMXXUTAC-UHFFFAOYSA-N 297.267 -0.207 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1C[C@H](C(=O)O)C1 518565823 NUKIFUVZNJRKOG-ZKCHVHJHSA-N 295.251 -0.264 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H]3[C@@H](CO)[C@@H]3C2)n1 590005375 FBVGFXSJTPTYNV-MYJAWHEDSA-N 252.274 -0.039 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 594352109 OGCHWDJYPLCJTD-LBPRGKRZSA-N 293.283 -0.091 5 20 CBBD NC(=O)N[C@H]1CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 596180276 RGXLKGYDJYDQOB-LURJTMIESA-N 266.261 -0.181 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCC1(CO)COC1 787133699 LIGMJSIWUFULIP-UHFFFAOYSA-N 281.268 -0.084 5 20 CBBD NC(=O)C[C@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 808229880 VCESTRZFPGLNAX-MRVPVSSYSA-N 253.262 -0.054 5 20 CBBD Nc1nc(N2CC[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 819130532 BMUBZEAJTDLVHB-RXMQYKEDSA-N 253.218 -0.122 5 20 CBBD C[C@@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)COC(=O)N1 860995621 PFJLSFYMZQVXCR-SNVBAGLBSA-N 284.228 -0.167 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NN1CCOC1=O 862699565 RVAIXRMBVVZLTL-UHFFFAOYSA-N 283.244 -0.027 5 20 CBBD CC1(C)CNCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923291840 GTPKLVDVYUVUHN-LLVKDONJSA-N 283.332 -0.164 5 20 CBBD CN(CCNc1ncc([N+](=O)[O-])cc1F)C(=O)C(N)=O 1101935605 ZXKIBJGCRXGBOU-UHFFFAOYSA-N 285.235 -0.516 5 20 CBBD Cc1[nH]nc(C(=O)NCC[S@](C)=O)c1[N+](=O)[O-] 1116083406 BYKFOVDJLBYVLF-KRWDZBQOSA-N 260.275 -0.265 5 20 CBBD COC[C@@H](C)NC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1329045230 AQYHRXKUPSVNDT-MRVPVSSYSA-N 299.287 -0.941 5 20 CBBD CONC(=O)CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 1579849194 ZOARVTDKWWUPTD-UHFFFAOYSA-N 293.243 -0.136 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CCN(C3CC3)C2)c1 44721353 DQZBFELZIMSSQJ-GXFFZTMASA-N 295.343 -0.022 5 20 CBBD NC(=O)c1ccc(N2CCO[C@H](CO)C2)c([N+](=O)[O-])c1 94267319 MKIWTMYHLFHNKR-VIFPVBQESA-N 281.268 -0.109 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](O)C(F)F 230231395 APSTUOMTYAFYOT-YFKPBYRVSA-N 264.188 -0.467 5 20 CBBD NC[C@H]1CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 238040756 GGMNLKMOXPLZRK-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1ccc([N+](=O)[O-])c(O)c1 273686095 GLOCLYOICYFFSH-QMMMGPOBSA-N 270.241 -0.274 5 20 CBBD CCc1nn(C)c(NC[C@H]2CC(C(N)=O)=NO2)c1[N+](=O)[O-] 289774398 WMOWLJQWNBSLFG-ZCFIWIBFSA-N 296.287 -0.067 5 20 CBBD CC(C)(C(=O)N1CC[C@@H](C(N)=O)C1)n1cc([N+](=O)[O-])cn1 338670445 HOMGBGJFHFJDGW-MRVPVSSYSA-N 295.299 -0.140 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc(O)c([N+](=O)[O-])c2)C(=O)N1 436977158 DSGTZFGBOQVBNC-SSDOTTSWSA-N 280.240 -0.625 5 20 CBBD COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 598535585 ASXSYTMVGARPIR-SFYZADRCSA-N 297.271 -0.356 5 20 CBBD O=[N+]([O-])c1cnc(NCCN2CC[C@H](O)C2)nc1 599199652 OLQCTVFZPCFVIR-VIFPVBQESA-N 253.262 -0.137 5 20 CBBD CCN(CC(=O)NC)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 743842612 IVNSUGSOYNVSDN-JTQLQIEISA-N 285.304 -0.780 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCc1nc(O)n[nH]1 774930392 HMJHRBYGFTVMHK-UHFFFAOYSA-N 268.189 -0.642 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@H]2CCCS(=O)(=O)C2)c1 775414538 NUMOVBNDMKZILG-VIFPVBQESA-N 288.329 -0.042 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1=O 848049236 OACCPLQANXSWKV-SSDOTTSWSA-N 271.273 -0.305 5 20 CBBD Cn1cc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)nn1 1093604611 NXUIQVXNRRLANO-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1nncn1C 1116930259 SSOOENNGJUTCEM-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NN1CCCC1=O 1254046156 KHGNBYQRJRAGBG-UHFFFAOYSA-N 267.245 -0.165 5 20 CBBD CS(=O)(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1322506902 FTRVPJCOGFWJFY-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@@H]1CCS(=O)(=O)C1 1324085161 LDIGUDKXXXSRGI-ZCFIWIBFSA-N 288.285 -0.299 5 20 CBBD COC(=O)NC1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1324932952 JDSOXWMGWWFYKL-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD CCOC(=O)[C@H]1CNCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1326308830 FGYAIPCRLRIQBD-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CCNC1=O 1327048014 IHMRTPCBDNMKGV-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD CN(C)S(=O)(=O)CCn1ccc(=O)c([N+](=O)[O-])c1 1327856191 ZPXBOPWGBSHXTA-UHFFFAOYSA-N 275.286 -0.352 5 20 CBBD O=C1C[C@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)CN1 1593387003 XHRBQIWALQHQHU-YFKPBYRVSA-N 278.232 -0.893 5 20 CBBD CNC(=O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 48958634 SGSGDURQLRBFHI-UHFFFAOYSA-N 280.240 -0.605 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 112669303 KIBKIXPSTJSBNR-VIFPVBQESA-N 298.255 -0.808 5 20 CBBD Nc1nc(N)nc(SCCn2cc([N+](=O)[O-])cn2)n1 122634841 VVWJGIWCEHECRK-UHFFFAOYSA-N 282.289 -0.067 5 20 CBBD NC(=O)NC(=O)OCCCn1nccc1[N+](=O)[O-] 269364044 NHZCCHRFQPEOTF-UHFFFAOYSA-N 257.206 -0.014 5 20 CBBD NC(=O)C1(O)CCN(c2ccc([N+](=O)[O-])cn2)CC1 311676002 ZHRJAZVTDGVKHM-UHFFFAOYSA-N 266.257 -0.194 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC(O)(CO)CC1 313623230 GFGCZRUBTRSZPM-UHFFFAOYSA-N 283.284 -0.107 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)CCN 349918099 UEHCSCBONSRTFH-SSDOTTSWSA-N 255.278 -0.047 5 20 CBBD C[C@@H](N)[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 351829394 BDSDGIPHAGDOFA-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD C[C@H](CN(C)C(=O)c1cc([N+](=O)[O-])n[nH]1)c1nn[nH]n1 354790727 NUSSICPGIZSAGI-RXMQYKEDSA-N 280.248 -0.293 5 20 CBBD C[C@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])n1C 362360281 LPJWHDNYKBVDOR-ZCFIWIBFSA-N 254.246 -0.073 5 20 CBBD NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CNC(=O)C1 420616696 SSPJNMHADFAFSU-ZCFIWIBFSA-N 264.241 -0.006 5 20 CBBD NC[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CCCC1 579222065 AGWKVNXZACWADK-SECBINFHSA-N 282.304 -0.180 5 20 CBBD O=C(NCCN1CCNCC1)c1cc([N+](=O)[O-])cnc1O 592289860 NRMLSWHXLBWBNM-UHFFFAOYSA-N 295.299 -0.670 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCC(NCCO)CC2)n1 601327944 AEVIHYUDNIUJNK-UHFFFAOYSA-N 283.332 -0.162 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N[C@H]1CCCN(CCO)C1=O 613701493 YTKZTCCLIVDELT-QMMMGPOBSA-N 283.288 -0.277 5 20 CBBD COC[C@](C)(O)C(=O)OCCn1cc([N+](=O)[O-])cn1 748130127 VTHILLKWCLOBGH-JTQLQIEISA-N 273.245 -0.268 5 20 CBBD CCC(=O)N[C@@H](C)C(=O)OCCn1cnc([N+](=O)[O-])n1 749075695 GRHMFHPHOHESDN-ZETCQYMHSA-N 285.260 -0.356 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1C[C@H]2C[C@@]2(CO)C1 782977338 NMXQJXIGOJTWRS-SKDRFNHKSA-N 295.299 -0.185 5 20 CBBD CC(=O)NCCOCCCNc1ncc([N+](=O)[O-])c(N)n1 1115374686 OTYGQQKIPVWRDX-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC[C@H](C(N)=O)C1 1263483500 PWBUEEUZDHZBJV-ZETCQYMHSA-N 268.277 -0.707 5 20 CBBD CCCN(CC(N)=O)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1324305541 XPABXMQVUZXMPE-UHFFFAOYSA-N 296.283 -0.520 5 20 CBBD CNC[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332400399 LMPNPVHULHZWTH-SECBINFHSA-N 282.304 -0.356 5 20 CBBD O=C(NCc1nnc2n1CCC2)c1c[nH]nc1[N+](=O)[O-] 1340017081 SOBJTFCOBHZRGU-UHFFFAOYSA-N 277.244 -0.214 5 20 CBBD C[C@H]1C[C@H](C(=O)O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1589269190 RPYHTZRDGMDTBJ-YUMQZZPRSA-N 297.271 -0.245 5 20 CBBD CN1CC[C@@H](n2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1604856392 XVMBMCHPSGHHLA-RXMQYKEDSA-N 278.232 -0.625 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])s1 36977495 HZIGGLWSRCVKLR-BYPYZUCNSA-N 260.227 -0.168 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)NC(CO)CO 87749483 FJEDJITUMDBDHA-UHFFFAOYSA-N 254.242 -0.393 5 20 CBBD COC(=O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 129560753 NHZQZQKWSFTGQS-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2CNC[C@@H]2C1 195248661 OXFSNPDWQQJDHL-DTORHVGOSA-N 265.273 -0.531 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 217712211 CUKWUGGUAYELTC-SECBINFHSA-N 268.225 -0.142 5 20 CBBD COC[C@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])cn1 229795105 POJFMNRZTPJCFX-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCN1C(=O)CNC1=O 264958220 MYBSVCNCVBSNBF-UHFFFAOYSA-N 268.233 -0.708 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)N1CCN(C)CC1 285390629 CALUUKJKODLLQX-SECBINFHSA-N 296.331 -0.316 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cncc2nncn12 347043123 CZEPHLNPBWPDJF-UHFFFAOYSA-N 288.227 -0.132 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CN2CCN1CC2 356733844 ULNPEZUEAFZXLZ-SECBINFHSA-N 294.315 -0.942 5 20 CBBD C[C@@H]1NCC[C@@H](C)[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 357295162 JTWOCKPBKPGEJD-WEDXCCLWSA-N 282.304 -0.311 5 20 CBBD O=C(CCN1C[C@@H](O)[C@H](O)C1)Nc1ccc([N+](=O)[O-])cc1 444695357 MFPUQLIGRFGQCH-VXGBXAGGSA-N 295.295 -0.039 5 20 CBBD NC(=O)c1ccc(N2CC[C@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 582519195 INZYYXOYEMIDTM-SKDRFNHKSA-N 295.295 -0.127 5 20 CBBD CCN(C)S(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])[nH]1 744239411 SNTQINBOUOAHHM-UHFFFAOYSA-N 276.274 -0.151 5 20 CBBD O=C1CC[C@@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CN1 748116028 JPLROELTPSCBJO-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD COc1cccc(C(=O)OCC(=O)NC(N)=O)c1[N+](=O)[O-] 769600763 GXTZGWAWHLLREI-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1ncc([N+](=O)[O-])c(N)n1 782399952 SYARVEVBTDUKQK-LURJTMIESA-N 266.261 -0.366 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])NCCn1cnnn1 807918647 BNYFMUPCRSTXPR-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD COC(=O)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839627404 OJJWDDQWLOQSDR-DJLDLDEBSA-N 271.273 -0.001 5 20 CBBD O=C(NC[C@@H]1CCCN1CCCO)[C@@H]1C[C@H]1[N+](=O)[O-] 839781110 IVVLHFCYZMRNAI-HBNTYKKESA-N 271.317 -0.385 5 20 CBBD O=C(CCCN1C(=O)CNC1=O)OCCC[N+](=O)[O-] 860912409 NFAMNFIGTADDIC-UHFFFAOYSA-N 273.245 -0.472 5 20 CBBD CN(C(=O)c1cc[nH]c1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954479072 IZUTXOGZHYCEPJ-GHMZBOCLSA-N 292.295 -0.037 5 20 CBBD Cn1c(S)nnc1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1320949699 WHERDWAIXZRVDB-UHFFFAOYSA-N 297.300 -0.292 5 20 CBBD Cc1[nH]nc(C(=O)N2CCCN(C=O)CC2)c1[N+](=O)[O-] 1327913991 QYVBKKLGKKYQRZ-UHFFFAOYSA-N 281.272 -0.069 5 20 CBBD NC(=O)[C@@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 1329020065 YIVXYOMNBRMDHG-SNVBAGLBSA-N 269.261 -0.975 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)O[C@@H]1CCOC1=O 1341454985 FKDLNRVGXGEICZ-ZCFIWIBFSA-N 255.186 -0.199 5 20 CBBD COCCNC(=O)CN=c1c(C)c[nH]cc1[N+](=O)[O-] 1346011862 HIYPXEWSBPJWHV-UHFFFAOYSA-N 268.273 -0.105 5 20 CBBD COC[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@@H](C)O1 1350598046 MBNUIOIUMOXFGK-RKDXNWHRSA-N 285.304 -0.168 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@]12CCC[C@@H]1NCC2 1580578797 LNZCPIBSVOVNJR-GZMMTYOYSA-N 280.288 -0.413 5 20 CBBD COC(=O)[C@@H]1[C@H](C(=O)O)[C@H]2CC[C@H]1N2CC[N+](=O)[O-] 1598737101 HXRVSFTYTSZFAN-BGZDPUMWSA-N 272.257 -0.400 5 20 CBBD CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cnn(C)n1 1753049028 PAMYNRHTJNPETL-NXEZZACHSA-N 282.304 -0.972 5 20 CBBD CCc1nn(C)c(N2CCNC(=O)C2)c1[N+](=O)[O-] 92826830 GLMATLNUSPLEGJ-UHFFFAOYSA-N 253.262 -0.173 5 20 CBBD C[C@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 178436495 SRVBPIHMGNBQSY-QMMMGPOBSA-N 298.303 -0.433 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@@H](O)C1 236345767 IBMDZOZKIOXLFP-UWVGGRQHSA-N 267.241 -0.645 5 20 CBBD O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H](O)CN1 238000172 BKHUZGBWWUCNBF-MWLCHTKSSA-N 294.311 -0.154 5 20 CBBD COC[C@@H](O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 278092053 QEHANHLPCYHHLQ-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD COC[C@@H](CCO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 278217875 RVAJEIMTJPBBDQ-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD COCCN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285500435 XPVPDHVPERNNTQ-UHFFFAOYSA-N 285.304 -0.032 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 292523851 LKGGFRZUMMJTEE-YUMQZZPRSA-N 270.245 -0.679 5 20 CBBD C[C@H]1CNCC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 432514613 MXDZAUNEORSXCK-DTWKUNHWSA-N 267.289 -0.095 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(=O)N(C)C[C@@H]2C)c1[N+](=O)[O-] 783760131 NJBYZWDXQXKSNB-LURJTMIESA-N 281.272 -0.071 5 20 CBBD COC[C@@H](CO)NS(=O)(=O)c1csc([N+](=O)[O-])c1 795281306 DKRMKNLNVSVQNC-ZCFIWIBFSA-N 296.326 -0.058 5 20 CBBD CC(CO)(CO)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 820281206 TYSVRNOXHOYCPN-UHFFFAOYSA-N 294.271 -0.070 5 20 CBBD Nc1ccc(C(=O)OCC(=O)NCC(=O)O)cc1[N+](=O)[O-] 821369662 YWHFEXJWPZNBOT-UHFFFAOYSA-N 297.223 -0.465 5 20 CBBD O=C(O)Cn1cc(CCn2cccc([N+](=O)[O-])c2=O)nn1 833273402 MQTZNVSGRHGKMS-UHFFFAOYSA-N 293.239 -0.325 5 20 CBBD COC(=O)C(=O)CCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840672906 FGSISURCJLWNLL-RNFRBKRXSA-N 259.214 -0.283 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnco1 996653806 FKZNMFNZQZQCBJ-HTQZYQBOSA-N 280.240 -0.720 5 20 CBBD COCC(=O)N1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1017444266 VVMJQDNROMYVHD-GHMZBOCLSA-N 297.311 -0.427 5 20 CBBD CCn1ncnc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767695 RSPIKYCMAUKMLK-NXEZZACHSA-N 296.331 -0.441 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1C(=O)CCC1=O 1323235419 ZGKISNJKVCMKIV-UHFFFAOYSA-N 295.255 -0.793 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1(C(N)=O)CCCC1 1324658804 VJMOTFOIMCUITE-UHFFFAOYSA-N 281.272 -0.144 5 20 CBBD CN1C[C@@H](Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)OC1=O 1330310530 KKFSSEJPUBPNHX-ZETCQYMHSA-N 296.239 -0.694 5 20 CBBD O=C(N[C@H]1CCCS(=O)(=O)C1)c1n[nH]cc1[N+](=O)[O-] 1341368548 BOVYTVRFGJRUPR-LURJTMIESA-N 288.285 -0.375 5 20 CBBD C[C@@H](O)[C@H](NC1CC(n2cc([N+](=O)[O-])cn2)C1)C(=O)O 1599845932 KSSQCZPUNAMFGT-NSDNXHHOSA-N 284.272 -0.082 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](CO)OC[C@H]1C 154276729 NGLPJBXLHRZBAA-SCZZXKLOSA-N 298.299 -0.292 5 20 CBBD CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 265732475 RIEHLNIDPBFUOR-ZETCQYMHSA-N 252.230 -0.117 5 20 CBBD COCCN(CCO)C(=O)Cn1cc([N+](=O)[O-])nc1C 270172319 AMFMVFQYRGSHOZ-UHFFFAOYSA-N 286.288 -0.433 5 20 CBBD CC(C)(C(N)=O)N1CCN(c2ncc([N+](=O)[O-])cn2)CC1 274061292 ZZNRNRSRPGPKFJ-UHFFFAOYSA-N 294.315 -0.229 5 20 CBBD CC(=O)N1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 301641351 GQWUDDSZGQWETK-ZETCQYMHSA-N 266.261 0.000 5 20 CBBD Cn1c(Cn2nccc2[N+](=O)[O-])cc(=O)n(C)c1=O 341035578 RJOPNEJSTOQSFQ-UHFFFAOYSA-N 265.229 -0.763 5 20 CBBD NC(=O)Cn1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cn1 343186725 IAJBACRTRRCWNH-UHFFFAOYSA-N 278.228 -0.143 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC(=O)N1 345498780 BQXHUTZJNDICCS-SSDOTTSWSA-N 281.272 -0.273 5 20 CBBD Cc1nc(=NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])o[nH]1 354575631 JXSACLHNFLHZML-UHFFFAOYSA-N 252.190 -0.008 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC1(CO)CCOCC1 355174908 YRSCMMVELMVCFR-UHFFFAOYSA-N 296.283 -0.157 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CCNCC1 428300606 HYBHRTKOXZGJME-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD COC(=O)NCC(=O)OCCn1ccc([N+](=O)[O-])n1 493153699 FTSGZXGFZXGSHO-UHFFFAOYSA-N 272.217 -0.310 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)OC[C@@H]2C1 495656307 IVIBNIXXUSAOPQ-LURJTMIESA-N 281.228 -0.406 5 20 CBBD COCCNCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 564083428 JWAGLJHIVKBMQI-UHFFFAOYSA-N 257.250 -0.716 5 20 CBBD CC[C@H](CO)NC(=O)c1ccnc(NC)c1[N+](=O)[O-] 565176976 IFTCZWBLEBQXSY-SSDOTTSWSA-N 268.273 0.532 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC2CC1(C(=O)O)C2 595244563 KSUTUUCAANGBRC-UHFFFAOYSA-N 280.240 -0.133 5 20 CBBD CN1C(=O)C[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1=O 596138263 SVKNKMRXQHRCLB-QMMMGPOBSA-N 292.251 -0.137 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)c1n[nH]cc1[N+](=O)[O-] 598184093 UCDMSMBMTOFMJA-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD O=C(N[C@H]1CCO[C@H]1C(=O)O)c1ccc([N+](=O)[O-])[nH]1 702963395 OJLKUVZZFMVLJA-YLWLKBPMSA-N 269.213 -0.105 5 20 CBBD CN[C@@H](C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 722037154 KPDKEZMVAXRGPH-QMMMGPOBSA-N 255.278 -0.095 5 20 CBBD O=C1CN(NC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)N1 752692255 MYUDXNBHOWMFEN-UHFFFAOYSA-N 264.197 -0.209 5 20 CBBD O=C(O)C[C@@H]1C(=O)NCCN1CCn1ccc([N+](=O)[O-])n1 833207095 HTWYPTBLRUJYPP-MRVPVSSYSA-N 297.271 -0.934 5 20 CBBD CC[C@]1(C)NC(=O)N(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839463223 AZUQLQRCPGQWAC-DGAHNEANSA-N 270.245 -0.597 5 20 CBBD COC(=O)C[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCOC1 840425179 WOWBNHQIZBPART-KBVBSXBZSA-N 286.284 -0.120 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 863017193 PBSPRYNRERCBAG-SSDOTTSWSA-N 298.255 -0.774 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@@H](O)C1 863319726 FGBUOEXPMTVGOH-SECBINFHSA-N 295.299 -0.632 5 20 CBBD CNC[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923295025 QNDKWIONQJAMNW-PWSUYJOCSA-N 283.332 -0.164 5 20 CBBD O=C(NC1CN(C(=O)c2ccncc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991279507 MBEFWFOFBFQNHG-GHMZBOCLSA-N 290.279 -0.313 5 20 CBBD O=C(C(F)F)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1009678618 RZZIYAOVCXLDIK-RNFRBKRXSA-N 277.227 -0.413 5 20 CBBD O=C1NC(=O)[C@H]2CN(c3ccnc(O)c3[N+](=O)[O-])C[C@@H]12 1327715824 YYFADAYVSYXXMS-OLQVQODUSA-N 278.224 -0.596 5 20 CBBD O=C1CNC(=O)N1CCNc1ccnc(O)c1[N+](=O)[O-] 1333701241 UJONQTPEHBBGLX-UHFFFAOYSA-N 281.228 -0.341 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@](C)(O)C(=O)O 1574429488 RSHFEIYBWUKPCO-SNVBAGLBSA-N 286.244 -0.948 5 20 CBBD CCOCCNC(=O)Cn1cc([N+](=O)[O-])c(C(=O)O)n1 1596929830 ZEFWHUHQGNNUHM-UHFFFAOYSA-N 286.244 -0.358 5 20 CBBD CO[C@](C)(C(=O)O)C(=O)OCc1cn(C)nc1[N+](=O)[O-] 1604472826 GSIJLBYJOZGSKK-SNVBAGLBSA-N 287.228 -0.139 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NC(=O)NCCOCC(=O)O 1607911664 RZEQPZCDPDRZCB-UHFFFAOYSA-N 298.255 -0.057 5 20 CBBD O=C1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 50131304 BRYJMECVGUMLFV-UHFFFAOYSA-N 252.230 -0.017 5 20 CBBD COc1ccc(C(=O)NOCC(N)=O)cc1[N+](=O)[O-] 124195257 XOVMPGVFLNZTMJ-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCS(=O)(=O)C1 157414138 SZGJBSRJYISAET-SECBINFHSA-N 288.329 -0.090 5 20 CBBD COC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 163362921 NQPRWOLTKFENPO-ZCFIWIBFSA-N 270.245 -0.223 5 20 CBBD O=C(NCC[C@H](O)C(=O)O)c1cc([N+](=O)[O-])c[nH]1 236538239 DTISUSVEUFUGRZ-ZETCQYMHSA-N 257.202 -0.512 5 20 CBBD CC1(C(=O)NCCn2cc([N+](=O)[O-])cn2)COC1 272884002 HWSNJGKRRHNRGN-UHFFFAOYSA-N 254.246 -0.056 5 20 CBBD COC(=O)[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 276506455 YVEGYALLLOLGFO-GHMZBOCLSA-N 298.299 -0.307 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 285814480 DYOGMAGYMQIUAG-YLWLKBPMSA-N 267.245 -0.428 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H]1CO 331261028 BOPFPFCHEUYQRI-SFYZADRCSA-N 269.261 -0.584 5 20 CBBD NC(=O)C[C@@H](N)C(=O)NCCNc1ccc([N+](=O)[O-])cc1 353092270 XVMOHPNRNWBKDC-SNVBAGLBSA-N 295.299 -0.674 5 20 CBBD COC[C@H](O)CCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357459792 PWTAQYXSBFYDHS-SSDOTTSWSA-N 284.272 -0.102 5 20 CBBD Cn1c(C(=O)N2CC(CC(N)=O)C2)ccc1[N+](=O)[O-] 358128232 PYKXMUUYZWYHHE-UHFFFAOYSA-N 266.257 -0.119 5 20 CBBD CC1(C)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](CO)O1 421950034 YASXGNZGTWUFHL-SSDOTTSWSA-N 284.272 -0.070 5 20 CBBD C[C@@H]1CCNC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427573567 KKGNABTYKQRKSS-HTQZYQBOSA-N 268.277 -0.700 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O 436883073 AXYLUVOJXBVASR-UHFFFAOYSA-N 289.269 -0.681 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(=O)N(C)C(=O)C2)c1[N+](=O)[O-] 550159899 RGIXTKDMJJIGRL-UHFFFAOYSA-N 281.228 -0.933 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1CC(=O)NCC(=O)O 563147243 DKDATMOAJQABLW-UHFFFAOYSA-N 269.213 -0.734 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 619255420 XZZNCEFBEOHIOL-JTQLQIEISA-N 292.251 -0.348 5 20 CBBD COC[C@@H](O)C(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 766149092 QAZPTTJTGGKYMF-SNVBAGLBSA-N 298.251 -0.256 5 20 CBBD CN(CC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 818402479 OGBALDVAKGMWJA-QMMMGPOBSA-N 258.234 -0.831 5 20 CBBD Nc1nc(N2CC[C@](F)(C(=O)O)C2)ncc1[N+](=O)[O-] 833091252 LJLKNPROSVPOJS-SECBINFHSA-N 271.208 -0.030 5 20 CBBD Cn1cc(CCOC(=O)Cn2cc([N+](=O)[O-])cn2)nn1 851371140 VINYPLXGABHBOL-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD CC(=O)N1CCN(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 967163098 MHVYMLFQSUBWNR-VXGBXAGGSA-N 296.327 -0.974 5 20 CBBD O=C(NC1CN(C(=O)c2ccc[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991281709 VJNPNSGATUMSCV-PSASIEDQSA-N 278.268 -0.380 5 20 CBBD NC(=O)C(=O)NCCCNc1ncc([N+](=O)[O-])cc1F 1094742373 VDFYMGALVBIVAS-UHFFFAOYSA-N 285.235 -0.468 5 20 CBBD CC[C@@H](N)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261494965 LQDIBWAWIYFIJQ-MRVPVSSYSA-N 268.273 -0.390 5 20 CBBD O=C1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CN1 1319260609 ANMXCLYNBPKYSS-QMMMGPOBSA-N 281.272 -0.566 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ncn(C)n1 1320847052 AHSFFIXNQSAGKF-SSDOTTSWSA-N 279.260 -0.203 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 1320967787 QYLJDEMVDOYSDI-ZETCQYMHSA-N 273.274 -0.748 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 88373731 UZLUALHNESQZRB-ZETCQYMHSA-N 284.228 -0.897 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN(CCO)CCCO 90548690 GVNZTYRVWGSZGM-UHFFFAOYSA-N 285.300 -0.567 5 20 CBBD NC(=O)[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CCO1 92734810 GDUUSTKEQIEBJB-NSHDSACASA-N 281.268 -0.014 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 264814392 WFOHHPHCMBUWOH-SECBINFHSA-N 295.299 -0.224 5 20 CBBD COC(=O)N1CC(Nc2ncc([N+](=O)[O-])c(N)n2)C1 269414132 ZZVSYMYIYHYKPV-UHFFFAOYSA-N 268.233 -0.171 5 20 CBBD COC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])c(C)n1 273133608 RHDWTGRVCWBQSN-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD COCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 281244885 DEPCQJLAYLIWOJ-ZETCQYMHSA-N 285.256 -0.177 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCO[C@H]1C1CC1 340659315 AABGOFIMRFLXSR-SCZZXKLOSA-N 281.272 -0.130 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCCn2ncnn2)n1 342681027 QKUMOVYMVGFBMS-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD CC(=O)NC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 344503177 YKMSGEFPXHXXTD-VIFPVBQESA-N 296.283 -0.100 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 353953173 SSVDNYPXCVIUPE-ZCFIWIBFSA-N 281.272 -0.111 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](CO)O1 355077742 ZLWHMEMKCGGGQY-RQJHMYQMSA-N 270.245 -0.460 5 20 CBBD O=C(NCCCn1cc(CO)nn1)c1cc([N+](=O)[O-])n[nH]1 356672076 PVTKCBWBOBLUAS-UHFFFAOYSA-N 295.259 -0.778 5 20 CBBD NC(=O)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 358525566 AORTWCPLKFYDOX-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 572899092 SKPUCRIMGUSSPZ-LBPRGKRZSA-N 295.299 -0.632 5 20 CBBD C[C@H](O)C(=O)N1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 590583494 YEKCGJWBIGPUSP-QMMMGPOBSA-N 295.299 -0.399 5 20 CBBD NC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1 610976765 QGYONNNVLWNMQR-UHFFFAOYSA-N 267.245 -0.685 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CO)C1CC1 771034894 PAZZQWZYRNOEFT-VIFPVBQESA-N 268.273 -0.013 5 20 CBBD O=C(O)[C@@H](O)CNS(=O)(=O)c1csc([N+](=O)[O-])c1 776536855 CLFUWXVEHOCHMO-YFKPBYRVSA-N 296.282 -0.620 5 20 CBBD COCC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 795422171 OXHMTPBBBKRHCS-UHFFFAOYSA-N 257.202 -0.450 5 20 CBBD CC(C)(C)OCCS(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842370926 ATGZDBQCHNQZDE-HTQZYQBOSA-N 294.329 -0.087 5 20 CBBD Cn1nccc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292794 VYKLHPILULXTBZ-GHMZBOCLSA-N 279.300 -0.614 5 20 CBBD NC(=O)C(=O)NC/C=C\CNc1ncc([N+](=O)[O-])cc1F 1107480550 MVTHNOVIWMCSNO-UPHRSURJSA-N 297.246 -0.302 5 20 CBBD NC(=O)c1ccnc(N2CC[C@H](C(=O)O)C2)c1[N+](=O)[O-] 1594653302 IUFJDNGLLAQGBQ-LURJTMIESA-N 280.240 0.000 5 20 CBBD CN(CC(N)=O)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] 1604716425 BUZKRRQWQQSVLM-UHFFFAOYSA-N 291.271 -0.308 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1O 1610683708 XXSRTWZSRBLZFW-SSDOTTSWSA-N 270.197 -0.524 5 20 CBBD N[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 158452200 UKSRJZLZFIADKW-VIFPVBQESA-N 280.284 -0.294 5 20 CBBD O=C(CNC(=O)COc1cccc([N+](=O)[O-])c1)NCCO 268559643 AYSYKEMQWOQABD-UHFFFAOYSA-N 297.267 -0.802 5 20 CBBD CN(CC(C)(CO)CO)c1c([N+](=O)[O-])ncn1C 269965603 NFGZJEOWAFTSQG-UHFFFAOYSA-N 258.278 -0.245 5 20 CBBD CNC(=O)[C@H]1CCCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 298776486 UTNZMQDFDKMBTJ-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CNC(=O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 354022338 NKBMGPXZELNTRA-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCCNC1=O 371574231 ZAUOPHGIFOXQJK-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD NS(=O)(=O)c1c(NC[C@H](O)CO)cccc1[N+](=O)[O-] 559626367 NVDAGZNUVJNFQI-LURJTMIESA-N 291.285 -0.993 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCCC[C@H]1C(=O)O 598659360 CCHNLSAESGNTSL-SFYZADRCSA-N 297.271 -0.054 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 619249907 ZAZKYMDAMWDUOF-JTQLQIEISA-N 270.245 -0.377 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@@H]2CCCS(=O)(=O)C2)c1 775414537 NUMOVBNDMKZILG-SECBINFHSA-N 288.329 -0.042 5 20 CBBD C[C@@H](O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 791793161 IQXFYXHBMPLMPW-SSDOTTSWSA-N 256.214 -0.320 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(Cc3ccon3)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] 1025775937 SGPKDXYGXRMWHI-ZIQFBCGOSA-N 292.295 -0.114 5 20 CBBD CCc1nc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)no1 1030292058 ROCHEOKKSVABMV-RKDXNWHRSA-N 295.299 -0.402 5 20 CBBD CC(C)(O)C1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1320493425 BMXXZUBJIPMPHS-LLVKDONJSA-N 284.316 -0.145 5 20 CBBD Cn1cnnc1COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1320556915 JTCJTNDMXHAMCG-UHFFFAOYSA-N 293.239 -0.372 5 20 CBBD CO[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])CCO1 1324238422 ZBGHOZAQRUUFKX-MRVPVSSYSA-N 282.256 -0.102 5 20 CBBD C[C@H]1[C@@H](C(=O)O)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1609835924 UBQSFYMLSBGUNH-BQBZGAKWSA-N 283.244 -0.492 5 20 CBBD NC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 178167895 AWUPAWXSGZJLHW-SECBINFHSA-N 253.262 -0.355 5 20 CBBD C[C@](O)(CO)CNc1nc(O)c2cc([N+](=O)[O-])ccc2n1 343059102 AUGJEJDTMPHCTH-GFCCVEGCSA-N 294.267 0.399 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(CCO)CC1 343181144 BDSWLZNBFMLYAF-UHFFFAOYSA-N 269.261 -0.932 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCCOCCO 352094043 WRJSEUHWZRZCFJ-UHFFFAOYSA-N 284.272 -0.299 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1COC[C@@H]1O 353360844 MQMZNBSBNBIHCR-IUCAKERBSA-N 255.230 -0.245 5 20 CBBD CNC(=O)CCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359027260 GKJOEXVEKKLPIU-UHFFFAOYSA-N 267.245 -0.331 5 20 CBBD COc1ccc(NC(=O)[C@@H](CO)NC(N)=O)cc1[N+](=O)[O-] 360749755 ZQSDKXKNTJCXPP-SSDOTTSWSA-N 298.255 -0.429 5 20 CBBD CC(C)NC(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 548083460 ADOPJRZSFSMGRW-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 549202005 RPMSERFAODEIBX-HTRCEHHLSA-N 281.272 -0.038 5 20 CBBD N[C@@H]1C[C@@H]2CN(c3ncc([N+](=O)[O-])cc3F)CCN2C1=O 569139739 SSYXZIPCOVKQMS-PSASIEDQSA-N 295.274 -0.123 5 20 CBBD CC[C@@H](N)CNS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 583752723 ZUCUZBJYNSMJHQ-SSDOTTSWSA-N 291.333 -0.173 5 20 CBBD O=C(CN=c1c(Cl)c[nH]cc1[N+](=O)[O-])NCCO 596158383 WOTIUKDJTYQJPT-UHFFFAOYSA-N 274.664 -0.415 5 20 CBBD COC(=O)[C@](C)(O)CNc1c([N+](=O)[O-])c(C)nn1C 613332111 WZXMBZUJYFFFSR-SNVBAGLBSA-N 272.261 -0.027 5 20 CBBD O=[N+]([O-])c1cnn(CCn2cnc([N+](=O)[O-])n2)c1 741732900 DCILQDHYTNRRMT-UHFFFAOYSA-N 253.178 -0.009 5 20 CBBD COC[C@](C)(O)C(=O)OCCn1ccc([N+](=O)[O-])n1 748128234 BSVGZNUHDOLYGF-JTQLQIEISA-N 273.245 -0.268 5 20 CBBD Cn1nnnc1COC(=O)c1c([N+](=O)[O-])cnn1C 766967640 SICOXLHLKAGHME-UHFFFAOYSA-N 267.205 -0.791 5 20 CBBD CCc1[nH]nc(C(=O)O[C@H](C)C(N)=O)c1[N+](=O)[O-] 790072987 GTOBDBHIOFSRBX-SCSAIBSYSA-N 256.218 -0.089 5 20 CBBD Cn1ccnc1N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839684947 CZTRYJAQSSMZCB-NXEZZACHSA-N 279.300 -0.266 5 20 CBBD CCS(=O)(=O)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839783036 SGGFSYUKLBMUMU-HTQZYQBOSA-N 262.287 -0.703 5 20 CBBD O=C(NS(=O)(=O)C[C@@H]1CCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 842331539 GGQZUNXDTIUEJU-XLPZGREQSA-N 278.286 -0.723 5 20 CBBD CCONC(=O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 846499331 OLDIWCAIZLBFMV-UHFFFAOYSA-N 282.256 -0.026 5 20 CBBD CC(F)(F)C(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001795165 BLBUUFZQJPRHFS-HTQZYQBOSA-N 291.254 -0.119 5 20 CBBD COCC[C@@H](Nc1c([N+](=O)[O-])ncn1C)C(N)=O 1254166448 VXXLIDRRVZGFMM-ZCFIWIBFSA-N 257.250 -0.369 5 20 CBBD COCC[C@H](CO)NC(=O)c1c([N+](=O)[O-])cnn1C 1321199080 IQUILRUHTHLWPJ-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD Cc1nc(NCCn2cnnn2)ncc1[N+](=O)[O-] 1326505835 LAOQAVQEQWMWTA-UHFFFAOYSA-N 250.222 -0.208 5 20 CBBD N[C@H](CO)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 1574261944 HELXGEDSGUFDCK-GFCCVEGCSA-N 294.311 -0.437 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2C[C@@H]3C[C@H]2CN3)n1 1579970520 YFMOFVCRAGHLII-BQBZGAKWSA-N 287.301 -0.937 5 20 CBBD O=C(NC[C@@H](C(=O)O)[C@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 1601457333 SQHZRUYJARHESI-NKWVEPMBSA-N 298.255 -0.215 5 20 CBBD CC[C@@H](O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 124699235 CAURWXJAHKHDRF-ZJUUUORDSA-N 258.278 -0.487 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCCC[C@@H]1C(N)=O 130360550 BLDZMQWDDBKXEZ-SECBINFHSA-N 295.299 -0.034 5 20 CBBD COCC[C@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 231682541 SZXDYJARUZZEDP-NSHDSACASA-N 286.288 -0.305 5 20 CBBD CCOC(=O)c1cc(C(=O)NCC(N)=O)cc([N+](=O)[O-])c1 263667096 DJTXHWFRNYKLTJ-UHFFFAOYSA-N 295.251 -0.013 5 20 CBBD CCN(CCO)CCNC(=O)c1cc([N+](=O)[O-])c[nH]1 345804525 AVHWWTMBGWGHKT-UHFFFAOYSA-N 270.289 -0.033 5 20 CBBD CCOC[C@@H](O)CNc1ccc2ncc([N+](=O)[O-])n2n1 347856036 DKGATIGUXLAKLE-QMMMGPOBSA-N 281.272 0.447 5 20 CBBD O=C(NC[C@@H]1CC[C@H](CO)O1)c1cc([N+](=O)[O-])cnc1O 356548889 MOWUAGHIJPWWDY-DTWKUNHWSA-N 297.267 -0.035 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CN1 358884122 NIAFMRZEUCHIJU-SSDOTTSWSA-N 285.281 -0.238 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@@H](CO)[C@@H](O)C1 546693807 RNUWGOPCRAZIKD-XVKPBYJWSA-N 297.267 -0.489 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC2CNC2)c1 592158750 OIMFHMPWWPDCQK-UHFFFAOYSA-N 267.241 -0.238 5 20 CBBD O=C1CN(CCN=c2c(Cl)c[nH]cc2[N+](=O)[O-])CCN1 596190848 YOTQLCHHJNKHEI-UHFFFAOYSA-N 299.718 -0.091 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc(C(N)=O)cc1[N+](=O)[O-] 808047631 RIRLPXXXIBHBOU-VIFPVBQESA-N 282.256 -0.788 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(CCCO)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] 1025775186 BPRJANSEOFSEIC-NZFPMDFQSA-N 269.301 -0.920 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCc1ncn(C)n1 1319933599 LVXDHPWJQLKTAY-UHFFFAOYSA-N 279.260 -0.455 5 20 CBBD C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)C[C@H](C(=O)O)O1 1328784503 WBTYPPJKZOBZAE-RKDXNWHRSA-N 284.272 -0.035 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 1336289281 FDUFKMJDHKSVET-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD COCC[C@H]1CNCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1579010349 JEEAPKBHLBMUOB-IVZWLZJFSA-N 257.290 -0.512 5 20 CBBD C[C@H](OC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)NCC(=O)O 1604409155 LUVOWZZPBUEWKS-LURJTMIESA-N 299.239 -0.321 5 20 CBBD CCC[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 179385171 YZSASNYNRNIYAE-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1CC(N)C1 294881934 QDXBJKYXEKZCNA-UHFFFAOYSA-N 253.262 -0.261 5 20 CBBD COC(=O)C1(C)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 425275476 BQLMJTBSEFFWMK-UHFFFAOYSA-N 267.245 -0.034 5 20 CBBD C[C@H]1CNCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 432516996 YMLLPEBMEMYEEM-ONGXEEELSA-N 294.311 -0.129 5 20 CBBD CCN1CCN(CCNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 514749383 WQSPASFCHHURSE-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD O=C(NC[C@@H]1CCCNC1=O)c1cnc(O)c([N+](=O)[O-])c1 590333263 JLQMAZBBQJKAEP-ZETCQYMHSA-N 294.267 -0.049 5 20 CBBD CN(C)[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@@H]1O 596242245 STLWPVDWCQFDTK-RYUDHWBXSA-N 294.311 -0.195 5 20 CBBD Cn1c(C(=O)OCc2nc(=O)n(C)[nH]2)ccc1[N+](=O)[O-] 765432243 TZDLIGRXGCRGSK-UHFFFAOYSA-N 281.228 -0.288 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCn1ccnn1 782491951 HZBCQPKESBKZEF-UHFFFAOYSA-N 292.255 -0.836 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)C(N)=O 787166936 GLZHOXHNIIKASF-VIFPVBQESA-N 282.256 -0.593 5 20 CBBD CCCc1[nH]nc(C(=O)Nn2c(O)nnc2O)c1[N+](=O)[O-] 816732422 GDZPPVQVIKOWRS-UHFFFAOYSA-N 297.231 -0.343 5 20 CBBD C[C@H]1CN(c2c([N+](=O)[O-])cnn2C)C[C@@H](CO)O1 893416348 IESJUYVZMQLHIF-YUMQZZPRSA-N 256.262 -0.086 5 20 CBBD CC(=O)N(CCO)CCNc1ncc([N+](=O)[O-])c(N)n1 1111423373 ZSJSWUIDJWGKKT-UHFFFAOYSA-N 284.276 -0.780 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1N 1118270179 XCUCLIKIDWDLFC-RKDXNWHRSA-N 282.304 -0.228 5 20 CBBD CNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 1253671117 HSZOFFBMNJRQBA-LURJTMIESA-N 269.261 -0.650 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]1C(=O)O 1608276858 NKOYUBLJLFGFBE-ZETCQYMHSA-N 266.213 -0.129 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 35175381 FDUSMTNLUVMMPG-ZETCQYMHSA-N 271.229 -0.803 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 156666785 GSILABOOXPBKHP-UHFFFAOYSA-N 285.281 -0.109 5 20 CBBD CC(=O)NC1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 191477438 AQMQUYXMIVFQHD-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD CC(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 227884841 UWRNGJBVIXXVPU-UHFFFAOYSA-N 281.272 -0.174 5 20 CBBD O=C(CN1CCNCC1=O)NCc1ccccc1[N+](=O)[O-] 238109314 WUZWPHXKLJUWQW-UHFFFAOYSA-N 292.295 -0.357 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1ccc([N+](=O)[O-])[nH]1 264977092 OUBGSHNRAIZZBT-UHFFFAOYSA-N 281.228 -0.796 5 20 CBBD CNC(=O)[C@@H](CO)Nc1ccc([N+](=O)[O-])c(C)n1 302159338 OWBGSYCTIFLPNP-SSDOTTSWSA-N 254.246 -0.183 5 20 CBBD COC[C@@](C)(NCc1c([N+](=O)[O-])ncn1C)C(=O)OC 347547670 XUEAPPKZXHNSQO-LLVKDONJSA-N 286.288 -0.004 5 20 CBBD O=C(NC[C@@H](O)[C@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 354059144 PBAVCJXOEQUMMZ-POYBYMJQSA-N 270.245 -0.555 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](CN)C1 571678081 BHPFOXUPIGFQTA-SSDOTTSWSA-N 268.277 -0.967 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 583762831 HNUSORHYPICFGD-SSDOTTSWSA-N 280.240 -0.580 5 20 CBBD Nc1nc(N2C[C@@H]3[C@@H](CO)[C@@H]3C2)ncc1[N+](=O)[O-] 589871959 YERVYUKKDACXJH-ZMONIFLSSA-N 251.246 -0.359 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCc1nc(N)n[nH]1 596236288 GBEHYESOXOQARB-UHFFFAOYSA-N 252.238 -0.317 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1cc([N+](=O)[O-])n[nH]1 598224824 FYRMHLGOXAHURF-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)N(C)C 602124189 KWWTXXOKQAFZJI-MRVPVSSYSA-N 255.278 -0.142 5 20 CBBD O=C(O)CCNC(=O)Cn1cccc([N+](=O)[O-])c1=O 739733054 GBLMMLVWHSFQLC-UHFFFAOYSA-N 269.213 -0.653 5 20 CBBD NC(=O)[C@H](O)CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] 808050229 CKJRKWHWZBONOU-SSDOTTSWSA-N 270.201 -0.239 5 20 CBBD O=C(N[C@@H]1CCCN(CCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 839781345 MYJFJLGAZUVRCW-GMTAPVOTSA-N 271.317 -0.385 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](CNc2ncccc2[N+](=O)[O-])C1 1068573707 URZWJPLRRJDNPJ-ZKCHVHJHSA-N 293.283 -0.218 5 20 CBBD CC(=O)NCC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-] 1093455175 AIAWXSOMDWSGRI-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1nnc(CCC[N+](=O)[O-])n1C 1121380927 GNNODQKPYDPYIZ-VIFPVBQESA-N 296.331 -0.309 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NN1CCCC1=O 1319950585 VUUXFWVWNOSVNE-UHFFFAOYSA-N 253.218 -0.555 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCNC1=O 1321242928 GZTMCZNPIMDGQZ-LURJTMIESA-N 253.218 -0.722 5 20 CBBD CS(=O)(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1322506901 FTRVPJCOGFWJFY-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)CCn1cc([N+](=O)[O-])cn1 1351088426 WSHJXIJZOWYEHB-UHFFFAOYSA-N 293.287 -0.032 5 20 CBBD COC[C@@](C)(NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1610244516 SIBTTZFMLKXWEO-SNVBAGLBSA-N 272.261 -0.129 5 20 CBBD Cc1nc(N2C[C@@H](O)C[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 1610557047 PIHQDKAFJOPEDN-SFYZADRCSA-N 282.256 -0.035 5 20 CBBD CCCN(CC(=O)NC)C(=O)Cn1cnc([N+](=O)[O-])n1 49034347 WSOGYVQHKRIHIX-UHFFFAOYSA-N 284.276 -0.829 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 65719671 WGVCZGAJBUDBGB-SSDOTTSWSA-N 283.288 -0.259 5 20 CBBD O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H](O)CO)cc1 95082617 DOASXPUDFCLNMD-GHMZBOCLSA-N 256.258 -0.429 5 20 CBBD COCCN(C)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 131208009 HFJOFBQMKZSNAW-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 163129154 UNQIJNMDZUKLOD-GXSJLCMTSA-N 297.315 -0.244 5 20 CBBD N[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 179571562 HWPWIENAHLOGCD-SECBINFHSA-N 253.262 -0.355 5 20 CBBD C[C@@H]1C(=O)NCCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 249071289 RBPBYAPPYNFTEC-MWLCHTKSSA-N 297.315 -0.637 5 20 CBBD O=C(NCCNC(=O)C1CC1)c1cc([N+](=O)[O-])[nH]n1 285114351 VAQJROIRLCOCGJ-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD CCc1nn(C)c(N(C)C[C@H](O)CO)c1[N+](=O)[O-] 288949157 SGHDQOHMHBVJPY-ZETCQYMHSA-N 258.278 -0.320 5 20 CBBD O=C1NC[C@H]2[C@H]1CCCN2C(=O)c1cc([N+](=O)[O-])n[nH]1 343306033 XDGKWHVNDGYGOR-SVRRBLITSA-N 279.256 -0.332 5 20 CBBD C[C@H]1CN[C@H](C)CN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 356926269 SQLGKBIEJOVXFQ-ZJUUUORDSA-N 294.311 -0.035 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1C[C@H](F)CN1 366462205 NJHYLIUATFTOPL-IUCAKERBSA-N 285.279 -0.084 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)OC[C@@H]2C1 378162827 XFUNZIGRADZTLN-VIFPVBQESA-N 295.255 -0.546 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN(C(=O)C2CC2)C1 422018912 UYAPSGMIZBNCOV-UHFFFAOYSA-N 293.283 -0.170 5 20 CBBD COC(=O)C1(C)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 425165812 UGOTUWYYXIPFRL-UHFFFAOYSA-N 268.229 -0.047 5 20 CBBD CCOC1CC(O)(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 444628270 HSYLMENOGYCQSJ-UHFFFAOYSA-N 284.272 -0.022 5 20 CBBD C[C@H](CN)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 564959816 YUQJNHKYIGGARZ-ZCFIWIBFSA-N 260.275 -0.385 5 20 CBBD CC[C@@H](O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 594421310 SQKZKSTVECTUDC-SSDOTTSWSA-N 268.273 0.532 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1C[C@H](C(=O)O)C1 595249471 FAIRVWIJFRFGKD-IZLXSQMJSA-N 269.217 -0.834 5 20 CBBD O=C(CO)N1CCN(c2cccnc2[N+](=O)[O-])CC1 611242416 VMXWJIVLOMQYOJ-UHFFFAOYSA-N 266.257 -0.369 5 20 CBBD CCNC(=O)NC(=O)COC(=O)c1nn(C)cc1[N+](=O)[O-] 772051744 NYLHOSDBLJKZAC-UHFFFAOYSA-N 299.243 -0.669 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(N)CCC1 1118265910 HHAFIQSYVKROTE-UHFFFAOYSA-N 253.262 -0.061 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H](C(N)=O)C1 1322524961 MJTBGENDMMXJMZ-VIFPVBQESA-N 295.299 -0.176 5 20 CBBD CN1CC[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1322767080 ZREQEVXLSNTQLO-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNOC2CCOCC2)c1 1326157503 YSUUHVQMUWNYDB-SNVBAGLBSA-N 286.288 -0.148 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC[C@H]1CCNC1 1329484768 VYNPYODOJPPIGZ-MRVPVSSYSA-N 268.277 -0.698 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3CCNC[C@H]32)nc1 1580875216 FDCCNLVCOGQAIJ-PSASIEDQSA-N 298.324 -0.028 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(=O)O 90262503 JZJUWWNEZHYCAM-ZETCQYMHSA-N 257.202 -0.891 5 20 CBBD NC(=O)CONC(=O)COc1cccc([N+](=O)[O-])c1 124194087 SKLIFUPOUBLPSS-UHFFFAOYSA-N 269.213 -0.493 5 20 CBBD NC(=O)COCCNC(=O)c1cccc([N+](=O)[O-])c1N 230211837 DZUCPGPONJQLJS-UHFFFAOYSA-N 282.256 -0.591 5 20 CBBD CCS(=O)(=O)NCCNc1c([N+](=O)[O-])c(C)nn1C 263721506 OMPKWTZSXKBBDG-UHFFFAOYSA-N 291.333 -0.012 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1O 331181233 RLRPJHDEIVLINE-GXSJLCMTSA-N 295.295 -0.014 5 20 CBBD Cc1ccn(CC(=O)N2CCN(C)CC2)c(=O)c1[N+](=O)[O-] 340695231 KFQLPOVJVWYYJV-UHFFFAOYSA-N 294.311 -0.161 5 20 CBBD C[C@@H]1COCCN1CCNc1ncc([N+](=O)[O-])cn1 354600238 JWPZECDBMYGIGI-SECBINFHSA-N 267.289 0.517 5 20 CBBD C[C@H](CC(N)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 361035350 AZOTXQMAESRDFV-ZCFIWIBFSA-N 255.234 -0.829 5 20 CBBD COC(=O)Cn1cc(CNc2c([N+](=O)[O-])ncn2C)nn1 441935795 WQLSWPHBFIOHKV-UHFFFAOYSA-N 295.259 -0.295 5 20 CBBD Cn1cnc(CCNC(=O)c2cc([N+](=O)[O-])cnc2O)n1 447200128 CYZWKEIFRSTEKT-UHFFFAOYSA-N 292.255 -0.204 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OC[C@@H]1CNC(=O)O1 497034878 FDJFHYMFPICGIK-QMMMGPOBSA-N 297.223 -0.592 5 20 CBBD O=C1C[C@@H](N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)N1 584239481 BSNJSKKVDHFTNZ-SECBINFHSA-N 293.283 -0.157 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1[C@H]2CC[C@H]1CNC2 595990727 DKGDPOANRLVFDY-UWVGGRQHSA-N 292.295 -0.281 5 20 CBBD COCCOCC(=O)OCCn1cc([N+](=O)[O-])cn1 748118661 LZDIQAZVYPKVQJ-UHFFFAOYSA-N 273.245 -0.003 5 20 CBBD C[C@H](COC(=O)[C@H]1CCCN(C(N)=O)C1)[N+](=O)[O-] 813105070 VEEPEJJVUGNOEV-SFYZADRCSA-N 259.262 -0.015 5 20 CBBD COC[C@@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842311119 RNTQQQMRNBLLIL-FSDSQADBSA-N 266.275 -0.868 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CN2C[C@H](O)[C@@H](O)C2)cc1 859455260 AJOVJWJPFDTTKD-SRVKXCTJSA-N 268.269 -0.334 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCCNC(=O)C1 878039598 ZJZSLBWOVLFXOU-UHFFFAOYSA-N 267.289 -0.078 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2CCOC[C@@H]2C1 893156330 CSEMDFIEKSHQGQ-VIFPVBQESA-N 267.289 -0.151 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCn2ncnc2C1 1325709078 XMUZSSQWHAZDKP-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD CNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 1337821573 ZRGSGXXICPKXQJ-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1[C@H]2CNC[C@H]21 1579877225 DUPPLSOVMDBQPV-MYJAWHEDSA-N 279.300 -0.319 5 20 CBBD CCCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H](C)C(=O)O 1605298217 NSWZYZGAKAJWNH-ZETCQYMHSA-N 285.260 -0.102 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(CCN2CCNC2=O)c1 1608863130 OVBSIUSQJMZDCU-UHFFFAOYSA-N 296.239 -0.520 5 20 CBBD Nc1nc(NC[C@@H]2CCS(=O)(=O)C2)ncc1[N+](=O)[O-] 48557251 RCUJICQIOGTEIV-LURJTMIESA-N 287.301 -0.186 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 227867134 YHHGEKWIWBVMTG-SECBINFHSA-N 267.241 -0.900 5 20 CBBD Nc1nc(N2CCC3(C2)OCCO3)ncc1[N+](=O)[O-] 301207729 QGFIJVQEHIULCT-UHFFFAOYSA-N 267.245 -0.080 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 356926089 CIVPNASJDLSMMX-MRVPVSSYSA-N 299.239 -0.651 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCCC(=O)N1 447743407 HAOYRPXYYOBOSW-QMMMGPOBSA-N 281.272 -0.424 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 549724718 ZUOUAKRHZXPKJX-LURJTMIESA-N 282.260 -0.539 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](CO)C1 699458822 SWWKBEMOLAULKO-SNVBAGLBSA-N 282.300 -0.318 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NOCC(N)=O)c1 772949024 OPRNATNEAZUZNF-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD NC(=O)N1CCC[C@H](C(=O)OCCC[N+](=O)[O-])C1 860912748 CQBODBPKKFNQPC-QMMMGPOBSA-N 259.262 -0.013 5 20 CBBD NC(=O)N1CCC[C@H]1COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 860983918 FLWJXTFNEXHGFB-XLPZGREQSA-N 257.246 -0.262 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1321893207 NWOVYPZGNMOTAR-YFKPBYRVSA-N 253.218 -0.735 5 20 CBBD COC[C@](C)(O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1322159761 ZTSZHHBNXZTTAU-LLVKDONJSA-N 286.288 -0.236 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1COCCO1 1323224601 NGEKJURSJFRINR-SSDOTTSWSA-N 270.245 -0.527 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)C[C@@H](C)N 1579877205 CTMICBAWAJJWGV-SSDOTTSWSA-N 255.278 -0.095 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@H](O)CO)cc1-c1nn[nH]n1 1607082697 SGXFWYBTTOZINH-ZETCQYMHSA-N 280.244 -0.460 5 20 CBBD O=C(O)[C@H](C[C@H]1CCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608534543 ZOIIRBFREXZWET-LURQLKTLSA-N 272.257 -0.210 5 20 CBBD CCN1CCO[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 157005508 GDDONIHIAQETBF-LLVKDONJSA-N 297.315 -0.372 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 274379151 FVXVPSDHZIULEG-HTQZYQBOSA-N 284.272 -0.070 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1ccc([N+](=O)[O-])cc1O 297060576 USPUWSPQBBKLCY-PSASIEDQSA-N 268.225 -0.210 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1 314818618 QDSXDJBGTYRAFC-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD CC(C)(C(=O)N1CCO[C@H](CO)C1)n1cc([N+](=O)[O-])cn1 331155038 BJNCQCCELUVFOR-JTQLQIEISA-N 298.299 -0.254 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1COC[C@@H]1O 342374496 KQDNFAAQRDEURT-YUMQZZPRSA-N 255.230 -0.245 5 20 CBBD C[C@H](C[S@](C)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 345568523 LXOYTYVLFXXVAW-MDTSDYNXSA-N 274.302 -0.326 5 20 CBBD CN(C)C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CCO1 356208538 DYZADRBFANCGIF-VIFPVBQESA-N 297.315 -0.269 5 20 CBBD CN(C)CCOCCNC(=O)c1cc([N+](=O)[O-])nn1C 360662556 GYYZFTAJVOYRHN-UHFFFAOYSA-N 285.304 -0.364 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1[C@@H]2CNC[C@@H]21 366532940 SRMOKVRKGGATKE-JZYVYDRUSA-N 265.273 -0.485 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)OC[C@@H]2C1 495816296 IDXALCQRCSNETL-LURJTMIESA-N 281.228 -0.406 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CCO1 567056299 MOYCWZDKPZEJHG-VIFPVBQESA-N 281.224 -0.085 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 593814768 DTVUHZJWRCSUAE-RKDXNWHRSA-N 284.272 -0.601 5 20 CBBD Nc1ccc(NC(=O)NC[C@@H](O)CO)cc1[N+](=O)[O-] 823973719 KXAAHKGQQYIELN-SSDOTTSWSA-N 270.245 -0.348 5 20 CBBD CN1C(=O)CN(C(=O)CCC(C)(C)[N+](=O)[O-])CC1=O 848047950 FAFAKIXJIXXPEE-UHFFFAOYSA-N 271.273 -0.351 5 20 CBBD Cn1cc(CN2CCN(CC[N+](=O)[O-])CC2)cn1 929584160 ZQQBEWKSSBYOCV-UHFFFAOYSA-N 253.306 -0.186 5 20 CBBD Cc1nn(C)c(-n2cnnc2[S@@](C)=O)c1[N+](=O)[O-] 1318846809 FYGQXGBXUMUNIN-GOSISDBHSA-N 270.274 -0.045 5 20 CBBD C[C@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1=O 1324145946 PNUMVBJSNGFDEB-VIFPVBQESA-N 254.202 -0.247 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3C[C@H]2CN3)c1 1332334549 LTYGFSQZSHEWLQ-ATZCPNFKSA-N 267.289 -0.802 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 54310314 ICFGFCGCIRONPP-LURJTMIESA-N 256.218 -0.372 5 20 CBBD CC(C)(CNC(=O)Cn1cc([N+](=O)[O-])cn1)OCCO 291695315 AGIGJLKKFQHDNX-UHFFFAOYSA-N 286.288 -0.305 5 20 CBBD NS(=O)(=O)NCCNc1ccc([N+](=O)[O-])cc1 341568762 QJAOQCDGJIWDEK-UHFFFAOYSA-N 260.275 -0.200 5 20 CBBD CCOC(=O)C[C@H](C)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 343490825 FZXVWMKWEHOTGV-QMMMGPOBSA-N 299.287 -0.014 5 20 CBBD CN1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(=O)N1 349664748 HYLCKSHRLYBCRU-SECBINFHSA-N 293.283 -0.532 5 20 CBBD CCNC(=O)NCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 351844062 ZLGGVBCZSWDRRR-UHFFFAOYSA-N 284.276 -0.325 5 20 CBBD COC[C@@]1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCCN1 357277304 VXVHOYJLDYZASP-LBPRGKRZSA-N 297.315 -0.324 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1Cc1c([N+](=O)[O-])ncn1C 361685452 FAIWDTDRSPFYSV-BDAKNGLRSA-N 270.289 -0.090 5 20 CBBD O=C1N[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2CO1 366842949 DJHDKYYFDSHWSZ-LURQLKTLSA-N 269.257 -0.392 5 20 CBBD COCCN(C)C[C@@H](O)Cn1cnc([N+](=O)[O-])c1 385886665 CQAROWDRSNTAAA-SECBINFHSA-N 258.278 -0.270 5 20 CBBD CCC[C@H](O)[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 412514779 FBDVKAJTBHLXDO-WPRPVWTQSA-N 299.283 -0.053 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)CN 441609166 IXEPDDLIOPBFMD-SSDOTTSWSA-N 255.278 -0.189 5 20 CBBD CCOC[C@@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 444968984 TXOWSXBRLMDYQH-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD COC(=O)[C@H]1C[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 519534503 AREXGPKOWWZXOO-WCABBAIRSA-N 298.299 -0.307 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 548952569 PBKFUBPKFRYJDL-UHFFFAOYSA-N 284.276 -0.339 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)N(C)C 610892208 KWWTXXOKQAFZJI-QMMMGPOBSA-N 255.278 -0.142 5 20 CBBD C[C@H]1CN(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 840673090 YXMFPDQFUUTVGI-DJLDLDEBSA-N 272.257 -0.558 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccncc1 990060696 IWLKYAZFHAVGHK-GHMZBOCLSA-N 290.279 -0.313 5 20 CBBD O=c1ccncn1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1116212995 OFJZKOJIXJQQRW-VIFPVBQESA-N 265.229 -0.591 5 20 CBBD CC(C)S(=O)(=O)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 1319046325 RSCOGOAROVZJFU-UHFFFAOYSA-N 290.301 -0.012 5 20 CBBD CNC(=O)[C@H]1CN(c2ccnc(O)c2[N+](=O)[O-])CCO1 1330043298 QXPZCBBFBJDRCK-MRVPVSSYSA-N 282.256 -0.353 5 20 CBBD CNC(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1339097326 VWKBQNAWXAZDIH-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NOCc1cnn[nH]1 1577967325 AZSBETMIGPJIOG-UHFFFAOYSA-N 294.227 -0.877 5 20 CBBD O=C(O)c1ccnc(N2CC(O)(CO)C2)c1[N+](=O)[O-] 1602482051 ZWRKDBUGAVOIKN-UHFFFAOYSA-N 269.213 -0.769 5 20 CBBD CNc1ccc(C(=O)N[C@@H](CO)C(=O)OC)cc1[N+](=O)[O-] 8138349 DDHGHBCAYQRVAB-VIFPVBQESA-N 297.267 -0.100 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1nnn[nH]1 50708682 JKNSNPCBHBWRJO-UHFFFAOYSA-N 263.217 -0.380 5 20 CBBD CC(=O)NCCCOC(=O)Cn1ccc([N+](=O)[O-])n1 63977180 NCMIDHXPEVOLEZ-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)Cn1cc([N+](=O)[O-])cn1 80522774 NLMZSJMTYOKLAL-UHFFFAOYSA-N 265.233 -0.432 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 163128944 UNQIJNMDZUKLOD-ONGXEEELSA-N 297.315 -0.244 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCS(=O)(=O)C1 176195605 LFHPNFFRBWWBOI-SECBINFHSA-N 288.329 -0.090 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCOCCO 180396146 NGPYJSNIRLSUTI-UHFFFAOYSA-N 286.288 -0.385 5 20 CBBD Cn1c(C(=O)N[C@H]2[C@@H]3CNC[C@@H]32)ccc1[N+](=O)[O-] 252407506 HNVKAYLCYVBCQX-MTBHXBHISA-N 250.258 -0.119 5 20 CBBD C[C@H]1C[C@@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 261924172 ZZKIMBQMYTWOOI-IUCAKERBSA-N 267.289 -0.013 5 20 CBBD CN1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 265631029 FDWYVIHWIDQWJH-VIFPVBQESA-N 281.272 -0.520 5 20 CBBD O=C1CN(CCNC(=O)c2ccc([N+](=O)[O-])s2)CCN1 272826584 XRDYHEVSWGKVON-UHFFFAOYSA-N 298.324 -0.182 5 20 CBBD COC[C@](C)(NC(=O)c1cc([N+](=O)[O-])[nH]n1)C(=O)OC 285607409 IYVVLHJLLZSVBR-JTQLQIEISA-N 286.244 -0.374 5 20 CBBD CC(C)N(CC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 298769003 HBCWTHVSUCCHPL-UHFFFAOYSA-N 269.261 -0.486 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[S@@]1=O 352312262 DYIMLFDQFJGCEC-YLVJLNSGSA-N 286.313 -0.229 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 353953172 SSVDNYPXCVIUPE-LURJTMIESA-N 281.272 -0.111 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354689422 WNKBFQBSMIKHQY-SNVBAGLBSA-N 269.261 -0.886 5 20 CBBD CCN(C)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 358228601 JPJUHVWXNIMWFQ-UHFFFAOYSA-N 282.256 -0.666 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1n[nH]cc1[N+](=O)[O-] 362397045 QMNPXVZYWKVKIO-IUCAKERBSA-N 295.299 -0.089 5 20 CBBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1C[C@@H](O)C[C@@H]1CO 368201056 MREAXHRFDKPDHI-BDAKNGLRSA-N 282.252 -0.132 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)C2(CC2)C1 428191739 KVJVIIMOHIGVBH-MRVPVSSYSA-N 266.257 -0.075 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCOCCF)c1 596070520 QMUZTUUTMQUZFZ-JTQLQIEISA-N 276.268 -0.272 5 20 CBBD CNC(=O)C1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 596195313 MECCGXRLDTUEDD-UHFFFAOYSA-N 278.268 -0.124 5 20 CBBD O=C1C[C@@H](C(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)N1 597571691 SHTKKPMYWFJCLA-VIFPVBQESA-N 289.251 -0.024 5 20 CBBD C[C@H]1[C@H](N(C)C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 597696619 CYEZUDXRMKTGRO-DTWKUNHWSA-N 282.304 -0.263 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1OC)C(N)=O 756743457 KSALLXXIQQGWBL-VIFPVBQESA-N 297.267 -0.167 5 20 CBBD COC[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)OC 774740184 DWNFIACAGLIAJK-ZETCQYMHSA-N 287.228 -0.478 5 20 CBBD COCCN(CC[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 930108945 XETGJOOTSPPSNF-SECBINFHSA-N 266.319 -0.601 5 20 CBBD O=C(Cn1ncnn1)NCCNc1ccc([N+](=O)[O-])cn1 1093889593 FZLIURSZEHTHAH-UHFFFAOYSA-N 292.259 -0.795 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@H]1C(=O)O 1117832914 BKJNYFLRCWVLMS-ZETCQYMHSA-N 284.228 -0.746 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1nc[nH]n1 1319883617 DQYOHRUIEVZBBA-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD C[C@@H](C[S@](C)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1337707049 HEJFSZQOGJPTME-AAODDVHNSA-N 260.275 -0.185 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC2(CCNC2)C1 1580579149 ZEKJWDHENHSXPW-UHFFFAOYSA-N 266.261 -0.992 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CCO[C@H]2C(=O)O)c1[N+](=O)[O-] 1599967646 XPHAIMUVUCVPQA-YLWLKBPMSA-N 284.228 -0.402 5 20 CBBD CCc1nn(C)c(N2CC[C@@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1776990581 IQWLAIBUEANSNC-NSHDSACASA-N 284.272 -0.084 5 20 CBBD COC(=O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 40419501 LRZWBBYLUIHAEL-UHFFFAOYSA-N 269.213 -0.424 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 44024885 PMQAOFSHELSSMS-UHFFFAOYSA-N 276.274 -0.798 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H](CO)C1 51885268 CLFOHKKSQGARDR-MRVPVSSYSA-N 254.246 -0.368 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 54051796 RUEXWKKNGMTEEH-LURJTMIESA-N 256.218 -0.277 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@H](O)C1 161645341 BAPQICSQLIEDOR-JTQLQIEISA-N 283.288 -0.042 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@H](O)[C@@H](O)C1 217316933 NESSEPDUPQKUGR-IUCAKERBSA-N 268.225 -0.522 5 20 CBBD O=C1NC[C@@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 267520095 XPCZZOHLQBDUOB-MRVPVSSYSA-N 291.267 -0.863 5 20 CBBD COC(=O)CN(C(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 267689299 JRQLAXOVFQBLMN-UHFFFAOYSA-N 282.256 -0.045 5 20 CBBD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1CCSC1=O 270429611 BIHDJPYNJUBUJJ-SSDOTTSWSA-N 297.292 -0.095 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1CCN[C@H](C(N)=O)C1 280087346 SDOMQPCINADJET-QMMMGPOBSA-N 282.304 -0.617 5 20 CBBD CCNC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 293918272 DZMAVLUVQGEZFU-UHFFFAOYSA-N 298.303 -0.465 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC(=O)N1C 337693119 OEQNPLDWQIJZKX-ZETCQYMHSA-N 281.272 -0.369 5 20 CBBD CNC(=O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338609682 XEWZZLLUOUXLMI-UHFFFAOYSA-N 269.261 -0.611 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] 344212334 HCJYBMYWELOLTN-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD COC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 349858464 PUWSWCPONDMTQF-UHFFFAOYSA-N 268.229 -0.183 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@H]2COCCO2)c1 352153321 MJFNJTFUZRZHLB-VIFPVBQESA-N 298.251 -0.042 5 20 CBBD O=C(NC[C@@H]1CC[C@H](CO)O1)c1cnc(O)c([N+](=O)[O-])c1 356529422 URGNMPQQRULKNJ-DTWKUNHWSA-N 297.267 -0.035 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN2CCOC[C@@H]2C1 374961006 DWMKKGZNQAJDGC-IVZWLZJFSA-N 255.274 -0.805 5 20 CBBD CCN(C)C(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 571176799 GCDDYAMNMWNSFY-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN1Cc1onc(C)c1[N+](=O)[O-] 595456752 FYFPWRDJWYICQP-JGVFFNPUSA-N 285.256 -0.001 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@@H](CO)[C@H](CO)C1 599767353 WOJRYWPQIUFCSY-IUCAKERBSA-N 296.283 -0.524 5 20 CBBD Nc1nc(N=c2ccn(CCO)[nH]2)ncc1[N+](=O)[O-] 610210585 KSACQDOSKODRQE-UHFFFAOYSA-N 265.233 -0.679 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)n1 801970560 OFXNGRJKQSPRKS-UHFFFAOYSA-N 295.234 -0.230 5 20 CBBD CN(CCC(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 818432315 ORRDFOXTYNAWGJ-UHFFFAOYSA-N 285.260 -0.093 5 20 CBBD C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCS1(=O)=O 862988655 QPCUDYYQEBNXMC-WCTZXXKLSA-N 262.287 -0.657 5 20 CBBD O=C(NCC1CN(C(=O)c2ccc[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001795824 JYSWJWRJBKYSSW-MWLCHTKSSA-N 292.295 -0.132 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NC/C=C\CNC(=O)C(N)=O)n1 1107480933 YEDRUGGCWCUGJG-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD CNC(=O)CC(=O)NCCNCc1cccc([N+](=O)[O-])c1 1126161402 KMKKWTGOLYOSSN-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD COC(=O)C1(O)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1321761362 WAFMPXKWPRHYIQ-UHFFFAOYSA-N 298.255 -0.542 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCSC1=O 1335973815 YSRXSSQUGZSWIM-SSDOTTSWSA-N 297.292 -0.095 5 20 CBBD N[C@@H](CC(=O)O)C(=O)NCCNc1ccccc1[N+](=O)[O-] 1608265183 ULTIHURFZVMSBG-QMMMGPOBSA-N 296.283 -0.075 5 20 CBBD O=C(O)C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 1608699798 IKFZJPCWSGHFMD-LURJTMIESA-N 284.228 -0.366 5 20 CBBD O=C(O)Cn1cc(Cn2cc([N+](=O)[O-])cc(F)c2=O)nn1 1608797867 LELBGENPODDCMO-UHFFFAOYSA-N 297.202 -0.380 5 20 CBBD CNC(=O)CN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] 7365351 QNMVVBWJHRBBRZ-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H](C)CO1 49090216 NVQBXAOKSDSRLV-YUMQZZPRSA-N 269.261 -0.178 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@]1(C(=O)O)CCOC1 85853269 IETJKTGCTBQROL-SNVBAGLBSA-N 284.228 -0.849 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(CO)CCOCC1 226803153 HETQRGJBMKYLIP-UHFFFAOYSA-N 284.272 -0.551 5 20 CBBD NC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 237881894 CDLIOIJIXLDQJC-QMMMGPOBSA-N 253.262 -0.355 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@H](C)O 274512961 HLDFDWSBGLYHFM-XNCJUZBTSA-N 272.213 -0.160 5 20 CBBD O=[N+]([O-])c1cnn(CCN2[C@@H](CO)CC[C@@H]2CO)c1 287623109 ZWUBESRXISWXRO-NXEZZACHSA-N 270.289 -0.391 5 20 CBBD CC(=O)N1CC(NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 331917042 DJWUYFUXPBAHQY-UHFFFAOYSA-N 267.245 -0.862 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1COC[C@H]1O 342504713 WLNHFBSRQJEJOQ-RKDXNWHRSA-N 282.256 -0.596 5 20 CBBD O=C(N[C@@H](CO)[C@@H]1CCCO1)c1cnc(O)c([N+](=O)[O-])c1 344820804 HSDURFKMQJOILA-WPRPVWTQSA-N 297.267 -0.035 5 20 CBBD CNc1nc(C(=O)N[C@H](CO)[C@@H](C)O)ccc1[N+](=O)[O-] 412430499 YIHZPAKQLBTWQQ-HTRCEHHLSA-N 284.272 -0.497 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1[C@@H]2CO[C@H]3[C@@H]2OC[C@H]31 586801432 PAJJNCVGCZREKE-SQEXRHODSA-N 266.213 -0.692 5 20 CBBD Cn1nnc2c1CC[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C2 594401265 NEMJMMBCTPAKKK-LURJTMIESA-N 291.271 -0.266 5 20 CBBD NS(=O)(=O)c1ccc(NC[C@H](O)CO)cc1[N+](=O)[O-] 596165707 KUXIYVVUIVXVBU-ZETCQYMHSA-N 291.285 -0.993 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1nnnn1C 733469275 WMYKDVDCIWQLNX-UHFFFAOYSA-N 295.259 -0.243 5 20 CBBD O=C(NCCCNCc1cnon1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767869 YSMOUDOHXVTCRM-RKDXNWHRSA-N 269.261 -0.669 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CC12CCNCC2 1326131927 CDXYDROJAJNTMC-MRVPVSSYSA-N 280.288 -0.555 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](O)CC(=O)O 1607984868 NIAAXNNJTCDFCQ-ZETCQYMHSA-N 286.244 -0.948 5 20 CBBD CC1(O)CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 1609150522 DLTGJJFEUHNOMT-UHFFFAOYSA-N 277.244 -0.259 5 20 CBBD O=C(Cn1cnnn1)NCCNc1ccc([N+](=O)[O-])cc1 15139047 GIICREACRFQEQY-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@H](C(N)=O)C1 68467446 JEIHDWQXTWJYEN-SECBINFHSA-N 295.299 -0.176 5 20 CBBD Cc1c(C(=O)NC(CO)CO)cccc1[N+](=O)[O-] 87751258 GCUQAZAHQIBFOF-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](CO)C(N)=O 340887438 WPBZGLGDDXPMIN-LURJTMIESA-N 257.250 -0.622 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 341737487 MLJOGUTWASAFKF-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD CC(C)[C@](C)(NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 341985825 NQTQBSYMOYLGME-NSHDSACASA-N 283.288 -0.042 5 20 CBBD Nc1nc(N[C@H]2CCCS(=O)(=O)C2)ncc1[N+](=O)[O-] 345637501 ARCHOZJDAGEKCJ-LURJTMIESA-N 287.301 -0.044 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(O)CCC1 353658294 KWLRGOQPGXLPGO-UHFFFAOYSA-N 281.268 -0.212 5 20 CBBD CN1CCO[C@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@@H]21 355503128 FIBCMEMENGXPCT-UWVGGRQHSA-N 295.299 -0.517 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 358056227 ZWVNSVALGUWFPQ-NSHDSACASA-N 268.273 -0.281 5 20 CBBD CN(C)C(=O)COC1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 361021623 BMCXVGARWVXTFL-UHFFFAOYSA-N 296.283 -0.148 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@H](O)C(F)F 426953732 KRGLJUTZWZZGLW-ZETCQYMHSA-N 293.230 -0.284 5 20 CBBD CNc1nc(C(=O)NCC(=O)N(C)C)ccc1[N+](=O)[O-] 454364124 OMTCKDNIWWXTHO-UHFFFAOYSA-N 281.272 -0.151 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 582432708 OMKYRFVPEDSRKR-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)[C@H](N)C[C@H]2C1 584124284 ABXSSGFWJGGGDF-JGVFFNPUSA-N 280.288 -0.924 5 20 CBBD O=C1CC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CN1 809017137 FWHAUFJFXZXJAL-SSDOTTSWSA-N 268.229 -0.387 5 20 CBBD O=C(NC1CN(C(=O)c2ccns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991293994 QJZPLOVQOTVAGZ-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD CCN1CC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2 1053253477 LBWFWNSQOJPUIY-NXEZZACHSA-N 269.301 -0.415 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H](N2CC[C@@H](O)C2)C1 1261818840 JDFYHPIHNGKGGK-RKDXNWHRSA-N 295.299 -0.401 5 20 CBBD COCc1nn(CCn2cc([N+](=O)[O-])cn2)c(=O)o1 1319541040 KXZQPMDQORULDD-UHFFFAOYSA-N 269.217 -0.212 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CO)C1CC1 1320549407 HUKFAWABFFXCIZ-SSDOTTSWSA-N 254.246 -0.171 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1323515953 TVGIPQLPFOOFSE-UHFFFAOYSA-N 270.249 -0.681 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1344097607 FAKMPLURQBUNCX-WRWORJQWSA-N 284.272 -0.402 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 88374170 NHSKQKCGOUSJQL-QMMMGPOBSA-N 269.213 -0.152 5 20 CBBD COC(=O)CCC(=O)NCCn1cc([N+](=O)[O-])cn1 129928057 LQUKYTZHQMAPIR-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD Cc1ccnc(N2CCN(C(=O)CO)CC2)c1[N+](=O)[O-] 301926085 GYASONAFYUPZMZ-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD COCCOCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 343325647 SWGDNVNUZDIRRL-UHFFFAOYSA-N 258.234 -0.289 5 20 CBBD O=C(NCc1nnnn1CC1CC1)c1n[nH]cc1[N+](=O)[O-] 354262809 CJTFFOOYUQYLTE-UHFFFAOYSA-N 292.259 -0.356 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CNCCO1 423719698 GEKVZVNEEOHYMP-JTQLQIEISA-N 291.267 0.398 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@@H](C)O 442924866 ZHKKIBCOKZIVJO-HZGVNTEJSA-N 285.256 -0.415 5 20 CBBD CN1C[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C(=O)N1 450607454 ALZMDZAHPLKPRW-LURJTMIESA-N 270.270 -0.269 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 590369826 OMYGQKNMYHAQPE-QMMMGPOBSA-N 284.272 -0.652 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592307350 FYVNEPKQNNZGFK-HTRCEHHLSA-N 269.261 -0.494 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H](O)C1 598529136 FNCQJJJACDPPNX-XWEPSHTISA-N 254.246 -0.179 5 20 CBBD COC(=O)COCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 599158168 HZWHGDGQPHQULX-UHFFFAOYSA-N 298.255 -0.310 5 20 CBBD CC[C@](C)(CC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 767056778 WUPHKKGDNPCAOX-SNVBAGLBSA-N 285.260 -0.054 5 20 CBBD Cn1ccc(C(=O)COC(=O)Cn2cnc([N+](=O)[O-])n2)c1 919520305 JHQZYYTWWSMBSH-UHFFFAOYSA-N 293.239 -0.049 5 20 CBBD COC[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1599180279 IBZQJZGTBGPUBU-QMMMGPOBSA-N 287.228 -0.176 5 20 CBBD C[C@@H](CC(N)=O)Nc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603463356 ILOSHZKMERNQKN-YFKPBYRVSA-N 292.259 -0.154 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NCC(=O)O 1604413119 DZHAJDZSFXCFJL-RXMQYKEDSA-N 286.196 -0.066 5 20 CBBD NC(=O)CNC(=O)COc1cccc([N+](=O)[O-])c1 70244310 RDSVYVICZQOZSQ-UHFFFAOYSA-N 253.214 -0.425 5 20 CBBD CC(C)(C)[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 106415401 XPSRQCDYOGLNHK-SECBINFHSA-N 283.288 -0.193 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1cccn1 194139665 DATSLQLKMIJCGX-UHFFFAOYSA-N 264.245 -0.196 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCNC(=O)C1 195684182 WEJPGKQYDGMONU-UHFFFAOYSA-N 278.268 -0.109 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC(F)(F)CO 274421350 YGGQQYVKOKRWNF-UHFFFAOYSA-N 291.210 -0.500 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCCOCC1 275916326 UJLBEGPMXFRPTM-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CC(=O)N(C2CC2)C1 286924365 CZBHYEMCFOCAIX-UHFFFAOYSA-N 265.229 -0.278 5 20 CBBD CN1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 330519484 PISRZJGOVZNMPD-ZETCQYMHSA-N 253.262 -0.001 5 20 CBBD CNC(=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 344640309 ZXDQBPDXBLVCBJ-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD CCNC(=O)CN(CC)C(=O)c1c([N+](=O)[O-])cnn1C 347073126 CTXCVBPPCPPYDQ-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)C2(C)C)c1[N+](=O)[O-] 347572153 GCSWFXXSBGHHLE-UHFFFAOYSA-N 281.272 -0.023 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356462430 QXOOKCWSKNLAOQ-SNVBAGLBSA-N 295.299 -0.075 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@]1(CO)CCOC1 359608344 ZAQFOFDBNDQLKL-ZDUSSCGKSA-N 297.311 -0.160 5 20 CBBD Cn1cc(NC(=O)c2cc([N+](=O)[O-])cnc2N)nn1 361152356 XZYLWIIKDGHMQC-UHFFFAOYSA-N 263.217 -0.047 5 20 CBBD Cn1nnc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])n1 362842090 KVYLEJGRZCDIHK-UHFFFAOYSA-N 277.244 -0.171 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cccc(OC)c1[N+](=O)[O-] 443910698 VHKPVARNYQTEAI-MRVPVSSYSA-N 298.251 -0.133 5 20 CBBD CC(C)(C(=O)NCC(N)=O)n1cc([N+](=O)[O-])cn1 505390398 VCRKFUVESFWNSK-UHFFFAOYSA-N 255.234 -0.872 5 20 CBBD O=C1C[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)CN1 577007057 UBKRJSLTNXWZCD-LURJTMIESA-N 262.229 -0.062 5 20 CBBD NC(=O)[C@H]1CN(c2c(Cl)cncc2[N+](=O)[O-])CCN1 596064916 CVKRHCKLCQCMQQ-SSDOTTSWSA-N 285.691 -0.093 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NS(C)(=O)=O 750383841 CMYQIJGWHPWQAW-UHFFFAOYSA-N 276.274 -0.434 5 20 CBBD COC[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C(N)=O 760063660 YBZYNFLEXGSVGQ-SNVBAGLBSA-N 297.267 -0.410 5 20 CBBD Cn1nnc2c1CC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 847199296 RPMVOSYJAMNEPD-NYNCVSEMSA-N 265.273 -0.546 5 20 CBBD CN(C)C(=O)CN1[C@H]2CC[C@H]1CC(NCC[N+](=O)[O-])C2 905254881 BIXIJCLDZOYPDW-RYUDHWBXSA-N 284.360 -0.064 5 20 CBBD Cn1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1030292675 RQWVOUKEZXLSHQ-GHMZBOCLSA-N 279.300 -0.614 5 20 CBBD O=C(O)[C@@H]1C[C@H](F)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 1602196932 WEBDGECRSYNFFI-XPUUQOCRSA-N 286.219 -0.185 5 20 CBBD CC(C)(CNC(=O)Cn1cnc([N+](=O)[O-])n1)CC(=O)O 1603627140 IBQWDIBMMJUDEB-UHFFFAOYSA-N 285.260 -0.197 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](O)C1 78774544 SCUYPMLUYCSDLF-MRVPVSSYSA-N 287.297 -0.187 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 167585375 SCCMMDMIIGTYHG-RKDXNWHRSA-N 284.272 -0.601 5 20 CBBD NC(=O)CCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] 184207787 HPBZQKFQHLRPCP-UHFFFAOYSA-N 287.297 -0.110 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1C[C@H](O)[C@H](O)C1 234206552 IMKVXFOLOFCULS-OCAPTIKFSA-N 256.262 -0.339 5 20 CBBD Cn1c(C(=O)NC[C@H]2COCCN2)ccc1[N+](=O)[O-] 236080319 CGQPICITYHTLDE-QMMMGPOBSA-N 268.273 -0.349 5 20 CBBD CN(CC(N)=O)S(=O)(=O)Cc1ccccc1[N+](=O)[O-] 268564511 PXYLSQZJMCPLHQ-UHFFFAOYSA-N 287.297 -0.158 5 20 CBBD NC(=O)CONC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 271417714 PLHYHWPXIQYPAP-UHFFFAOYSA-N 297.223 -0.487 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CCN(CCO)CC1 272359086 BVDLHDKKOBOYLM-UHFFFAOYSA-N 294.311 -0.073 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)N(C)C 340118257 KBTTZDGVJGYZHW-SSDOTTSWSA-N 269.261 -0.616 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1nn[nH]n1 342852955 QQJITWWCFZGJCJ-UHFFFAOYSA-N 291.227 -0.524 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H](CO)O1 347667517 KSHLHHKNPJLVKJ-HTQZYQBOSA-N 284.272 -0.450 5 20 CBBD CCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 356110733 DEWVLVDPNINXBF-UHFFFAOYSA-N 268.229 -0.439 5 20 CBBD O=C(NCCn1ncnn1)c1cccc([N+](=O)[O-])c1O 380074476 QXMWDAVQWMVATN-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H]2CCO)c1 426257372 VPZJLVZWIISJRA-PWSUYJOCSA-N 284.316 -0.001 5 20 CBBD C[C@H]1[C@@H](CO)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 427831249 XAOIXYVSYLCOBJ-VHSXEESVSA-N 295.295 -0.014 5 20 CBBD CC(C)(C(=O)NC1[C@@H]2CNC[C@@H]12)n1cc([N+](=O)[O-])cn1 495177379 ZTICZKKPEWMBRF-RKDXNWHRSA-N 279.300 -0.140 5 20 CBBD N[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 564945807 QRMPTCSSBZJUAK-ZCFIWIBFSA-N 252.230 -0.131 5 20 CBBD Cc1noc(CN2CCN(C(=O)[C@H](C)O)CC2)c1[N+](=O)[O-] 595405074 SKEAPJBHLWWWGV-VIFPVBQESA-N 298.299 -0.084 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)CCc1cccc([N+](=O)[O-])c1 763701100 BJLZJFMYYBORJM-LLVKDONJSA-N 295.295 -0.250 5 20 CBBD CN1CC[C@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 847789518 DWHYGIYIQTYJQC-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD Cc1[nH]ccc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991278193 GABRKRVXFXHXJS-GHMZBOCLSA-N 292.295 -0.071 5 20 CBBD CCn1cnnc1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 1116034385 QPAHGJIXNPPYNE-UHFFFAOYSA-N 293.287 -0.238 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1C[C@H]2COC[C@H]2C1 1350597815 IQRMYTKTVOWDBV-OCAPTIKFSA-N 253.262 -0.326 5 20 CBBD CNC[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350908259 CAIRCBPLKBETHL-CMPLNLGQSA-N 283.332 -0.307 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1594724343 ONOQTAYDFGHELG-SECBINFHSA-N 270.201 -0.709 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@@](O)(C(=O)O)C1 1600990996 LHTSVDZCGBNJHS-VIFPVBQESA-N 256.218 -0.646 5 20 CBBD O=C(O)[C@@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 1602171536 KOMWWBSTOPZHNG-UWVGGRQHSA-N 270.241 -0.337 5 20 CBBD CNC(=O)CN(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 25590820 BFRKMXGUYOXVMA-UHFFFAOYSA-N 287.297 -0.039 5 20 CBBD Cc1nn(CN2CCNC(=O)C2)c(C)c1[N+](=O)[O-] 58593157 OZZCTCVJQMHSKP-UHFFFAOYSA-N 253.262 -0.203 5 20 CBBD COC(=O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cn1C 135529833 KPDSVZALJMWEPQ-SNVBAGLBSA-N 297.267 -0.053 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCN1 155010795 YIIYDRNPVXPTFP-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCCN1 178720487 QNNHOEAKORLOSF-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD Cc1nc(N2CCO[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-] 268450102 FQQPRDLFYKLITO-SECBINFHSA-N 266.257 -0.011 5 20 CBBD CC(CO)(CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 274904664 HFMSLENXSHRJFB-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 278255374 WIKJNIHDUOORMH-MRVPVSSYSA-N 294.267 -0.002 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337799513 YCKBVGDQJPQOGK-IMTBSYHQSA-N 281.272 -0.417 5 20 CBBD O=C(O)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 354172104 NEWPIXURLJBFNU-ZETCQYMHSA-N 283.244 -0.348 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CCO1 354404185 DJADGXMMNIMOKX-VIFPVBQESA-N 294.267 -0.497 5 20 CBBD NC(=O)CCCNC(=O)c1cc([N+](=O)[O-])cnc1O 359405335 ALBNQWUIPQZWCX-UHFFFAOYSA-N 268.229 -0.309 5 20 CBBD Nc1noc(CCNC(=O)c2ccc([N+](=O)[O-])cn2)n1 531887447 IVTIVXFJPUSZDU-UHFFFAOYSA-N 278.228 -0.073 5 20 CBBD CCC[C@H](O)[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 565785241 OBLWQTXGBBQOHS-IUCAKERBSA-N 298.299 -0.176 5 20 CBBD CO[C@H]1C[C@@H](C(=O)O)N(CCn2cc([N+](=O)[O-])cn2)C1 574697359 RACPAJKPNWTRFX-UWVGGRQHSA-N 284.272 -0.035 5 20 CBBD C[C@@]1(C(=O)O)CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 595250876 OKECSAZRNNRGBU-WRWORJQWSA-N 297.271 -0.054 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CN(CCN)C[C@@H](O)CO 595901113 AAVSOOWSPNARAK-GFCCVEGCSA-N 299.327 -0.283 5 20 CBBD CCC1(O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 597633548 XMTXVCMIUHHXHK-UHFFFAOYSA-N 255.234 -0.830 5 20 CBBD CN(CC(=O)O)S(=O)(=O)c1cccnc1[N+](=O)[O-] 611164670 KUEPSUUJSUMFDG-UHFFFAOYSA-N 275.242 -0.305 5 20 CBBD Cn1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)ccc1=O 749076073 IEFXGMQZSLLFPM-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] 763706241 HVDNKNVWHKDGTD-SNVBAGLBSA-N 297.267 -0.560 5 20 CBBD CCc1nnc(S)n1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839690789 KITYERFXSHZXLC-RNFRBKRXSA-N 285.329 -0.089 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)NC[C@H]2C1 1116432305 SGCUNQQKKVEVCY-ZETCQYMHSA-N 294.271 -0.822 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](CO)[C@@H](O)C1 1117121229 CATPCJSFKRMFOD-XPUUQOCRSA-N 270.245 -0.867 5 20 CBBD COc1ccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126932213 MJOLVSVJJKBADA-GHMZBOCLSA-N 294.311 -0.039 5 20 CBBD CCN(C)C(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253427740 JUBDHVCPBZBJQG-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD Nc1ncc(C(=O)NCCC(=O)O)cc1[N+](=O)[O-] 1594664895 FMOXRXAWNPKNNU-UHFFFAOYSA-N 254.202 -0.224 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](CC(F)F)C(=O)O 1601390229 XGYAGDCSINIOAV-BYPYZUCNSA-N 293.186 -0.589 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCSC1=O 89681374 HKRQPAFCRXFKNY-ZETCQYMHSA-N 270.270 -0.060 5 20 CBBD CN1CCO[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]21 152194839 JUBWXJJLLBWRPD-VHSXEESVSA-N 295.299 -0.667 5 20 CBBD CN(Cc1nnc[nH]1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 174809244 AJFSSJQPALVNJO-VIFPVBQESA-N 281.276 -0.598 5 20 CBBD COc1cc(C(=O)NCCOCC(N)=O)ccc1[N+](=O)[O-] 269530426 MUCSWHMWACESJL-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD CN1CCO[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@H]21 284646687 FXQDGYNOOVLIOE-NXEZZACHSA-N 295.299 -0.137 5 20 CBBD CC(C)N(CC(N)=O)C(=O)c1cc([N+](=O)[O-])[nH]n1 285118853 VIFNQTZFQPFILP-UHFFFAOYSA-N 255.234 -0.346 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H](C)CO 293620360 JBAVGBAPKXUTER-SECBINFHSA-N 283.284 -0.014 5 20 CBBD CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 345904910 CLOUGNRYSTTXEC-ZJUUUORDSA-N 295.299 -0.178 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2CNC[C@H]2C1 359404067 IWZDZCZCNZPGGN-UWVGGRQHSA-N 279.300 -0.222 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCO1 428018238 STQXBZIBHHWWBV-SNVBAGLBSA-N 295.251 -0.373 5 20 CBBD CNCCN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 519153494 YMUDNDFFHKAYBA-UHFFFAOYSA-N 254.246 -0.013 5 20 CBBD COC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])cn2C)CCOC1 530795803 YJEHFTKWWHGYSH-GFCCVEGCSA-N 297.267 -0.005 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 549186567 ZGXCHAYNNODZTR-SSDOTTSWSA-N 284.228 -0.668 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1CCNC1 567522215 JHBUSJBFRNVXHG-QMMMGPOBSA-N 268.277 -0.548 5 20 CBBD O=C(NCCc1ccccc1[N+](=O)[O-])C1(O)CNC1 595940207 OTSQFISSZSVXAP-UHFFFAOYSA-N 265.269 -0.412 5 20 CBBD Cc1[nH]nc(C(=O)N2CCOC[C@@H]2C(=O)O)c1[N+](=O)[O-] 595985421 JMQABLOMDIRKOP-ZCFIWIBFSA-N 284.228 -0.448 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1CN(C(=O)O)C1 740368461 VONJLCXSHDNFLW-UHFFFAOYSA-N 283.244 -0.340 5 20 CBBD CNC(=O)NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cn1 761983123 MQFSGPGVUZEDFY-ZCFIWIBFSA-N 296.239 -0.009 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 763699729 LSWXAHVTYMDBFE-SECBINFHSA-N 267.241 -0.569 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 814042333 ICUBQVLYPVNRRS-JMCQJSRRSA-N 299.283 -0.085 5 20 CBBD O=C(O)CNC(=O)COC(=O)c1cccc([N+](=O)[O-])c1 821533068 XFYIJIJRCPRMIM-UHFFFAOYSA-N 282.208 -0.048 5 20 CBBD CCOC1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839739837 LZOGRYCOEGFLAQ-VCZAYRLQSA-N 258.274 -0.302 5 20 CBBD CCn1nc(C)c(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 840674083 GKBUHHWFRGJGMA-HTQZYQBOSA-N 282.256 -0.002 5 20 CBBD O=[N+]([O-])CCN1CCC(O)(CN2CCOCC2)CC1 930165778 AKJMEKRQCHLJGP-UHFFFAOYSA-N 273.333 -0.578 5 20 CBBD O=C(NC1CN(C(=O)c2ccncn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991292229 DIKKJRUHDYUTIC-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCc1nc[nH]n1 1346724788 DIRVDRKKMMDUIM-UHFFFAOYSA-N 252.190 -0.347 5 20 CBBD O=C(O)CN1CC[C@H](n2ncc([N+](=O)[O-])n2)C1=O 1595086794 NUYLEKGVABPLDW-YFKPBYRVSA-N 255.190 -0.956 5 20 CBBD O=C(N[C@H](CCF)C(=O)O)c1cc([N+](=O)[O-])n[nH]1 1608397521 ROHLYQMNDDHXLH-SCSAIBSYSA-N 260.181 -0.140 5 20 CBBD NC(=O)[C@@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 228681500 IUXRARSVPVCQJO-ZJUUUORDSA-N 269.257 -0.936 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 229420298 RABDAXXCJMSRKN-KRTXAFLBSA-N 297.267 -0.035 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@@H](O)[C@H](O)C1 236532431 BHYMSWXKJLYIEP-RKDXNWHRSA-N 288.281 -0.679 5 20 CBBD COc1cc(C(=O)N[C@@H](CO)C(N)=O)cc([N+](=O)[O-])c1C 286502902 WFFZCIOCCNREIO-QMMMGPOBSA-N 297.267 -0.512 5 20 CBBD CCOC(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 299571399 WAJZJZICPKWOCW-UHFFFAOYSA-N 256.218 -0.081 5 20 CBBD CNC(=O)CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338684440 OFCSSKBBMQREIF-UHFFFAOYSA-N 283.288 -0.221 5 20 CBBD CC(C)N(CC(N)=O)C(=O)c1cc([N+](=O)[O-])cnc1N 352621706 TYSDEHHANXYWTN-UHFFFAOYSA-N 281.272 -0.092 5 20 CBBD COc1ccc(NC(=O)[C@H](CO)NC(N)=O)cc1[N+](=O)[O-] 360749756 ZQSDKXKNTJCXPP-ZETCQYMHSA-N 298.255 -0.429 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C1CC1 360753939 KAWHIEAZHNILEM-QMMMGPOBSA-N 254.246 -0.171 5 20 CBBD COc1cc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 450616076 RBTAPTBHALZSMG-MRVPVSSYSA-N 294.267 -0.322 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCc1nc(N)no1 530773073 FEMTWQNYWRBBGA-UHFFFAOYSA-N 280.244 -0.129 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@@H](CO)[C@H](O)C2)c1 554744083 WBDPDCHIKUVTOO-GXSJLCMTSA-N 270.289 -0.534 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H]2CNC[C@H]2C1 569358662 FYQFGZBAIWBZBH-YUMQZZPRSA-N 265.273 -0.001 5 20 CBBD CC1(C)CN[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 591686788 ZNXODDFVPQFCSS-VIFPVBQESA-N 267.289 -0.095 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)Cn1ccc([N+](=O)[O-])n1 598180933 HXMVPEHHVLXQMM-VIFPVBQESA-N 284.272 -0.335 5 20 CBBD COC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(N)=O 760886671 CMWRPFGZIFYEMX-ZETCQYMHSA-N 283.240 -0.470 5 20 CBBD COCC(=O)COC(=O)Cn1cc([N+](=O)[O-])nc1C 795474616 YYSUCXXOPDXABJ-UHFFFAOYSA-N 271.229 -0.142 5 20 CBBD CC(C)(F)C(=O)N[C@H]1[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@H]21 976032054 HMCVNPSAJCUITK-SPFKKGSWSA-N 299.302 -0.027 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCn2ccnc21 1261782659 PBKZQDYSXLQOSC-UHFFFAOYSA-N 263.217 -0.570 5 20 CBBD CC(C)NC(=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319651236 JECQCRJJFJYBFT-UHFFFAOYSA-N 283.288 -0.027 5 20 CBBD C[C@@H](N)C[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 1329518841 CMJGZYGSHIBLSG-RNFRBKRXSA-N 256.266 -0.572 5 20 CBBD CCN1C[C@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)CC1=O 1346295298 PMQHBJMHQVONHP-QMMMGPOBSA-N 296.287 -0.829 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCNC[C@@H]2O)n1 1578349821 AUNJAYLLUWMKQU-CBAPKCEASA-N 283.288 -0.736 5 20 CBBD Cn1cc(CN2C[C@@H](O)C[C@H](C(=O)O)C2)c([N+](=O)[O-])n1 1608113930 WNOMAJGQQJXCSX-CBAPKCEASA-N 284.272 -0.404 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCC(=O)O)ccc1[N+](=O)[O-] 35097182 RMIJLWMTVSWCBD-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD CNC(=O)CN(C)c1nc(C(=O)O)ccc1[N+](=O)[O-] 166674364 RMPBTOUEKPAZQF-UHFFFAOYSA-N 268.229 -0.130 5 20 CBBD COCCN(C)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 263767630 MKGJCBFMBSSSPY-UHFFFAOYSA-N 285.304 -0.066 5 20 CBBD COCCN(CCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266526954 KRSXHSKWYJXETH-NSHDSACASA-N 288.304 -0.907 5 20 CBBD CC(C)[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(N)=O 269124064 FUFKYNUMXTYVJM-ZCFIWIBFSA-N 254.250 -0.111 5 20 CBBD C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)[C@@H](O)C1 278556910 BFKUKUQKNZCIGM-ZHAHWJHGSA-N 295.295 -0.041 5 20 CBBD O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCC[C@H](OCCO)C1 285914944 ZISDJVJKWXMVFY-QMMMGPOBSA-N 284.272 -0.069 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N2CC(O)C2)n1 342112082 NVAUNDZGTZBMPW-UHFFFAOYSA-N 253.214 -0.043 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCN1CCCC1 349673937 INEKBRAFZFKLFP-UHFFFAOYSA-N 282.304 -0.212 5 20 CBBD COCCNCCNc1ncc([N+](=O)[O-])c(C)n1 420217574 JVIVDSRFEDYDGI-UHFFFAOYSA-N 255.278 0.341 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@@H](CO)[C@@H](O)C2)c1 554744086 WBDPDCHIKUVTOO-ONGXEEELSA-N 270.289 -0.534 5 20 CBBD C[C@H]1CNCCN1C(=O)c1c([N+](=O)[O-])cnn1C 569843866 XBYVXMLBXCZKOT-ZETCQYMHSA-N 253.262 -0.238 5 20 CBBD CCC[C@H](O)[C@H](CO)Nc1ccc(N)c([N+](=O)[O-])n1 596272488 HMQDWYLEZWCIQJ-IUCAKERBSA-N 270.289 0.506 5 20 CBBD C[C@@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)[C@H](C)CO1 596428116 HELCUQLGQFQLPS-RKDXNWHRSA-N 296.331 -0.090 5 20 CBBD C[C@@]1(NC(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 597430899 BCTCZBGNDHJZDB-LLVKDONJSA-N 282.304 -0.158 5 20 CBBD CO[C@H]1C[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 600761824 SLFMSWMOZRHMRC-FBIMIBRVSA-N 270.289 -0.081 5 20 CBBD C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 610714620 ZZTGSHMQWFOHBW-PSASIEDQSA-N 294.315 -0.215 5 20 CBBD CNC(=O)[C@@H]1CN(c2cccnc2[N+](=O)[O-])CCO1 611618258 WBXSJXARUSOICS-VIFPVBQESA-N 266.257 -0.059 5 20 CBBD CCS(=O)(=O)CC(=O)OCCn1cc([N+](=O)[O-])cn1 748123542 PCGHYSIEAYMTAW-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD COC(=O)C1(C(=O)OCCn2cnc([N+](=O)[O-])n2)CC1 766873768 QPEGKXGCSPINRE-UHFFFAOYSA-N 284.228 -0.317 5 20 CBBD CC(C)(CCC(=O)NC[C@@H]1CN2CCN1CC2)[N+](=O)[O-] 827167457 XNHSBWFRNZMAIQ-LLVKDONJSA-N 284.360 -0.062 5 20 CBBD O=C(NC1CC1)N[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839725705 ISWOPQALMZMREA-OPRDCNLKSA-N 282.300 -0.286 5 20 CBBD Cc1noc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1022061460 JFDCOKXMTGCYQM-UTINFBMNSA-N 295.299 -0.220 5 20 CBBD NC(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-] 1094079534 NEOYJJCWFNRMIA-UHFFFAOYSA-N 252.230 -0.392 5 20 CBBD CS(=O)(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321423829 KKZRNTNIMRQGMH-UHFFFAOYSA-N 262.247 -0.908 5 20 CBBD NC(=O)N1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 1328355633 IVGNYUIAOFYAMA-ZETCQYMHSA-N 282.260 -0.940 5 20 CBBD CN(CCOCCO)c1nccc(C(N)=O)c1[N+](=O)[O-] 1347398160 LHZCLFICQKICEU-UHFFFAOYSA-N 284.272 -0.466 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CO1 1349444899 YCHBWEUTLOVERP-RQJHMYQMSA-N 255.234 -0.520 5 20 CBBD Nc1ccc(N2C[C@@H](O)C[C@H](C(=O)O)C2)nc1[N+](=O)[O-] 1601216192 YNBKXFLGZVKONV-BQBZGAKWSA-N 282.256 -0.156 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCNC(=O)C1 48387475 HZABZUJVGXHNGZ-UHFFFAOYSA-N 264.241 -0.130 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CCO1 50858442 XMJHAJDXTQJSTH-SNVBAGLBSA-N 279.252 -0.079 5 20 CBBD CN1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 122175278 KAQPULLOJMTLKN-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD NC(=O)CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 123752671 LJCDDHMGGFYTNN-UHFFFAOYSA-N 289.251 -0.004 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H](O)CN1 150755156 OUBWGIAFGWRTPN-RYUDHWBXSA-N 294.311 -0.154 5 20 CBBD COCCN(CCO)CCn1cc([N+](=O)[O-])cn1 174870079 ATUUZNJFJBMIMA-UHFFFAOYSA-N 258.278 -0.268 5 20 CBBD COC(=O)[C@H](O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 217729381 HCGWVOWOSBBDMS-SNVBAGLBSA-N 282.252 -0.213 5 20 CBBD O=C(N[C@]1(CO)CCOC1)c1ccc([N+](=O)[O-])[nH]1 273449827 WZOKQAJDLSZUNN-JTQLQIEISA-N 255.230 -0.196 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@H](O)CN2C[C@@H](O)[C@H](O)C2)c1 278717471 KMLDZBBXBYPQCP-RAIGVLPGSA-N 298.295 -0.628 5 20 CBBD CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@H]1OC 286462521 JYVIYLFHWKUPTE-OCAPTIKFSA-N 270.245 -0.196 5 20 CBBD Cn1c(C(=O)NCC(=O)N2CCOCC2)ccc1[N+](=O)[O-] 330676798 KNAXEYKAAAILNE-UHFFFAOYSA-N 296.283 -0.478 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCN2C(=O)CC[C@@H]2C1 346073686 LWHFVESOSIGAHT-SECBINFHSA-N 293.283 -0.376 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCOCCO 353654834 FMBWWCSFDNWQOK-UHFFFAOYSA-N 270.245 -0.689 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N 428578221 GSRRMFNYUQSZGO-SSDOTTSWSA-N 293.283 -0.125 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@H]1CNC(=O)O1 495656578 XJIIEBOVGKVDDR-MRVPVSSYSA-N 284.228 -0.167 5 20 CBBD Nc1nccc(C(=O)NCCCn2ccnn2)c1[N+](=O)[O-] 566018961 UVDZRLUEQZZCBG-UHFFFAOYSA-N 291.271 -0.016 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C1 599766847 OSOJFEZVTYMDIR-LJGSYFOKSA-N 279.256 -0.203 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])ncn2C)[C@H](CO)C1 601980403 VLFMOANIIRLMRV-QMMMGPOBSA-N 255.278 -0.559 5 20 CBBD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC(=O)O 619470143 NLRAZQUAFLRFOM-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD O=C1CN(NC(=O)c2cc(O)ccc2[N+](=O)[O-])C(=O)N1 795284015 NHGRJDTWNSCLNB-UHFFFAOYSA-N 280.196 -0.503 5 20 CBBD C[C@@H]1CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)CO1 855405958 BFKGWKHOGUUEHD-GWOFURMSSA-N 271.317 -0.123 5 20 CBBD COCC(=O)N1CCC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 943541734 ACZGASIZBHBPOG-NXEZZACHSA-N 285.300 -0.595 5 20 CBBD Cc1cc(NCCNC(=O)CNC(N)=O)ncc1[N+](=O)[O-] 1093500732 JBABWQXXJNDBBY-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD O=C1CC[C@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)CN1 1122871368 VKCULKCDDPSTNE-LURJTMIESA-N 269.217 -0.992 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C(N)=O)C1 1318073191 BRTYWPJVFGXKKU-SECBINFHSA-N 282.256 -0.740 5 20 CBBD O=C(NC[C@H]1CNCCO1)c1n[nH]cc1[N+](=O)[O-] 1349271291 JRJJZNDNCVQLCV-ZCFIWIBFSA-N 255.234 -0.964 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN(CCO)CCO 49753475 NUAWGGUMEDOLSC-UHFFFAOYSA-N 258.278 -0.614 5 20 CBBD NC(=O)[C@H]1CCCN1CCn1ccc([N+](=O)[O-])n1 176231477 BQYFXURMNYJGAA-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H](C(N)=O)C1 188597593 CGCCVEJYYIBQCW-SCZZXKLOSA-N 295.299 -0.096 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCCN1C(=O)CNC1=O 264484861 REUAETKRDFQQRE-UHFFFAOYSA-N 282.260 -0.318 5 20 CBBD NC(=O)COCCNC(=O)CNc1ccccc1[N+](=O)[O-] 268482373 JHXMSCNZGVHQOI-UHFFFAOYSA-N 296.283 -0.375 5 20 CBBD O=C(CNC(=O)c1ccc(F)cc1[N+](=O)[O-])NCCO 269536153 KNQQXSFHOTYCLO-UHFFFAOYSA-N 285.231 -0.428 5 20 CBBD NC(=O)[C@H](CO)Nc1ncc(Cl)cc1[N+](=O)[O-] 286301626 JOWNQDWHBMAOTA-YFKPBYRVSA-N 260.637 -0.099 5 20 CBBD CN(c1ncc([N+](=O)[O-])c(N)n1)[C@@H]1COC[C@H]1O 286426561 RNBXGAVLKQBCLL-RNFRBKRXSA-N 255.234 -0.837 5 20 CBBD NC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 299155133 RMRMMCZHMZVKPA-UHFFFAOYSA-N 281.272 -0.834 5 20 CBBD CN1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 299613486 GQUYAESDTZDSPF-SSDOTTSWSA-N 267.245 -0.862 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CC(=O)NC1=O 347176287 WSJLXZUFQSZFOS-ZCFIWIBFSA-N 295.255 -0.795 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2ccc([N+](=O)[O-])o2)C1 358047610 MBFMQYMPBYJZKP-NSHDSACASA-N 269.257 -0.016 5 20 CBBD CC(CO)(CO)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 393878443 AIOPCKFLJPFYCL-UHFFFAOYSA-N 257.246 -0.356 5 20 CBBD CN[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 428449529 UDXKSHABSLUMQA-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN3C(=O)NC[C@@H]3C2)c1[N+](=O)[O-] 431601520 CUACKYSSXWEGQJ-SSDOTTSWSA-N 294.271 -0.524 5 20 CBBD CC[C@@H](CO)NC(=O)c1ccnc(NC)c1[N+](=O)[O-] 565176986 IFTCZWBLEBQXSY-ZETCQYMHSA-N 268.273 0.532 5 20 CBBD CC(C)(C)n1nnc(Cn2cnc([N+](=O)[O-])n2)n1 594452711 ICRIGSCJODXZKF-UHFFFAOYSA-N 252.238 -0.024 5 20 CBBD COC(=O)COCCNc1ncc([N+](=O)[O-])cn1 599155856 DKNGMFAJCUCABW-UHFFFAOYSA-N 256.218 -0.014 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)CCc1cccc([N+](=O)[O-])c1 618924016 OKDBWBRDRNYHHQ-JTQLQIEISA-N 281.268 -0.510 5 20 CBBD O=C(NCCN=c1cc[nH]cc1)[C@@H]1C[C@H]1[N+](=O)[O-] 839554121 VPKZAFFTJFEWLE-NXEZZACHSA-N 250.258 -0.303 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CCN(S(C)(=O)=O)C1 839777174 RGTKXHBNZJHSHS-IWSPIJDZSA-N 291.329 -0.856 5 20 CBBD CN[C@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923278147 PKYNDQYWSOAFOR-GXSJLCMTSA-N 269.305 -0.554 5 20 CBBD NC(=O)C(=O)NC/C=C/CNc1ncc([N+](=O)[O-])cc1F 1107480549 MVTHNOVIWMCSNO-OWOJBTEDSA-N 297.246 -0.302 5 20 CBBD CCCNC(=O)CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767429 MLNCARPPGCYWOH-NXEZZACHSA-N 286.332 -0.726 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CNCCO1 1326451080 LFYUXZZPTJHIKD-SSDOTTSWSA-N 269.261 -0.954 5 20 CBBD C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1343706085 OPCVSQLFXTVPST-YFKPBYRVSA-N 256.218 -0.221 5 20 CBBD Cn1cnnc1COCC(=O)OCCC[N+](=O)[O-] 1346360602 BMGABGJTFOQNFE-UHFFFAOYSA-N 258.234 -0.458 5 20 CBBD CO[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[C@H]1C(=O)O 1777176951 IQPXFGHXGLIALX-SVRRBLITSA-N 297.271 -0.107 5 20 CBBD C[C@H](C(N)=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 26484521 XKJRMSJSCNVTSV-SECBINFHSA-N 279.300 -0.014 5 20 CBBD CS(=O)(=O)c1ccc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 90281608 APPXKRXFRJQPSX-SSDOTTSWSA-N 290.297 -0.237 5 20 CBBD O=C1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCCN1 112207104 YVZTUTVAMDOEBJ-UHFFFAOYSA-N 252.230 -0.115 5 20 CBBD CC(C)(CO)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 135091410 VDMGLYHKYPRKMR-JTQLQIEISA-N 272.305 -0.240 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C)N1 154087007 JDYBFYGBYUACHU-AOOOYVTPSA-N 294.311 -0.035 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 217694762 NRJZEPGEXZHORA-JTQLQIEISA-N 282.252 -0.213 5 20 CBBD CN1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285358265 ZRRMPQQPTNCUQA-SSDOTTSWSA-N 269.261 -0.622 5 20 CBBD NC(=O)[C@H](CO)NC(=O)CCNc1ccccc1[N+](=O)[O-] 286537557 YQTICTOEIOUQIX-VIFPVBQESA-N 296.283 -0.641 5 20 CBBD CN1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 343333138 GHIXGBRTFLXJJA-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD Cc1[nH]nc(C(=O)NC(C)(C)c2nn[nH]n2)c1[N+](=O)[O-] 354791088 PXELQCLQFFLTDD-UHFFFAOYSA-N 280.248 -0.195 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC1(CC(N)=O)CCC1 360744316 IQJORWJGUPABGW-UHFFFAOYSA-N 281.272 -0.144 5 20 CBBD CC[C@H](NC(=O)c1ccnc(NC)c1[N+](=O)[O-])C(=O)NC 566464286 DBSNJKYYALXVRE-QMMMGPOBSA-N 295.299 0.286 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]1)N(CCO)CCOCCO 600116775 OGUXEFXUTLDEKP-UHFFFAOYSA-N 287.272 -0.634 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 600462782 ZGLZNXUSSFIUNZ-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD Cn1cc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)nn1 611930512 SCRUHDZFXHUATA-UHFFFAOYSA-N 277.244 -0.171 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619260325 WUMLZBXPJOAICJ-QMMMGPOBSA-N 281.272 -0.086 5 20 CBBD CCNS(=O)(=O)[C@@H]1CCN(CC[N+](=O)[O-])C1 930177799 PGISZSRJOIWHRL-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD O=C(NC1CCN(CCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1002786561 BOHNJEKGLAJXBX-NXEZZACHSA-N 257.290 -0.776 5 20 CBBD Cn1ccnc(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1=O 1116234152 SCJZUYWIBUTUDU-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD COC(=O)[C@@H](C)OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116347374 JAXDGZXUSQQHLO-SSDOTTSWSA-N 284.224 -0.139 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)[C@H](CO)C2)c1[N+](=O)[O-] 1118317610 RLHPCHYLCBVUAY-IONNQARKSA-N 296.283 -0.543 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CNOC1 1579869061 QNHMXKDVXRMZRO-SSDOTTSWSA-N 255.234 -0.881 5 20 CBBD Cn1ncnc1Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1601039396 GOGDVXBZBQTMFI-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD O=C(O)[C@@H]1C[C@H](F)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 1602196719 LIGTVGXHXXAYIT-BQBZGAKWSA-N 286.219 -0.185 5 20 CBBD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NCCO 35100880 FXIBAOFRTUHPRV-UHFFFAOYSA-N 293.235 -0.701 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C)CO1 49090213 NVQBXAOKSDSRLV-HTQZYQBOSA-N 269.261 -0.178 5 20 CBBD O=C1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CN1 110910503 QRCMBOPKWCOTTD-LURJTMIESA-N 280.240 -0.296 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 230684882 JUIYUDKNQLJLLO-UHFFFAOYSA-N 288.285 -0.654 5 20 CBBD CN[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 269133902 PMFNBKGYUDHGAP-SECBINFHSA-N 280.284 -0.423 5 20 CBBD C[C@H](O)C[C@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 274379154 FVXVPSDHZIULEG-YUMQZZPRSA-N 284.272 -0.070 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C1CCOCC1 330853183 RBWIYZBCHKHVLU-LLVKDONJSA-N 298.299 -0.305 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 436740745 RFPZMLCNYBIMGR-VIFPVBQESA-N 298.251 -0.046 5 20 CBBD O=C(NC[C@H]1CN2CCN1CC2)c1c[nH]nc1[N+](=O)[O-] 548958890 DRBPIBITLBATPE-QMMMGPOBSA-N 280.288 -0.953 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1 580961868 HCTOVVVYEJAWMY-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](C)[C@@H](O)C2)c1[N+](=O)[O-] 594335935 YUMFRHCMFRPIRS-APPZFPTMSA-N 280.284 0.484 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCOCC(=O)O 600875948 LPHAGAAMAAWMHH-UHFFFAOYSA-N 286.244 -0.683 5 20 CBBD C[C@@H]1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C[C@H]1O 611257457 OILALQIQUSKNRP-HTQZYQBOSA-N 287.297 -0.009 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NS(=O)(=O)CCCF 747132998 OMAFLSZSOXAXQL-UHFFFAOYSA-N 294.264 -0.403 5 20 CBBD CN1C(=O)CN(NC(=O)c2cc([N+](=O)[O-])ccc2N)C1=O 787203914 ZQUSTKYMVSWYKF-UHFFFAOYSA-N 293.239 -0.284 5 20 CBBD NC(=O)[C@@H](O)CNc1nc2ccccn2c1[N+](=O)[O-] 808050500 CWHWPYQPYQEWAK-LURJTMIESA-N 265.229 -0.499 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)O[C@H]1CNOC1 808089542 VUKKUTLHEXOYTG-QMMMGPOBSA-N 256.218 -0.372 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](C(=O)O)C1 821314992 GEGNCQVWTRSWJS-ZCFIWIBFSA-N 268.229 -0.125 5 20 CBBD Cc1nn(C)c(C(=O)N[C@]2(CO)CCOC2)c1[N+](=O)[O-] 1116584101 AGWKYISEYJBUHO-NSHDSACASA-N 284.272 -0.482 5 20 CBBD Cc1nn(C)c(C(=O)N2CCn3ncnc3C2)c1[N+](=O)[O-] 1116634112 JKJBLSAGIHCXMN-UHFFFAOYSA-N 291.271 -0.116 5 20 CBBD Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H](CO)C(N)=O 1329548386 SAVVVRRWFQHJPI-ZETCQYMHSA-N 285.231 -0.382 5 20 CBBD CNCCOCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1578709904 RKSIELXUBKONLR-UHFFFAOYSA-N 298.299 -0.891 5 20 CBBD Cn1c(C(=O)Nc2ncn(CC(=O)O)n2)ccc1[N+](=O)[O-] 1594517807 KPMBFZDKHANSGO-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1601908126 AKEDCXJRHITRJF-ONGXEEELSA-N 298.251 -0.420 5 20 CBBD COC(=O)[C@@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])n1C 1606324581 VALFHOOZTGIGOY-ZCFIWIBFSA-N 299.239 -0.321 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 228753581 HICGFYPSQHVDQW-NSHDSACASA-N 270.289 -0.035 5 20 CBBD C[C@@]1(O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 248342720 JSRDGCSYONGVEG-GHMZBOCLSA-N 270.289 -0.391 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(CCO)CC2)c1[N+](=O)[O-] 267969596 UCZUFYWYVONAMD-UHFFFAOYSA-N 283.288 -0.624 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 273524490 XIEAUMPKSCERIY-ZETCQYMHSA-N 284.224 -0.436 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)C1 276163889 AJSIBTIFHLMIBQ-SECBINFHSA-N 292.251 -0.045 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 342556466 DGFTYXCZBQKACF-RXMQYKEDSA-N 257.206 -0.882 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 445212090 LNHPPKYJCYXKGU-SSDOTTSWSA-N 294.267 -0.002 5 20 CBBD CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 555555586 GFBUFWMSUXUSAC-UHFFFAOYSA-N 266.213 -0.636 5 20 CBBD CC(C)Oc1nc(NCC(=O)NCCO)ccc1[N+](=O)[O-] 565547771 FAEDLNQNNLHMGY-UHFFFAOYSA-N 298.299 0.297 5 20 CBBD C[C@](O)(CNc1ncc([N+](=O)[O-])c(N)n1)C(=O)O 567983343 BPRFFWYXAPOXCI-QMMMGPOBSA-N 257.206 -0.786 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](O)[C@@H](N(C)C)C2)c1[N+](=O)[O-] 573631873 DFDAHGBDNNSCDJ-YUMQZZPRSA-N 283.288 -0.627 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592368899 MGISLVNWVBPMLA-ZCFIWIBFSA-N 270.201 -0.757 5 20 CBBD N[C@@]12CCC[C@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 598670282 TVCFVRWCSLEROW-GZMMTYOYSA-N 280.288 -0.474 5 20 CBBD CN(C)C(=O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 612778445 MYWSPZYWHHTRHO-UHFFFAOYSA-N 294.315 -0.405 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)NC1CC1 766966961 HWVTUSLITQRFAA-UHFFFAOYSA-N 268.229 -0.236 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1 787269329 DDKPINPMXOSMAC-CYBMUJFWSA-N 294.311 -0.027 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC[C@@H]1CCNC1=O 813916958 RPWIXHWMANDULH-QMMMGPOBSA-N 282.256 -0.139 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)O 833009676 OAPMJXOGBVUHIL-QMMMGPOBSA-N 269.213 -0.526 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2COC[C@H]2O)c1 843117609 QQTMOTRANDWEHR-IJLUTSLNSA-N 268.269 -0.023 5 20 CBBD CC(=O)NCC(C)(C)C(=O)OCCn1cnc([N+](=O)[O-])n1 845481418 AHBSNVJEISVGPE-UHFFFAOYSA-N 299.287 -0.108 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1COC(=O)C1 854556967 FAUWBGDVGPYFIN-LURJTMIESA-N 253.214 -0.021 5 20 CBBD COC[C@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 886866638 NAYJWTBEBVDTNT-QMMMGPOBSA-N 284.272 -0.184 5 20 CBBD O=C(NCCCOCCO)c1c[nH]nc1[N+](=O)[O-] 1256667398 HKHOLAJFRWRXQA-UHFFFAOYSA-N 258.234 -0.553 5 20 CBBD C[C@@H](CN1CCCC1=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1318013802 ZMGJDEDSRLLEND-QMMMGPOBSA-N 296.287 -0.687 5 20 CBBD Cc1nnc(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)n1C 1343526978 QPWAPKWPIIRQMW-UHFFFAOYSA-N 293.287 -0.413 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCCOCC(=O)O 1600748615 XKKLTGRGNFZAPM-UHFFFAOYSA-N 286.244 -0.683 5 20 CBBD COC[C@@H](O)CNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1605127616 BCFATFHFNRHEDX-ZETCQYMHSA-N 295.259 -0.411 5 20 CBBD O=C(O)CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C1CC1 1610779823 YQDWLEAZXWRVRG-UHFFFAOYSA-N 295.251 -0.168 5 20 CBBD O=C(NCCC(=O)N1CCOCC1)c1cc([N+](=O)[O-])c[nH]1 42626372 JUIGUYJXLHMYHM-UHFFFAOYSA-N 296.283 -0.098 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)NCCOCCO)cc1 52925272 AXSOURPFBODNMQ-UHFFFAOYSA-N 290.297 -0.118 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(=O)NC(C)C 65719921 PIMWIVAGAATASX-UHFFFAOYSA-N 283.288 -0.259 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NN1CCOCC1 123903323 IDOGYVANMBMKJU-UHFFFAOYSA-N 269.261 -0.455 5 20 CBBD COC(=O)CNC(=O)Cn1c([N+](=O)[O-])cnc1C 130309450 CRRIVRGFXMLELK-UHFFFAOYSA-N 256.218 -0.611 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 194344374 GQUSTJAYZGUZSP-GMSGAONNSA-N 281.272 -0.568 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 194344413 GQUSTJAYZGUZSP-XVKPBYJWSA-N 281.272 -0.568 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@](C)(O)C(=O)O 262341698 CRLGZMXLTHPUMP-NSHDSACASA-N 283.240 -0.136 5 20 CBBD CN1CCC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 331089156 GGFISTZOJIWMNQ-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC1=O 338667990 QZVPIUCQYCWCTG-SSDOTTSWSA-N 266.257 -0.106 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 341732878 GONZPWYSYQPISJ-SECBINFHSA-N 293.283 -0.125 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354345262 YVVYWKIZFPBFEU-SNVBAGLBSA-N 271.277 -0.640 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 354631811 NQFCMVYCZLSNQP-MRVPVSSYSA-N 283.240 -0.559 5 20 CBBD NS(=O)(=O)CCn1cc([N+](=O)[O-])cc(Cl)c1=O 357572915 KBLOGJMXORFNJA-UHFFFAOYSA-N 281.677 -0.302 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1CO 360857145 PWQRRTNFMOPMRO-RKDXNWHRSA-N 268.273 -0.122 5 20 CBBD CCC[C@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 412549234 PXFJHOZGEQOQGF-SFYZADRCSA-N 272.261 -0.430 5 20 CBBD CC(C)[C@H](N)CNC(=O)Cn1cnc([N+](=O)[O-])n1 429178996 FWAPAEHCACAUPY-SSDOTTSWSA-N 256.266 -0.714 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 588866125 BGGWSYIFWDMQKO-SSDOTTSWSA-N 256.262 -0.425 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 592198822 OYKQFOSXJUGEKQ-ZJUUUORDSA-N 298.299 -0.353 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCC[C@H]1C(=O)O 595249658 ITKGRMHSMHIELJ-RQJHMYQMSA-N 283.244 -0.444 5 20 CBBD NCCN(Cc1c(F)cccc1[N+](=O)[O-])C[C@@H](O)CO 595903522 XJVCOKYWLKTDNZ-SECBINFHSA-N 287.291 -0.152 5 20 CBBD O=C1NC[C@H]2CN(c3cccnc3[N+](=O)[O-])CCN2C1=O 610770294 WYBPDKISSRSPNS-QMMMGPOBSA-N 291.267 -0.863 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@H]2CCNC2=O)c1=O 1118322936 WVGFZPXUHNMGJT-SSDOTTSWSA-N 294.267 -0.618 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H](c2nc[nH]n2)C1 1331997175 PBHHLLNSLCTOTG-MRVPVSSYSA-N 291.271 -0.075 5 20 CBBD CC(=O)N1C[C@@H]2CN(c3nnc(C[N+](=O)[O-])n3C)C[C@@H]2C1 1341371004 GQKDBCFOVNLSSW-AOOOYVTPSA-N 294.315 -0.494 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])ccc1=O 1601771882 HZWKYPQHUFIMEN-NXEZZACHSA-N 297.267 -0.724 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCN(CCO)CC1 35118446 BBMJZBGNRJBBMO-UHFFFAOYSA-N 282.300 -0.317 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H](O)CO)cc1 95082618 DOASXPUDFCLNMD-MNOVXSKESA-N 256.258 -0.429 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C(=O)O 111252182 KCZQLFIXSWJPFH-APPZFPTMSA-N 282.256 -0.030 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](CN)C1 165592741 FDMWFXRDBCJXLE-VIFPVBQESA-N 268.273 -0.267 5 20 CBBD CC(=O)NC[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 172170396 QFIGFTMFPYBUTA-LLVKDONJSA-N 283.288 -0.414 5 20 CBBD CN(CC(=O)N1CCNC(=O)C1)c1ccccc1[N+](=O)[O-] 173073490 VSPVXUCNDOCSMP-UHFFFAOYSA-N 292.295 -0.011 5 20 CBBD NC(=O)N1CCCN(CCn2ccc([N+](=O)[O-])n2)CC1 177024822 SBGCFIMYWIBIRV-UHFFFAOYSA-N 282.304 -0.122 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@H](C(N)=O)C1 288124167 LZGJQQGGHJRASC-QMMMGPOBSA-N 283.288 -0.190 5 20 CBBD CCC[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 343476800 NVCAICVFODXXMR-VIFPVBQESA-N 283.288 -0.048 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 351864016 RFHKXSJYCVAQSR-APPZFPTMSA-N 254.246 -0.370 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 352994687 WLEASZKMUBKMMN-SNVBAGLBSA-N 292.251 -0.348 5 20 CBBD COCCOC1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1 357535227 NCPXKJWHHHLYRW-UHFFFAOYSA-N 296.283 -0.060 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 358339730 YEVKABLAAJFTDX-NSHDSACASA-N 281.272 -0.485 5 20 CBBD CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 412516364 FVMMEQPNFNTVPK-NXEZZACHSA-N 298.299 -0.176 5 20 CBBD O=C(NCCc1nc[nH]n1)c1cnc(O)c([N+](=O)[O-])c1 444994919 FVWRWFPSAHBIET-UHFFFAOYSA-N 278.228 -0.214 5 20 CBBD O=C(NC[C@]1(O)CN2CCC1CC2)c1cc([N+](=O)[O-])n[nH]1 563820749 XUEKIHUMDBTGBA-LBPRGKRZSA-N 295.299 -0.496 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 594352108 OGCHWDJYPLCJTD-GFCCVEGCSA-N 293.283 -0.091 5 20 CBBD CC(C)[C@@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC(N)=O 840672978 UTSOWYFLAUSSBM-FSDSQADBSA-N 273.245 -0.586 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)[C@H]1CCCO1 862656466 DNYYZXADZZJZBK-NXEZZACHSA-N 296.283 -0.158 5 20 CBBD O=C(N[C@H](CO)C1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1116942473 VWKLESLRYGJKLS-SECBINFHSA-N 284.272 -0.165 5 20 CBBD CN(C)CCONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261744707 OACAJDNBDLVUFF-UHFFFAOYSA-N 284.272 -0.634 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H]1C(N)=O 1329202019 UXINFBSOPOWBAH-LURJTMIESA-N 267.245 -0.582 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@@H]1C[C@H](F)CN1 1329520482 IUEMQCLUYWBEPK-IUCAKERBSA-N 298.274 -0.427 5 20 CBBD COC[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])CCO1 1347399339 XQWWDMWYVSPTEA-QMMMGPOBSA-N 296.283 -0.060 5 20 CBBD N[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1580411982 SYISRERRQNCZKA-ZETCQYMHSA-N 254.250 -0.864 5 20 CBBD COC(=O)CCCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591264137 VEJXFTPKARDGAB-UHFFFAOYSA-N 281.232 -0.075 5 20 CBBD O=C(NC(CO)CO)c1cc(F)cc([N+](=O)[O-])c1 165743108 PBLRUHOCSIREJP-UHFFFAOYSA-N 258.205 -0.183 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1ccc([N+](=O)[O-])cc1O 274784192 JYVHSWZSRRNAHA-QMMMGPOBSA-N 270.241 -0.274 5 20 CBBD O=C(O)[C@H]1CC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)O1 276183046 SNZBELCYHVOEQZ-RKDXNWHRSA-N 298.255 -0.460 5 20 CBBD C[C@H](C[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286105545 OXLXBORJWIYUDJ-NEXAQPNMSA-N 260.275 -0.185 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N(CCO)CCO 288829049 IWMOBXGRVNONCA-UHFFFAOYSA-N 258.278 -0.089 5 20 CBBD O=C(NC[C@H]1CC[C@@H](CO)O1)c1cnc(O)c([N+](=O)[O-])c1 293758398 URGNMPQQRULKNJ-BDAKNGLRSA-N 297.267 -0.035 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCCO1 330559459 ANQFFIKSIVHZQE-SNVBAGLBSA-N 284.272 -0.287 5 20 CBBD CNC(=O)N[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 341562552 JDAULKVFDDYZAM-ZCFIWIBFSA-N 281.276 -0.525 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 344003666 CSGQERHRDYEQNA-JTQLQIEISA-N 272.261 -0.165 5 20 CBBD C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)N(C)C 357685197 YZAFICHHOKLFAM-LURJTMIESA-N 281.272 -0.023 5 20 CBBD COC(=O)C1(C)CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 425137894 GKZUEGHQRAVMNJ-UHFFFAOYSA-N 282.256 -0.187 5 20 CBBD CO[C@@]1(C)C[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 598458916 BHWPTIYMPUSOPK-MUWHJKNJSA-N 255.234 -0.520 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(O)(C(=O)O)CC1 738409708 CVUBPJDHYRKDDX-UHFFFAOYSA-N 270.245 -0.256 5 20 CBBD NC(=O)c1ccc(COC(=O)CO)c([N+](=O)[O-])c1 765402932 HEQLDJFJAQDXCB-UHFFFAOYSA-N 254.198 -0.271 5 20 CBBD CN1C[C@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 772765952 KFPCYKUQDWCMDA-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD NC(=O)CONC(=O)c1cc([N+](=O)[O-])c2nsnc2c1 778420244 UAURNULLTVFDKQ-UHFFFAOYSA-N 297.252 -0.254 5 20 CBBD COC(=O)CCCONC(=O)c1c[nH]nc1[N+](=O)[O-] 811561624 SQRWOSBLOFJJJE-UHFFFAOYSA-N 272.217 -0.068 5 20 CBBD O=[N+]([O-])c1ncn(Cc2ccnc(-c3nn[nH]n3)c2)n1 826500904 RCGOZKNJSCNFAR-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD CN(C(=O)c1ccon1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953817127 AEMYSXGHCBMALF-PSASIEDQSA-N 294.267 -0.377 5 20 CBBD NC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cc1F 1093500752 JTUZNSSVIYTOTE-UHFFFAOYSA-N 299.262 -0.070 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N1CCCC1 1116973087 YTUCBQCWZSOVAX-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H](O)c2cnn(C)c2)c1[N+](=O)[O-] 1318909094 KVBIXQLKGQYVRE-QMMMGPOBSA-N 294.271 -0.177 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCn3ncnc3C2)c1 1320345514 OVNOPTTYWKJFBE-JTQLQIEISA-N 293.287 -0.741 5 20 CBBD Cc1nn(C)c(C(=O)O[C@H](C)C(N)=O)c1[N+](=O)[O-] 1322008725 USYDXKQOGNIJLR-RXMQYKEDSA-N 256.218 -0.333 5 20 CBBD Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H](O)C(N)=O 1328360532 PHQHEUNZBDHCQE-QMMMGPOBSA-N 285.231 -0.382 5 20 CBBD C[C@@](O)(CNc1ccnc(O)c1[N+](=O)[O-])C(=O)O 1589148246 NZVPKFQRFKRGDI-SECBINFHSA-N 257.202 -0.057 5 20 CBBD CN1CC[C@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1604854061 JXPULLLDMFYCTN-ZCFIWIBFSA-N 292.259 -0.550 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)c1c([N+](=O)[O-])cnn1C 22238429 PFHROZRJFDWCQJ-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD NCCC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 40835080 RRBCSPLWWMIKIP-UHFFFAOYSA-N 279.300 -0.013 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)[C@H]1CN(C)CCO1 119053968 HVGQNISZXNUILD-VHSXEESVSA-N 297.315 -0.373 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1CO 161466616 QAGMKJQSCFSTJN-SECBINFHSA-N 283.288 -0.042 5 20 CBBD C[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1CO 190374917 IXPSBSOCJWHIOH-ZMLRMANQSA-N 284.316 -0.145 5 20 CBBD C[C@](O)(CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)O 262462125 XUHCZPPKCAVXQR-NSHDSACASA-N 283.240 -0.258 5 20 CBBD C[C@H](Nc1ncc([N+](=O)[O-])c(N)n1)C(=O)NCCF 283511507 MKJWGXXEXWBPJS-YFKPBYRVSA-N 272.240 -0.147 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCC(N)=O 286114901 BSJOPDIKNPCXFS-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD CCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 286328793 LKQBGOBVJJMFOG-VIFPVBQESA-N 296.283 -0.473 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H](O)C1CC1 337651269 LIDFRIOMRWSADQ-SNVBAGLBSA-N 281.268 -0.356 5 20 CBBD C[C@@H](C[S@](C)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 345568527 LXOYTYVLFXXVAW-VIIUKITBSA-N 274.302 -0.326 5 20 CBBD COc1nc(NC(=O)c2nn(C)cc2[N+](=O)[O-])n[nH]1 352687826 SYCCQCHJWUAHTK-UHFFFAOYSA-N 267.205 -0.293 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 354422519 DXZHMLFVETZWHW-BQBZGAKWSA-N 281.272 -0.038 5 20 CBBD O=C(O)C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 396708109 MDQBMGBWHHWERV-UHFFFAOYSA-N 280.240 -0.277 5 20 CBBD NC(=O)[C@@H]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 450923372 IIQXSLHYFCWZQD-RITPCOANSA-N 266.261 0.033 5 20 CBBD Cc1nc(CNC(=O)NCCn2cc([N+](=O)[O-])cn2)no1 489966356 WCMMXSQBWHSNIZ-UHFFFAOYSA-N 295.259 -0.018 5 20 CBBD O=C(O)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 535497961 QNUQBLJAAFXMBG-UHFFFAOYSA-N 275.242 -0.257 5 20 CBBD Nc1nccc(C(=O)NCCN2CCOCC2)c1[N+](=O)[O-] 548057346 DDPLQNQBHVAKBO-UHFFFAOYSA-N 295.299 -0.366 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@]1(C)CO 598447092 HBFDLBBVTYEXCO-KCJUWKMLSA-N 283.288 -0.337 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCNC1=O 693863007 YFSQALXDBVZTEN-ZETCQYMHSA-N 265.229 -0.810 5 20 CBBD C=CC(=O)NCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 732099566 JECOMBNCTSBNSF-UHFFFAOYSA-N 295.299 -0.055 5 20 CBBD NC(=O)c1sccc1NC(=O)Cn1cnc([N+](=O)[O-])n1 769703154 SQICGZTULMENDL-UHFFFAOYSA-N 296.268 -0.015 5 20 CBBD CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])c(F)cc1N 801818871 XYEYPVABWIYIJT-UHFFFAOYSA-N 270.220 -0.127 5 20 CBBD Nc1nc(N2CC[C@@](F)(C(=O)O)C2)ncc1[N+](=O)[O-] 833091256 LJLKNPROSVPOJS-VIFPVBQESA-N 271.208 -0.030 5 20 CBBD Cc1cnc(N[C@H]2C[C@H](NC(=O)C(N)=O)C2)c([N+](=O)[O-])c1 1059393861 OIGFOGWSTLJODE-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD CCC(=O)NC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1069917641 BRSKYRGTENLNBP-NXEZZACHSA-N 299.327 -0.157 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](CO)[C@@H](O)C1 1117121228 CATPCJSFKRMFOD-SVRRBLITSA-N 270.245 -0.867 5 20 CBBD NC(=O)CC(=O)NCCNCc1cccc([N+](=O)[O-])c1 1125080046 MNYUCXCBPYEMTR-UHFFFAOYSA-N 280.284 -0.324 5 20 CBBD CCNC(=O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1318979190 SZFZROUUQWFPRI-UHFFFAOYSA-N 268.229 -0.398 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCN2C(=O)CC[C@H]2C1 1338059855 LWTKLOVYTYHCDK-QMMMGPOBSA-N 280.288 -0.597 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1NC[C@@H]1COCO1 1607080832 QVJSHEFPMITFFI-SSDOTTSWSA-N 293.243 -0.045 5 20 CBBD CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 35408828 SAZNMFDGBSBNJA-ZETCQYMHSA-N 256.218 -0.229 5 20 CBBD N[C@@H]1C[C@@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 36263983 XLALOFDZCLCXBP-RQJHMYQMSA-N 257.271 -0.027 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C1CC1 71303141 JFASGRODNMLUDB-SECBINFHSA-N 254.246 -0.322 5 20 CBBD NC(=O)C1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 90512258 QGRHPHKBOBMXEC-UHFFFAOYSA-N 294.311 -0.046 5 20 CBBD O=C(O)COCCNC(=O)Cn1ccc([N+](=O)[O-])n1 93226610 ATYDNGPVHCLYJY-UHFFFAOYSA-N 272.217 -0.991 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 159054888 RJIPVMUKHWDSMT-LURJTMIESA-N 257.202 -0.248 5 20 CBBD C[C@@H](O)CN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 189358682 LLWFTHMDOWGDKD-LLVKDONJSA-N 283.332 -0.210 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H](C(=O)O)O1 262179026 QJCSDOZESBQEGK-SFYZADRCSA-N 298.255 -0.508 5 20 CBBD C[C@](O)(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)O 262315053 UGAAZIWALMYGBJ-NSHDSACASA-N 284.224 -0.134 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CN(C)CCO2)c1[N+](=O)[O-] 263716771 RGLHUMLQOOOOHO-QMMMGPOBSA-N 283.288 -0.313 5 20 CBBD CC(C)(CNC(=O)c1cc([N+](=O)[O-])[nH]n1)C(N)=O 285014669 GPAZOJJDRWLSQW-UHFFFAOYSA-N 255.234 -0.441 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H](O)C2CCC2)c1 315851270 FVTVKSQFKCWZQZ-VXGBXAGGSA-N 284.316 -0.097 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](O)[C@H](O)C1 331293923 LZCSATPJZCDXDI-TXEJJXNPSA-N 295.295 -0.121 5 20 CBBD COC(=O)c1cc(C)nc(N[C@H](CO)C(N)=O)c1[N+](=O)[O-] 343248231 IYUGKLAXWGCLBE-SSDOTTSWSA-N 298.255 -0.657 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCC(=O)N1 345554082 DUXYFOLPMJRAPN-MRVPVSSYSA-N 281.272 -0.424 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1cc([N+](=O)[O-])cnc1O 359835951 KALWSNOSLHGWDQ-UHFFFAOYSA-N 280.200 -0.551 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@](O)(C3CC3)C2)c1 365851939 XQDDKFZPPAVKDZ-OLZOCXBDSA-N 296.327 -0.001 5 20 CBBD COC(=O)Cn1cc(CCn2cc([N+](=O)[O-])cn2)nn1 448106346 AZXWGIZLJCFLIL-UHFFFAOYSA-N 280.244 -0.202 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCN(C2CCC2)CC1 609594574 RYEIYACOKYGTRA-UHFFFAOYSA-N 294.315 -0.117 5 20 CBBD NS(=O)(=O)c1c(N2CC[C@H](O)C2)cccc1[N+](=O)[O-] 610076304 YLAYRGRAYCBMRM-ZETCQYMHSA-N 287.297 -0.187 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@H](O)C(=O)NC)c1[N+](=O)[O-] 763721952 CLDQSAHRWPYGGN-ZETCQYMHSA-N 299.287 -0.893 5 20 CBBD C[C@H](COC(=O)C1CCN(S(N)(=O)=O)CC1)[N+](=O)[O-] 813109214 PSPUCSASQSPVEU-SSDOTTSWSA-N 295.317 -0.890 5 20 CBBD O=C(O)Cn1cc(CCn2cnc([N+](=O)[O-])c2)nn1 833273390 MCAGOKWTVBKRIL-UHFFFAOYSA-N 266.217 -0.290 5 20 CBBD Cc1c[nH]c(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 991291749 YNSCMPVOVUKQNP-RKDXNWHRSA-N 293.283 -0.676 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CCC[C@H](C1)N2CCO 1039583181 GDGCTUXKXVFMKN-WRWGMCAJSA-N 283.328 -0.291 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCC(F)(F)CO 1116639429 WFKUBEQWJZDJMM-UHFFFAOYSA-N 291.210 -0.500 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2C(=O)NCC[C@H]2C)c1[N+](=O)[O-] 1116910292 CIIRYSGSZRZEQJ-HTRCEHHLSA-N 295.299 -0.109 5 20 CBBD CNC(=O)CC(=O)NCCNCc1ccccc1[N+](=O)[O-] 1126161635 QLSJKSAKPIHREX-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD CN1CCC(O)(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1319611381 DGQBHQTXMWJPNS-UHFFFAOYSA-N 283.288 -0.496 5 20 CBBD O=C(CO[C@H]1CCOC1)NCCn1cc([N+](=O)[O-])cn1 1319840466 BDQMJNVNONMDLO-JTQLQIEISA-N 284.272 -0.287 5 20 CBBD CN(C)S(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 291719760 QBWWKYKFBYFHMZ-UHFFFAOYSA-N 291.285 -0.191 5 20 CBBD NS(=O)(=O)c1cc(NCCO)cc([N+](=O)[O-])c1 298784701 JQEVUHZKCQPIQN-UHFFFAOYSA-N 261.259 -0.354 5 20 CBBD CN(CC(C)(CO)CO)c1ncc([N+](=O)[O-])cn1 302244517 ZNAXNJRBTJKCPC-UHFFFAOYSA-N 256.262 -0.188 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@]1(CCO)CCOC1 331323298 DEQHKXCHJUSFHG-LLVKDONJSA-N 284.272 -0.551 5 20 CBBD Nc1nc(NC[C@@H](O)[C@@H]2CCOC2)ncc1[N+](=O)[O-] 346435949 WHKYLJARYQFQJL-HTRCEHHLSA-N 269.261 -0.224 5 20 CBBD NC(=O)c1ccc(N2C[C@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 347409860 HHWFMFFKWDFMOC-DTWKUNHWSA-N 281.268 -0.374 5 20 CBBD Nc1nc(N2CCCS(=O)(=O)CC2)ncc1[N+](=O)[O-] 348172442 JWCKTKALSVTRMO-UHFFFAOYSA-N 287.301 -0.408 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])n1C 362360280 LPJWHDNYKBVDOR-LURJTMIESA-N 254.246 -0.073 5 20 CBBD O=C(NCCn1cncn1)c1cnc(O)c([N+](=O)[O-])c1 445175936 UMNLHLSRUGHALX-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD CNC[C@H](O)CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 519660265 ZGZJZTNIXDMBAO-RYUDHWBXSA-N 299.327 -0.496 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2cn(C)nn2)c1=O 535578453 CNFQTYUAWDIWFP-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD O=C1NC[C@@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 572312292 QBSUITQDAWJSSH-SECBINFHSA-N 291.267 -0.863 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CNC[C@H]1O 700640406 GJELBKGJIYSVIC-GHMZBOCLSA-N 281.268 -0.578 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 737706511 OKPHTFIYKWBSCC-LURJTMIESA-N 270.197 -0.227 5 20 CBBD CON(C)C(=O)[C@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-] 858834465 AYOVTMRYDBBQDB-LURJTMIESA-N 297.271 -0.091 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](NCc2cccc([N+](=O)[O-])c2)C1 1022633550 KSKRGRJPHWYGHG-AOOOYVTPSA-N 292.295 -0.183 5 20 CBBD Cn1cc(CCN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1030292637 PYIMBJFMLNZYNK-VXGBXAGGSA-N 293.327 -0.572 5 20 CBBD O=C(NCCNc1ccnc(O)c1[N+](=O)[O-])c1cnn[nH]1 1094256745 HGQQCGIOPSTWGK-UHFFFAOYSA-N 293.243 -0.345 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC(OCCO)CC1 1117141923 ABSILPHQLKJVFB-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 1117951446 NGEQZSBWCZEGBM-YFKPBYRVSA-N 253.218 -0.735 5 20 CBBD C[C@@]1(CN)CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1118085521 HFFZRJWLZQLIKJ-JTQLQIEISA-N 268.277 -0.616 5 20 CBBD NC(=O)c1ccnc(N2CCN(CCO)CC2)c1[N+](=O)[O-] 1261208195 KAQUIOJRRXRREE-UHFFFAOYSA-N 295.299 -0.797 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCS(=O)CC1 1318609122 YYSGNAMUMVXVIM-UHFFFAOYSA-N 272.286 -0.618 5 20 CBBD CC(=O)NCC(=O)NCCn1cc([N+](=O)[O-])cn1 1319840912 QFCAJDVWYYKJBQ-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD CN(CCNS(C)(=O)=O)c1ncc([N+](=O)[O-])cn1 1325407598 UOVSLFLOASSFAN-UHFFFAOYSA-N 275.290 -0.630 5 20 CBBD Cn1cncc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1329870539 ZBHSIYFJNKJZPQ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Nc1ncccc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1592761856 CANQJIWQOZULPL-UHFFFAOYSA-N 287.243 -0.003 5 20 CBBD O=C(N[C@@]1(C(=O)O)CCSC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1608406566 XEAIPGGHICQMJG-KCRUCZTKSA-N 260.271 -0.272 5 20 CBBD CN(C)CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 44667099 ZSXNFJOBVCJBLL-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD CNC(=O)CCN(C)CCn1cc([N+](=O)[O-])ccc1=O 179208188 CDQVWNBFROZFOP-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD CS(=O)(=O)NCCn1cccc([N+](=O)[O-])c1=O 218168352 JSFKYBWBYCUCTG-UHFFFAOYSA-N 261.259 -0.694 5 20 CBBD N[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 237995912 RYYRDEZZLINUIA-QMMMGPOBSA-N 253.262 -0.355 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 279644128 ZHNFUMOJWKSUEK-JMCQJSRRSA-N 297.267 -0.035 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc([N+](=O)[O-])c(F)cc1N 284351313 KCGBQZCDBXQMNH-LURJTMIESA-N 287.247 -0.259 5 20 CBBD O=C1CNC(=O)N1CCCn1cccc([N+](=O)[O-])c1=O 338635449 DFXXAIHZWHWQKV-UHFFFAOYSA-N 280.240 -0.302 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@]1(CO)CCOC1 349552009 FNVDWRSHJYQYDS-GFCCVEGCSA-N 297.267 -0.976 5 20 CBBD C[C@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)S(N)(=O)=O 398254352 QACVYQRQYQOVPO-ZCFIWIBFSA-N 299.312 -0.018 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@]1(O)CCOC1 413650986 DXNVDAQGRONGAI-LBPRGKRZSA-N 292.251 0.561 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 447741551 NFXJRXRZJRAWRP-WRWORJQWSA-N 284.272 -0.402 5 20 CBBD CO[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H]1OC 487134393 HGJSNVXEYPXRBC-HTQZYQBOSA-N 269.261 -0.183 5 20 CBBD C[C@H]1CN(CCNC(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 522268565 HIAWLJZBPZIDSK-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD CO[C@@H]1CS(=O)(=O)C[C@@H]1N=c1cc[nH]cc1[N+](=O)[O-] 596434128 JCQOPZUXKCLMRF-WCBMZHEXSA-N 287.297 -0.364 5 20 CBBD O=[N+]([O-])c1ccc(N(CCO)CCOCCO)nc1 599087014 XTWKDPZFKMTZHD-UHFFFAOYSA-N 271.273 -0.203 5 20 CBBD O=[N+]([O-])c1ccc(NCCN2CC[C@@H](O)C2)nc1 599175649 GRYQBCGUTGSLJF-SNVBAGLBSA-N 252.274 0.468 5 20 CBBD Nc1cc(NC[C@@H](O)CO)cc(CO)c1[N+](=O)[O-] 615279931 JJDGBRNOLTWIHR-MRVPVSSYSA-N 257.246 -0.566 5 20 CBBD Cn1nnc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1 819271524 SVYYCJNOCOFAAQ-JTQLQIEISA-N 278.272 -0.059 5 20 CBBD O=C1N[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CCO1 860245713 KTQDGIIUGPZMCL-MRVPVSSYSA-N 283.244 -0.594 5 20 CBBD COC(=O)CCN1CCN(CC[N+](=O)[O-])[C@H](C)C1 930237755 WHLRJRZOQOOTLE-SNVBAGLBSA-N 259.306 -0.168 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cscn1 990470937 NEAICDZFLFICJE-VXNVDRBHSA-N 296.308 -0.251 5 20 CBBD Cc1ccnc(NCCCNC(=O)C(N)=O)c1[N+](=O)[O-] 1094741620 DDORYIJSFUVHDK-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD COCC[C@H](CO)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1321647881 CMHBTSBXCXCKKC-MRVPVSSYSA-N 286.288 -0.236 5 20 CBBD COCc1nn(CCn2cc([N+](=O)[O-])ccc2=O)c(=O)o1 1324958950 XAOUXCMHTNYMCJ-UHFFFAOYSA-N 296.239 -0.247 5 20 CBBD C[C@H]1OCC[C@]12CN(c1nnc(C[N+](=O)[O-])n1C)CCO2 1339667312 SUPKLNRYPAWFBC-SKDRFNHKSA-N 297.315 -0.024 5 20 CBBD CCN1C[C@@H](CNC(=O)Cn2cnc([N+](=O)[O-])n2)CC1=O 1346295284 PMQHBJMHQVONHP-MRVPVSSYSA-N 296.287 -0.829 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H](O)CC(=O)O)n1 1607709888 RGYUQYFOMKRBSP-QMMMGPOBSA-N 283.240 -0.136 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 107184401 VKBTYDZGRCBMNC-SECBINFHSA-N 269.261 -0.583 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 193569865 SUXYVRUSVAJWFD-DVVUODLYSA-N 297.315 -0.734 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCNC(=O)C1CC1 227885445 ZPGMZOAJGKHLNU-UHFFFAOYSA-N 293.283 -0.172 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2CCO[C@@H](C(=O)O)C2)n1 231664580 OBSXFKLYYSFUOI-SSDOTTSWSA-N 256.218 -0.382 5 20 CBBD CCc1ccc(C(=O)NC(C(N)=O)C(N)=O)cc1[N+](=O)[O-] 266972975 ZMJJUHQOWWUQLL-UHFFFAOYSA-N 294.267 -0.774 5 20 CBBD NC(=O)[C@H]1CCCC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 267298700 JNIWCJDNZRITMI-VHSXEESVSA-N 295.299 -0.048 5 20 CBBD C[C@H]1COCCN1CCNC(=O)c1c([N+](=O)[O-])cnn1C 330585925 XDZVLTIBVCDBEK-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD C[C@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC(=O)N1C 337437724 DJQCFXOGOUYDIT-QMMMGPOBSA-N 267.289 -0.009 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 352582930 NFJSMMXXJQZMED-SSDOTTSWSA-N 284.228 -0.668 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354345261 YVVYWKIZFPBFEU-JTQLQIEISA-N 271.277 -0.640 5 20 CBBD COC[C@@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 357712626 RJRDABLWYLBARI-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 360612467 JRJIVLOBWUWNRH-SSDOTTSWSA-N 285.256 -0.413 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)N1CCO 456238214 JENCSNGHYBZVES-DTORHVGOSA-N 297.315 -0.155 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 598516029 QXNIOUBVPBQMBV-IZLXSQMJSA-N 268.229 -0.001 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])c[nH]1 737612806 ZHIHQYYYOOIMII-UHFFFAOYSA-N 285.212 -0.377 5 20 CBBD CCNC(=O)COC(=O)Cn1cc([N+](=O)[O-])nc1C 744653043 UOSPZDVSFZENDZ-UHFFFAOYSA-N 270.245 -0.221 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@]3(CCNC3)C2)c1 923331661 MQHMXNHAXGKDQY-CHWSQXEVSA-N 295.343 -0.162 5 20 CBBD CC(C)C(=O)N(C)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953758060 FOEKTVUDKZGWGQ-NXEZZACHSA-N 269.301 -0.023 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(Cc2ccno2)c1=O 1116020285 MOTOIROTSYWCCH-UHFFFAOYSA-N 264.197 -0.108 5 20 CBBD COC[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@H](C)O1 1350598045 MBNUIOIUMOXFGK-IUCAKERBSA-N 285.304 -0.168 5 20 CBBD O=C(O)c1cnc(C(=O)OCCC[N+](=O)[O-])cn1 1595268703 MAAXYEGGOILRRU-UHFFFAOYSA-N 255.186 -0.002 5 20 CBBD CNC(=O)c1ccc(N2CC(O)(C(=O)O)C2)c([N+](=O)[O-])c1 1606289569 GPFJYBJDVWBETI-UHFFFAOYSA-N 295.251 -0.410 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@](O)(C(=O)O)C1 1609028840 RETRDZFILGUGLA-GFCCVEGCSA-N 296.235 -0.038 5 20 CBBD CNC(=O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 25199747 BAEJYUPVQYFKGU-UHFFFAOYSA-N 252.230 -0.347 5 20 CBBD CCCCNC(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 48603194 DGRAEEOPCXDBIR-UHFFFAOYSA-N 270.249 -0.188 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@H](C)O 275999284 OJVZZFNWVKSXSK-XNCJUZBTSA-N 299.239 -0.652 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C)O1 282621371 ZYIZDNHGPWQJIW-HTRCEHHLSA-N 298.255 -0.280 5 20 CBBD C[C@H]1C[C@@H](O)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 429117924 RFWFOFWRSKSFFB-DLOVCJGASA-N 284.316 -0.003 5 20 CBBD COC(=O)C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 549202425 MQXGKVLECHTLSU-ZETCQYMHSA-N 298.255 -0.278 5 20 CBBD C[C@H](Sc1ncc([N+](=O)[O-])c(N)n1)C(=O)NC(N)=O 564587445 XGZSIAZXTVBBJJ-VKHMYHEASA-N 286.273 -0.358 5 20 CBBD C=CC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])nc1C 732100686 XZPZCXYOJUPMAL-UHFFFAOYSA-N 295.299 -0.092 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])c(C)n1 757693924 WEHNMDQWUZMUAN-MRVPVSSYSA-N 254.246 -0.183 5 20 CBBD NC(=O)c1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)co1 760221897 YYUFQBVRHUQJEZ-UHFFFAOYSA-N 295.211 -0.265 5 20 CBBD NC(=O)c1ccnc(N2CCNC(=O)C2)c1[N+](=O)[O-] 1117684040 DIVICTQNQNKEQA-UHFFFAOYSA-N 265.229 -0.975 5 20 CBBD CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C1CC(N)C1 1118269562 KTAMIBJSFKROIX-UHFFFAOYSA-N 280.284 -0.295 5 20 CBBD NC(=O)c1cc(N2C[C@@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-] 1118597165 VCPVXHHPRFRXAV-CPCISQLKSA-N 281.268 -0.517 5 20 CBBD Cc1[nH]nc(C(=O)NCCN2CCN(C)CC2)c1[N+](=O)[O-] 1321573256 GCGJQOSUVGGGLZ-UHFFFAOYSA-N 296.331 -0.396 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N1CC=CCC1 1329709370 GSVXNBNIGLQWRK-UHFFFAOYSA-N 293.283 -0.304 5 20 CBBD Cn1cncc1CNC(=O)c1c([N+](=O)[O-])cnn1C 1330886082 DCTPLHDVEKESHT-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610733119 NAXQRHZPLVYDTE-XUTVFYLZSA-N 258.230 -0.912 5 20 CBBD CN1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 152466255 JGKIPDVBAIJWSK-SECBINFHSA-N 281.272 -0.472 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)C(=O)[C@H]1C 188489205 UIIGLMUKZHIQIM-MRVPVSSYSA-N 295.299 -0.211 5 20 CBBD O=C1CCC(=O)N1CCNc1ncc([N+](=O)[O-])cn1 273620291 OLVKGIPZPOCZQJ-UHFFFAOYSA-N 265.229 -0.054 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H](C)O 274520403 SDFACWXUOQKARI-WKEGUHRASA-N 297.267 -0.171 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 299467837 MFQIUWPEOHMSPB-SSDOTTSWSA-N 268.229 -0.751 5 20 CBBD CN(C[C@@H](O)CO)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 353957742 CISIWSCIYKSUGC-SECBINFHSA-N 286.288 -0.662 5 20 CBBD COCC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360738501 PKUBKEAQGPXUPC-NSHDSACASA-N 286.288 -0.154 5 20 CBBD COC(=O)[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 362664449 AUROMHUMVLOSPK-JTQLQIEISA-N 282.256 -0.141 5 20 CBBD O=C(NCc1nn[nH]n1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 732158158 VWBILOXEUCTSKY-UHFFFAOYSA-N 293.199 -0.054 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cn1 761979069 GDWVBAKHZNGSJB-UHFFFAOYSA-N 282.212 -0.398 5 20 CBBD O=C(CC1OCCO1)NCCn1cc([N+](=O)[O-])cn1 793686092 DIRFTZDSWGJZMM-UHFFFAOYSA-N 270.245 -0.330 5 20 CBBD CCO[C@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839726179 NVWOYOOQTUVLPR-RGOKHQFPSA-N 258.274 -0.038 5 20 CBBD CC(=O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840414771 FNXYOIGWLNJKTG-IVZWLZJFSA-N 256.258 -0.142 5 20 CBBD CCn1ncn(NC(=O)c2c[nH]nc2[N+](=O)[O-])c1=O 854628709 RIDYTUQQSNIEMI-UHFFFAOYSA-N 267.205 -0.920 5 20 CBBD COC[C@H]1CCCN1NC(=O)Cn1ccc([N+](=O)[O-])n1 862603744 UBWRTQFOZBQTMY-SECBINFHSA-N 283.288 -0.067 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC1 973780466 VPRFSMMBLWQDCQ-UTINFBMNSA-N 267.285 -0.175 5 20 CBBD O=C(NC[C@@H]1CCCS1(=O)=O)c1n[nH]cc1[N+](=O)[O-] 1117994375 LOYBGASPRMRKAZ-LURJTMIESA-N 288.285 -0.375 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)NCCF 1325190734 WTJDFTIKUSFFON-RXMQYKEDSA-N 273.224 -0.478 5 20 CBBD CCn1nc(C)c(CNC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1326665723 RZQZPOGFEAVXTG-UHFFFAOYSA-N 294.275 -0.577 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C(=O)O1 1329065849 KPXUWAOSFWQOLO-PHDIDXHHSA-N 268.229 -0.238 5 20 CBBD COC(=O)CCN(CC(=O)O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1593839319 SEHNNGNLMAMQJE-RNFRBKRXSA-N 274.229 -0.872 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(=O)O 1599845312 CTQHDLLFOBUOBJ-XRGYYRRGSA-N 284.224 -0.136 5 20 CBBD O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H](CO)C(=O)O 1608365054 GOCJOTXPNWAVBM-MRVPVSSYSA-N 286.215 -0.162 5 20 CBBD O=C(NCCN1CCNCC1)c1cc([N+](=O)[O-])c[nH]1 36278199 NZYNMVUFKFXWHL-UHFFFAOYSA-N 267.289 -0.442 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1ccc([N+](=O)[O-])cc1 45744685 KHCJUCUGQLYOSO-UHFFFAOYSA-N 273.270 -0.299 5 20 CBBD O=C1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 50129261 XPUBTQXEVLDCIH-UHFFFAOYSA-N 279.252 -0.052 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@]1(C(=O)O)CCOC1 262214091 SIONPZULYUTFRM-NSHDSACASA-N 298.255 -0.540 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 277836743 RRVUQZWLPCPYIM-ZCFIWIBFSA-N 282.256 -0.050 5 20 CBBD CCOC(=O)COCCNc1ncc([N+](=O)[O-])c(N)n1 294981717 MBNSSBREWFHFTR-UHFFFAOYSA-N 285.260 -0.041 5 20 CBBD N=C(O)N[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 330517128 IWJXTHBJGIPYGO-QMMMGPOBSA-N 268.277 -0.052 5 20 CBBD O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN2C(=O)NC[C@@H]2C1 408385447 LZULJJTWCWRCGC-MRVPVSSYSA-N 279.256 -0.228 5 20 CBBD O=C(NC[C@H]1COCCO1)c1cnc(O)c([N+](=O)[O-])c1 445172119 JOWDYPOQGUYKDK-QMMMGPOBSA-N 283.240 -0.159 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 558757542 IHLKGMIYYVVEPW-ZCFIWIBFSA-N 269.261 -0.228 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2)CCOC1 566463733 BVJABLVHWYXTOP-LBPRGKRZSA-N 279.252 -0.031 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCC2CC(O)C2)c1 578132343 YRSQYZLTOFVMBN-NHNAUAITSA-N 284.316 -0.097 5 20 CBBD CN(C)C[C@H](O)CNc1ncc([N+](=O)[O-])c(N)n1 728051198 REWQGZOSEMTBII-ZCFIWIBFSA-N 256.266 -0.699 5 20 CBBD CN1CC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1=O 734894638 KSURXLOCMWPDSI-SECBINFHSA-N 295.251 -0.470 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCCOCCO 740238805 SBGSGOVKMZYQLO-UHFFFAOYSA-N 273.245 -0.348 5 20 CBBD CC(C)N(CCOCCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 854387956 QWHPMOHBOJVSCQ-NXEZZACHSA-N 260.290 -0.103 5 20 CBBD Cc1ccnc(N(C)CCNC(=O)C(N)=O)c1[N+](=O)[O-] 1100294703 JRVPZFMCTWFIBI-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD CSC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1116667302 MKWXGPWVAIJYBG-SSDOTTSWSA-N 287.297 -0.421 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(=O)NCC1CC1 1254293983 FGTKJCVZGDVTMY-UHFFFAOYSA-N 281.272 -0.416 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)NCCF 1326065066 UXRYJHHABPLSKT-RXMQYKEDSA-N 273.224 -0.478 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1C[C@@H]2[C@@H](C1)C2(F)F 1329611838 CUUOVVXVMXKIDK-PHDIDXHHSA-N 273.199 -0.090 5 20 CBBD CNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1345369350 VSIMAYJRTHBHLX-UHFFFAOYSA-N 281.272 -0.084 5 20 CBBD O=C(O)CN1CCC[C@@H]1COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1606258829 YEVTVKFCAAPWIK-IWSPIJDZSA-N 272.257 -0.256 5 20 CBBD C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(N)=O 10057651 UXINUJJBQXJTDP-YFKPBYRVSA-N 252.230 -0.219 5 20 CBBD C[C@@H](NC(=O)CNC(=O)CN)c1cccc([N+](=O)[O-])c1 37766599 MRLPAEPQMPEZRP-MRVPVSSYSA-N 280.284 -0.153 5 20 CBBD Nc1ccc(C(=O)N[C@H]2CCC(=O)NC2=O)cc1[N+](=O)[O-] 90020938 ZSUQIAJIJJDVLV-QMMMGPOBSA-N 292.251 -0.288 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 110683440 MHLDTHSZZCEBIV-SECBINFHSA-N 281.272 -0.472 5 20 CBBD C[C@H](CO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 161550071 MIDSPXJWWJEUPY-SSDOTTSWSA-N 257.250 -0.529 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)Cn1cnnn1 193579612 NLWYCKJBSGWSQG-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD COCCN1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 264584179 UZEKMAHBWWVKOM-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD C[C@H](O)CN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 275124693 IQMHPWZGQDBZFJ-JTQLQIEISA-N 297.315 -0.684 5 20 CBBD NC(=O)[C@@H]1CCN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C1 300528651 HCKNLSQKIODNLS-ZCFIWIBFSA-N 280.240 0.000 5 20 CBBD COCCN(Cc1c([N+](=O)[O-])ncn1C)[C@H](C)C(N)=O 355925818 BYEOTKNKQZXHDI-MRVPVSSYSA-N 285.304 -0.350 5 20 CBBD Nc1nc(=NCCCN2C(=O)CCC2=O)[nH]cc1[N+](=O)[O-] 357851246 LYMDBCHEODUJMR-UHFFFAOYSA-N 294.271 -0.660 5 20 CBBD O=C(C[C@@H]1NC(=O)NC1=O)Nc1cc([N+](=O)[O-])ccc1O 358673750 BCCDDGJCBLWTBW-ZETCQYMHSA-N 294.223 -0.163 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359034495 WVPOCGMPAZEDTD-LURJTMIESA-N 267.245 -0.203 5 20 CBBD Cc1ccn(Cc2nnn(C)n2)c(=O)c1[N+](=O)[O-] 430170272 UMSQOMMDOFJBRU-UHFFFAOYSA-N 250.218 -0.363 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN3C(=O)NC[C@H]3C2)c1[N+](=O)[O-] 431601521 CUACKYSSXWEGQJ-ZETCQYMHSA-N 294.271 -0.524 5 20 CBBD Cn1cnc(CNC(=O)c2cnc(O)c([N+](=O)[O-])c2)n1 445136328 PEUDWNINMZQOQO-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CCN(CCN)C(=O)NCCn1cc([N+](=O)[O-])cn1 599922163 ZXYDKLWOMHPWBJ-UHFFFAOYSA-N 270.293 -0.219 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)[C@@H]1COCCO1 748111959 LRWPRPFFQJETFN-VIFPVBQESA-N 271.229 -0.250 5 20 CBBD NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])n[nH]2)CCCC1 796460711 BFHZGAYFPYGDMV-UHFFFAOYSA-N 267.245 -0.154 5 20 CBBD Cc1cnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1030293471 LELUUNGIJXGGDC-VXGBXAGGSA-N 291.311 -0.249 5 20 CBBD O=CN1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1117738141 YSDQXRKQLCQBES-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD COc1cccc(C(=O)NCC(=O)NCCO)c1[N+](=O)[O-] 1320807790 JOYWUECWSRQLQZ-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@]1(CCO)CCOC1 1320847844 HXMBDYUXXBLWPN-LLVKDONJSA-N 284.272 -0.400 5 20 CBBD CC(=O)NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 1329029337 BOFDHUJSQUNLFD-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD O=C(O)C1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1594945412 SQIQGQBDMJTPBO-UHFFFAOYSA-N 268.229 -0.276 5 20 CBBD Cn1cc(CN2CCC[C@@H](O)[C@H]2C(=O)O)c([N+](=O)[O-])n1 1600952128 UGCMIJBLGGNHNE-BDAKNGLRSA-N 284.272 -0.262 5 20 CBBD O=C(O)c1cnc(N2C[C@@H](O)C[C@@H](O)C2)c([N+](=O)[O-])c1 1610861222 FUIWXGWQRFZFCJ-OCAPTIKFSA-N 283.240 -0.380 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1nnn[nH]1 44927105 PVHRCYVSKRNYHG-UHFFFAOYSA-N 262.229 -0.033 5 20 CBBD C[C@H](CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 180588678 SRFZHZAGVHZANB-LURJTMIESA-N 254.246 -0.070 5 20 CBBD O=C(NCC1(N2CCOCC2)CC1)c1n[nH]cc1[N+](=O)[O-] 277717280 XWNAMTNBNMLLML-UHFFFAOYSA-N 295.299 -0.088 5 20 CBBD O=C(NC[C@]1(O)CCSC1)c1cc([N+](=O)[O-])[nH]n1 286258398 UZGCRSDZNKJKEW-SECBINFHSA-N 272.286 -0.084 5 20 CBBD COC(=O)c1cn(CCNc2ncc([N+](=O)[O-])cn2)nn1 286567259 VHVAJDXLIFNAPW-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD CC(C)[C@H](O)C(=O)NCCn1cc([N+](=O)[O-])cn1 292079990 HQHQQQOHLVDOCC-VIFPVBQESA-N 256.262 -0.076 5 20 CBBD CCS(=O)(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 337713853 IVAQQTNGFBFGOF-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD Cn1c(C(=O)NCCn2cc([N+](=O)[O-])cn2)cccc1=O 339808175 LUWNTVMEMKETHH-UHFFFAOYSA-N 291.267 -0.080 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H](CO)[C@H]1CCCO1 344844275 HVCUHRBXBLLZSX-GHMZBOCLSA-N 298.299 -0.163 5 20 CBBD CCOC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 351727190 JLMKJKQZMXGTJE-QMMMGPOBSA-N 284.272 -0.301 5 20 CBBD COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])cnc1N 351937474 OEJOPVKHUQJOOY-MRVPVSSYSA-N 284.272 -0.301 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356463497 SGIPJAZEQDDQRW-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD CCOC(=O)[C@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 358864914 VVESWVAUTBWJNF-SNVBAGLBSA-N 285.260 -0.307 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C2(CC2)C1 428191742 KVJVIIMOHIGVBH-QMMMGPOBSA-N 266.257 -0.075 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@H](CO)[C@@H]2CCCO2)c1 447901820 CWXKKFBJSDQPMO-MNOVXSKESA-N 270.289 -0.079 5 20 CBBD CNc1nccc(C(=O)NCC(=O)N(C)C)c1[N+](=O)[O-] 557425932 QSWZWMPXXRFBIH-UHFFFAOYSA-N 281.272 -0.151 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])OC 580211021 KPFURHDYCFESIP-SSDOTTSWSA-N 298.255 -0.510 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1C[C@@H](C(N)=O)C1 593491041 CGUUXEWRMJGACQ-OLQVQODUSA-N 279.256 -0.236 5 20 CBBD CCN1C[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 593825822 LSQJEPFVIWAPRL-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD COCc1n[nH]c(CNc2ncc([N+](=O)[O-])c(N)n2)n1 596435247 BXTSDFCOQVCIBD-UHFFFAOYSA-N 280.248 -0.156 5 20 CBBD CNc1nccc(C(=O)N2CCOCCN2)c1[N+](=O)[O-] 597705254 CTKPVOGGASJWPR-UHFFFAOYSA-N 281.272 0.009 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCCNC(N)=O)c1[N+](=O)[O-] 771490386 DWEUNDUQSUSUJD-UHFFFAOYSA-N 284.276 -0.161 5 20 CBBD Cn1c(C(=O)NCCn2cnnn2)ccc1[N+](=O)[O-] 816286231 DHODJXAUIFSMQO-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD O=C(O)NCCC(=O)OCCn1cnc([N+](=O)[O-])n1 832605157 KGVXKZFJWAILEC-UHFFFAOYSA-N 273.205 -0.613 5 20 CBBD Cc1noc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1031661979 PNYVGJAUHYXXNK-NXEZZACHSA-N 295.299 -0.409 5 20 CBBD COC[C@H](CO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1117691740 RHTBYYNGWKZHJV-LURJTMIESA-N 258.234 -0.637 5 20 CBBD COCCn1ccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 1318274950 MCNOZKDKJUUODL-UHFFFAOYSA-N 295.259 -0.332 5 20 CBBD Cc1nc2n(n1)C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])CC2 1321288160 POLBDRXRWOWCBG-SSDOTTSWSA-N 291.271 -0.037 5 20 CBBD NC(=O)C[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329411738 GWFFYYOINCUEIL-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD C[C@@H]1CNC[C@H]1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1579457205 OUSHHXXYOBRBLW-SFYZADRCSA-N 268.277 -0.842 5 20 CBBD O=C(O)CCNS(=O)(=O)c1ncccc1[N+](=O)[O-] 1595063592 GZWXDNHXBRVOKB-UHFFFAOYSA-N 275.242 -0.257 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 1601749049 ABUAMAFAGUKUKU-VHSXEESVSA-N 284.272 -0.299 5 20 CBBD C[C@H](O)[C@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1603694014 NAVLGOHTNLWCCH-CAHLUQPWSA-N 295.259 -0.677 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC(=O)NC2CC2)c1 41744499 QEENONXZWPAHDA-UHFFFAOYSA-N 295.251 -0.178 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)Cn1cc([N+](=O)[O-])cn1 54051797 RUEXWKKNGMTEEH-ZCFIWIBFSA-N 256.218 -0.277 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)c1n[nH]cc1[N+](=O)[O-] 136031929 MZPQQKVBKJDMKG-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc(F)cc1[N+](=O)[O-] 159418503 MEYYIXYFKMHZOY-ZETCQYMHSA-N 272.188 -0.091 5 20 CBBD C[C@@H](C[S@](C)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 182786316 KKTFPPCVGQUEPK-VIIUKITBSA-N 274.302 -0.326 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 281801519 JVBFIVCOPCYFHN-RXMQYKEDSA-N 281.228 -0.717 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](C)C1 330601655 IMDLMORWBXKAMG-RKDXNWHRSA-N 297.315 -0.155 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](C)O[C@H](CO)C2)c1[N+](=O)[O-] 347508359 AWHOIOOKXPLYIY-XPUUQOCRSA-N 284.272 -0.152 5 20 CBBD C[C@@H](O)CCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 358929596 JEKDPFDHZHXUSB-SECBINFHSA-N 283.284 -0.014 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C(C)(C)C(=O)O 362347294 UFNCEFIWOFZKPP-UHFFFAOYSA-N 271.233 -0.492 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 415385819 OMBSANAGNPOMIF-SECBINFHSA-N 294.315 -0.563 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2)CCOC1 566463732 BVJABLVHWYXTOP-GFCCVEGCSA-N 279.252 -0.031 5 20 CBBD CCN1CC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 594357088 SMDBIWZCNRWHMH-MRVPVSSYSA-N 293.283 -0.077 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 618935280 ACNURCZNRXMZIH-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCOC(=O)CNC(=O)O 738888714 OYAJRNPTPVMYPN-UHFFFAOYSA-N 272.217 -0.089 5 20 CBBD NC(=O)CONC(=O)c1cccc([N+](=O)[O-])c1O 772938269 FSTFQFCQXNZPCI-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CCN1C 928563817 SKEKOPRGDJKZQU-SECBINFHSA-N 267.289 -0.080 5 20 CBBD CSCC(=O)N1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1001797132 VYAKJHRHQFXQIP-RKDXNWHRSA-N 287.341 -0.411 5 20 CBBD CN1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 1118908627 FZINPMOYNJETIT-SECBINFHSA-N 295.299 -0.224 5 20 CBBD CC1(C)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@H]1O 1321006873 ZDFQBTIUVOLRFX-LLVKDONJSA-N 295.295 -0.014 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1=CCNCC1 1326845394 KHGHWXKUEVNMRH-UHFFFAOYSA-N 265.273 -0.022 5 20 CBBD C[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CN(C)CCO1 1341460152 LRGNAWMWZPVVMB-PSASIEDQSA-N 297.315 -0.223 5 20 CBBD O=[N+]([O-])c1cn(CC2OCCO2)nc1-c1nn[nH]n1 1593487504 YZAXOOYMDIIQQU-UHFFFAOYSA-N 267.205 -0.656 5 20 CBBD COC[C@](C)(CC(=O)O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1599148056 GDMIRQOREGWHEF-JTQLQIEISA-N 286.244 -0.073 5 20 CBBD O=C(OCc1ccncc1-c1nn[nH]n1)[C@@H]1C[C@H]1[N+](=O)[O-] 1609577549 JNVJQIZAMIQFQP-VXNVDRBHSA-N 290.239 -0.030 5 20 CBBD Cc1nc(N2C[C@H](O)C[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 1610557045 PIHQDKAFJOPEDN-HTQZYQBOSA-N 282.256 -0.035 5 20 CBBD CNC(=O)CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 49486149 CMHVMXVKXQZLMW-UHFFFAOYSA-N 285.231 -0.025 5 20 CBBD COC(=O)C[C@@H](O)Cn1cc([N+](=O)[O-])c(C)cc1=O 128642638 KXGTZHXCBBBKRD-MRVPVSSYSA-N 270.241 -0.011 5 20 CBBD NCC(=O)NCC(=O)N1CCc2c1cccc2[N+](=O)[O-] 187598886 YVWXCJTXGUAQPO-UHFFFAOYSA-N 278.268 -0.441 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 227867128 YHHGEKWIWBVMTG-VIFPVBQESA-N 267.241 -0.900 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 230681688 FPJJZMJAQVFQKG-ZCFIWIBFSA-N 281.272 -0.174 5 20 CBBD CN(C)S(=O)(=O)CCNc1c([N+](=O)[O-])ncn1C 231010665 YNEJHPCUCJPMOW-UHFFFAOYSA-N 277.306 -0.368 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCO1 273243258 QMZOTWUORHLPBS-SNVBAGLBSA-N 295.251 -0.373 5 20 CBBD Cc1ccc(NC(=O)NC(CO)(CO)CO)cc1[N+](=O)[O-] 294211316 MGWQULSOZPDREC-UHFFFAOYSA-N 299.283 -0.260 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CN2CCN1CC2 347371093 IBOVYCWGYJSDEL-SECBINFHSA-N 294.315 -0.942 5 20 CBBD Cn1ccc(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 354724250 UEAJIKAKFMCABF-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD CNC(=O)c1ccc(N[C@@H](CO)C(=O)NC)c([N+](=O)[O-])c1 358860237 KOYSNGQWUNEOSA-VIFPVBQESA-N 296.283 -0.527 5 20 CBBD COCc1nc(C(=O)NCCn2cc([N+](=O)[O-])cn2)no1 359189404 FRANWFRUKLBBLR-UHFFFAOYSA-N 296.243 -0.249 5 20 CBBD NC(=O)COCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1 433030018 IKOUSNUMGOIGTH-UHFFFAOYSA-N 285.231 -0.034 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 514672379 NEYRYBMJDKNFSL-ZCFIWIBFSA-N 255.234 -0.882 5 20 CBBD CNS(=O)(=O)[C@@H]1CCN(c2c([N+](=O)[O-])ncn2C)C1 532756639 PXIYGWWHAPBGNS-SSDOTTSWSA-N 289.317 -0.544 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2C[C@H](C(N)=O)C2)c1[N+](=O)[O-] 600316792 GNKKQBPGVXAIKV-IZLXSQMJSA-N 281.272 -0.126 5 20 CBBD CN1N=C(C(=O)OCCn2ccc([N+](=O)[O-])n2)CCC1=O 748108880 JPHWNTRYKUWVGT-UHFFFAOYSA-N 295.255 -0.057 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H](CCO)C2CC2)c1 763060451 UMCGJSLDDLGMCE-NWDGAFQWSA-N 284.316 -0.097 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)Nn2c(O)nnc2O)c1 820282630 PMZTTXQKVFHEKW-UHFFFAOYSA-N 295.211 -0.010 5 20 CBBD CN(CC(N)=O)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821594982 JCPGOJPTJFEJDQ-UHFFFAOYSA-N 278.232 -0.909 5 20 CBBD COC(=O)[C@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843065203 KEPWPBNNIROSSD-WDEREUQCSA-N 284.268 -0.248 5 20 CBBD Cc1noc(CS(=O)(=O)CC(=O)N(C)C)c1[N+](=O)[O-] 1327951687 LYHAKTQFXJEAAH-UHFFFAOYSA-N 291.285 -0.106 5 20 CBBD Cn1cc([C@H](O)CNC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 1340430218 MJNJRFVMQWMBKN-SNVBAGLBSA-N 294.271 -0.625 5 20 CBBD N[C@@H](CO)C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F 1574262893 RPGDJEYNUBDPTN-QMMMGPOBSA-N 275.211 -0.191 5 20 CBBD COC[C@@]1(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)CCNC1 1578977558 AFZJAVPNAVOBRN-SNVBAGLBSA-N 269.261 -0.118 5 20 CBBD O=C(NCC1(C(=O)O)CC1)c1c[nH]nc1[N+](=O)[O-] 1608426917 WTWVFSPGRDKZSC-UHFFFAOYSA-N 254.202 -0.088 5 20 CBBD O=C(O)C1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 71173078 XIOWSPYTNZLAFK-UHFFFAOYSA-N 254.202 -0.666 5 20 CBBD CNC(=O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 105855439 NRCZQCBDUIZPGU-JTQLQIEISA-N 253.258 -0.036 5 20 CBBD C[C@H](C[S@](C)=O)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228984997 XHOUQTVUWXGGTF-QFHRKFJASA-N 290.345 -0.491 5 20 CBBD CC(C)c1[nH]nc(C(=O)Nn2cn[nH]c2=O)c1[N+](=O)[O-] 272864496 MRSUHJQKQCZYQK-UHFFFAOYSA-N 281.232 -0.290 5 20 CBBD COCCN(CC(=O)N(C)C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285411351 DDLQILCDUMAUMM-UHFFFAOYSA-N 299.287 -0.505 5 20 CBBD O=C(O)c1ccnc(N2C[C@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 316934349 XBCXAQPOUHZQBR-SVRRBLITSA-N 283.240 -0.523 5 20 CBBD CCOC[C@H](O)CNc1ccc2ncc([N+](=O)[O-])n2n1 347856035 DKGATIGUXLAKLE-MRVPVSSYSA-N 281.272 0.447 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1CN2CCN1CC2 356733846 ULNPEZUEAFZXLZ-VIFPVBQESA-N 294.315 -0.942 5 20 CBBD COC1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1 357268026 XDLVCOHNXQNCIA-UHFFFAOYSA-N 252.230 -0.076 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 362405571 XQCIVVCEHNMKOM-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD COC[C@](C)(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 525777160 KILNLIHPHUUAMZ-LLVKDONJSA-N 286.288 -0.305 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@@H](CO)O1 566805367 HMMZANSHNZMHSO-YUMQZZPRSA-N 296.283 -0.206 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1(CO)CC1 588857362 XXHOGUKUMISPKF-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD COC(=O)[C@@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])cn1 831067234 NETCFBZRVMAQHI-MRVPVSSYSA-N 297.223 -0.264 5 20 CBBD NC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 1055999311 HFCZRDYUUDCHQY-UHFFFAOYSA-N 296.258 -0.132 5 20 CBBD CNC(=O)CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1 1093568083 QVARWWWHXBGBOH-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD Cc1cnc(N(C)CCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1100294557 BUJUSWIPDCMIAF-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCn3ncnc3C2)c1 1320345515 OVNOPTTYWKJFBE-SNVBAGLBSA-N 293.287 -0.741 5 20 CBBD CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCNC1=O 1324648729 GZFQSPMBTFKHLM-ZETCQYMHSA-N 279.256 -0.587 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(C[C@H]2COCCN2)n1 1325894990 CVRUOWBFOVAVIR-ZETCQYMHSA-N 294.271 -0.091 5 20 CBBD CCCNC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1337779963 QFMKBBBYYUXAEY-UHFFFAOYSA-N 283.288 -0.107 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@]2(C(=O)O)CCOC2)n1 1339863008 WZKCEALFHMJKMI-SNVBAGLBSA-N 284.228 -0.698 5 20 CBBD CON(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H](C)C(=O)O 1594038819 YRMMDMFWUFKGHF-BYPYZUCNSA-N 258.190 -0.205 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(C[C@H]2CNCCO2)c1 1602299922 WBOXCDPGSTYONG-MRVPVSSYSA-N 283.240 -0.557 5 20 CBBD COC(=O)c1ccc(OCC(=O)NC(N)=O)c([N+](=O)[O-])c1 22222953 YQIJBDGFYYTYLP-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC(C)(C)O 75746098 GCXZQCZBCAFYFG-SNVBAGLBSA-N 272.305 -0.145 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 217689851 QNADOMBZGQVINT-SECBINFHSA-N 286.215 -0.002 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1NCC(=O)NCCO 280822074 YFJSVJFAVIFBGW-UHFFFAOYSA-N 271.277 -0.360 5 20 CBBD C[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC(=O)N1C 282421408 QHTSWNQBDDPQFS-SECBINFHSA-N 295.299 -0.130 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 340484729 PSXDQHLUQQTEQO-VIFPVBQESA-N 295.299 -0.127 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1COC[C@H]1O 342456611 NTFISLIVDXPFPQ-RKDXNWHRSA-N 269.257 -0.235 5 20 CBBD CN(CC(N)=O)C(=O)c1cc(F)cc([N+](=O)[O-])c1N 342862422 XQABWNIJTZCTJW-UHFFFAOYSA-N 270.220 -0.127 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1nncn1C 355064202 ILKABDUTBFPVAW-LURJTMIESA-N 279.260 -0.020 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2CNC[C@H]2C1 359310414 SBBYTNHPRQIGPH-IUCAKERBSA-N 251.290 -0.021 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(=O)NCC(F)F 361386396 ZXHCORPCLZHYSN-UHFFFAOYSA-N 291.214 -0.561 5 20 CBBD CN1C(=O)CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 555555581 FYQQMEVZPULPCX-UHFFFAOYSA-N 295.255 -0.991 5 20 CBBD C[C@@H]1CN(CCNC(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 558749126 QPDBIPNVFSXXGU-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 592942059 YMSPZILFLVINJG-RNFRBKRXSA-N 298.255 -0.686 5 20 CBBD Nc1nccc(C(=O)NCCN2CC[C@@H](O)C2)c1[N+](=O)[O-] 600536030 VUJQKXASNJTUGU-MRVPVSSYSA-N 295.299 -0.632 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](O)C1 856394553 INARNDWFGVLATB-KBTIHESUSA-N 252.230 -0.175 5 20 CBBD CC(C)(O)C1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1320493426 BMXXZUBJIPMPHS-NSHDSACASA-N 284.316 -0.145 5 20 CBBD Cn1nccc1[C@@H](NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1601034705 QSMSEIRRDUHHIW-SNVBAGLBSA-N 294.271 -0.060 5 20 CBBD O=[N+]([O-])c1c(NC[C@H](O)CO)cccc1-c1nn[nH]n1 1607078224 PANVSRPZOXBTJK-LURJTMIESA-N 280.244 -0.460 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@]1(C(=O)O)CCOC1 1608376863 IFBDZSAGMPLNRS-NSHDSACASA-N 298.255 -0.601 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC(=O)NC1CC1 48603120 LSPJFWHADVVNNB-UHFFFAOYSA-N 254.206 -0.826 5 20 CBBD CN(C)C(=O)N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 71952790 FGVLYTMIUOQKRT-UHFFFAOYSA-N 295.303 -0.229 5 20 CBBD C[C@H]1C(=O)NCCCN1CCn1cc([N+](=O)[O-])ccc1=O 189334948 KBSJAPAZBNQIHO-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H](CO)O1 229996443 VVPHOYMYIZURAE-IUCAKERBSA-N 284.272 -0.601 5 20 CBBD COC(=O)[C@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1 268093247 UWXVHDHZKUQWMX-NSHDSACASA-N 298.255 -0.760 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 287174695 SJBWOYYHDBXJMI-QUBYGPBYSA-N 270.245 -0.412 5 20 CBBD CN1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 299731905 ZCCUBKTZPHQMMI-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD CO[C@@H]1CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C[C@H]1O 395300564 JZXPZWGOZVLWRL-RKDXNWHRSA-N 283.240 -0.116 5 20 CBBD NC(=O)c1cc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)on1 426913428 FSONCJAWDXGJSP-UHFFFAOYSA-N 279.212 -0.060 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cnn[nH]1 492890415 LVGGLGKNTJTYFA-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD N[C@H]1C[C@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 563431263 LRHMKMCLEJQBOI-UWVGGRQHSA-N 277.284 -0.262 5 20 CBBD COC[C@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNC1 564836477 CRBWQCRPDFVPBD-LBPRGKRZSA-N 297.315 -0.466 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@]12C[C@H]1CCN2 578879799 JLUHBLCEXVPXIQ-KCJUWKMLSA-N 265.273 -0.341 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2CNC(=O)C2)c1[N+](=O)[O-] 580580054 BNCBMHONQBYVPY-LURJTMIESA-N 279.256 -0.350 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(c2ccc(N)c([N+](=O)[O-])n2)C1 596289359 OSYSVCNFPWHZPT-JGVFFNPUSA-N 296.283 -0.068 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCOCCN1 597707649 QAIYUSCYPPFIKX-UHFFFAOYSA-N 254.246 -0.090 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)c1cc([N+](=O)[O-])n[nH]1 598177008 QQEHHRADAAPSPC-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n[nH]1 611504333 KAHPYRKMRPQIQS-UHFFFAOYSA-N 264.201 -0.003 5 20 CBBD COC(=O)[C@@](C)(O)CNc1c([N+](=O)[O-])c(C)nn1C 613332110 WZXMBZUJYFFFSR-JTQLQIEISA-N 272.261 -0.027 5 20 CBBD CN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 619025978 WCZWPFHRZWMOQA-UHFFFAOYSA-N 254.246 -0.249 5 20 CBBD CN1CC[C@@H]1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 712587279 RTRJIVZEZDXTSM-KOLCDFICSA-N 269.305 -0.554 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1C[C@@H](O)C1 720981813 OFBJBKHFZOAMEH-OTSSQURYSA-N 254.246 -0.322 5 20 CBBD COC[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C(N)=O 760059368 DUATWZUGKUMKCO-SECBINFHSA-N 285.231 -0.036 5 20 CBBD Cn1c(C(=O)OCC(=O)N2CCNC2=O)ccc1[N+](=O)[O-] 761062664 XIUBMOOZGBKQRI-UHFFFAOYSA-N 296.239 -0.358 5 20 CBBD CC(C)C1(O)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 765575404 IFDVMZXMLPHFJW-UHFFFAOYSA-N 295.295 -0.014 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)COc1ccccc1[N+](=O)[O-] 788182899 JMMBOYPEQMTGPK-SECBINFHSA-N 297.267 -0.803 5 20 CBBD O=C(NC[C@H]1C[C@@H](NCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1086084132 DXHSMKWTFNQGIO-UTINFBMNSA-N 257.290 -0.872 5 20 CBBD CN(CCNC(=O)CC(N)=O)c1ncc([N+](=O)[O-])cc1F 1099970973 SSHKPQIMEFRMEL-UHFFFAOYSA-N 299.262 -0.443 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1C=C[C@H](CO)C1 1319250290 YKQGWPJWEBDTIO-VHSXEESVSA-N 293.279 -0.190 5 20 CBBD COC(=O)C1(O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1319961313 AKAYMSGRFOKYSO-UHFFFAOYSA-N 298.255 -0.542 5 20 CBBD COC[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)OC 1321286115 CMDISDWVAHKCIJ-ZCFIWIBFSA-N 272.217 -0.764 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-c1noc(C[C@@H]2COCCN2)n1 1325894989 CVRUOWBFOVAVIR-SSDOTTSWSA-N 294.271 -0.091 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCCCNC1=O 1336738607 YPVFVRPMZXQEMQ-ZETCQYMHSA-N 281.272 -0.273 5 20 CBBD O=[N+]([O-])CCN1CCS(=O)(=O)[C@@H]2COCC[C@H]21 1341532587 GUMMYIBYDDQOBS-RKDXNWHRSA-N 264.303 -0.849 5 20 CBBD O=C(CC1(O)CNC1)NCCc1ccccc1[N+](=O)[O-] 1580515180 NAMCYRPKGPLBPS-UHFFFAOYSA-N 279.296 -0.022 5 20 CBBD C[C@@H](C(=O)O)[C@@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1603190562 VXFJRWMJVXOERB-DBRKOABJSA-N 294.285 -0.793 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H](O)C(=O)O 90262329 DMUXYIZYLYPYLT-VIFPVBQESA-N 268.225 -0.301 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCC(=O)N1CCOCC1 158088047 XXYHBAWTOLELHG-UHFFFAOYSA-N 283.288 -0.011 5 20 CBBD O=C(NCCO)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 159356526 PSRAWGPNAGIRSM-UHFFFAOYSA-N 277.240 -0.102 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)Cn1ccc([N+](=O)[O-])n1 193743849 ONBIEYXWAMCREC-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@](C)(O)CN(C)C)c1[N+](=O)[O-] 269908326 OLMLWOCVGQQHSB-LBPRGKRZSA-N 299.331 -0.077 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285817228 GPWVMDZOBSJADD-QMMMGPOBSA-N 282.304 -0.707 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC(N)C1 294872161 PIFLZKMOWCWUCF-UHFFFAOYSA-N 280.284 -0.295 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCO[C@H](CO)C1 330472512 AJWOGSAAKKARAB-JTQLQIEISA-N 298.299 -0.290 5 20 CBBD CN1CCC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 331104317 PXZKTZUEDLJZTM-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD COC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])c1 350357577 ABUUVZQITDBWRD-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(Cc2cnnn2C)c1=O 351683561 APDOUPODQBWBTA-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354726022 ULNPQLOCBZHEPQ-FSPLSTOPSA-N 284.228 -0.934 5 20 CBBD NCC[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 357366466 RXGBYPYSXXQNMX-VIFPVBQESA-N 282.304 -0.084 5 20 CBBD CNc1c(C(=O)NC[C@@H](O)C(=O)OC)cccc1[N+](=O)[O-] 360943796 JQVWMIWCYKXTFT-SECBINFHSA-N 297.267 -0.100 5 20 CBBD CNc1nccc(C(=O)NCCN(C)C)c1[N+](=O)[O-] 553190229 HQZLSGAGVYPILN-UHFFFAOYSA-N 267.289 0.323 5 20 CBBD O=C(O)CC1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 577067583 FGIPNQKHAAQMLN-UHFFFAOYSA-N 295.251 -0.120 5 20 CBBD NC(=O)CN[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 577646779 WMNDIHPNPOCCKO-VIFPVBQESA-N 292.251 -0.698 5 20 CBBD O=C(NC[C@@H]1C[C@H](F)CN1)c1n[nH]cc1[N+](=O)[O-] 592338208 RDUGLBVGNLSPLX-WDSKDSINSA-N 257.225 -0.252 5 20 CBBD Nc1nccc(C(=O)NC[C@@H]2CCCNC2=O)c1[N+](=O)[O-] 594285709 ANTFDVGLZCIIMO-ZETCQYMHSA-N 293.283 -0.172 5 20 CBBD N[C@@H]1C[C@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 594694784 SZNCBGQSPKCJBP-NKWVEPMBSA-N 283.313 -0.201 5 20 CBBD COC[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)OC 774740182 DWNFIACAGLIAJK-SSDOTTSWSA-N 287.228 -0.478 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022064137 XQENZXDMOZAJEC-BKFJMODKSA-N 281.272 -0.528 5 20 CBBD NC(=O)C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 1133206523 USLKHJZEQSAQLK-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD CN1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 1321456621 DKYJZILXXJIIDX-ZCFIWIBFSA-N 253.218 -0.722 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](n2cncn2)C1 1338403558 RJKPQPUQFUNIET-SSDOTTSWSA-N 277.244 -0.003 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)C1(CO)COC1 1344479353 RYBQJHYSRHJGPM-UHFFFAOYSA-N 271.229 -0.657 5 20 CBBD O=C(NCC1(C(=O)O)CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1594743807 XPQKRNHYCQOXOF-HTQZYQBOSA-N 272.257 -0.351 5 20 CBBD Nc1ccc(N2C[C@H](O)C[C@@H](C(=O)O)C2)nc1[N+](=O)[O-] 1601216194 YNBKXFLGZVKONV-RNFRBKRXSA-N 282.256 -0.156 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H](C(=O)O)C1CC1 1608377407 WGNHSSKOXGDDIJ-NSHDSACASA-N 295.251 -0.264 5 20 CBBD CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 28003569 FQPJVVQBHAKDPP-UHFFFAOYSA-N 282.256 -0.461 5 20 CBBD COCCNCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 152473015 ITAADTJKRQZBMB-UHFFFAOYSA-N 299.331 -0.121 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H](C(N)=O)C1 188597638 CGCCVEJYYIBQCW-PSASIEDQSA-N 295.299 -0.096 5 20 CBBD O=[N+]([O-])c1nc(Br)n(C[C@H]2CNCCO2)n1 231803175 KVACPXUVHKNATR-RXMQYKEDSA-N 292.093 -0.063 5 20 CBBD COC[C@@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)OC 234700027 CVKGAJNIZCEQDG-WDEREUQCSA-N 288.304 -0.597 5 20 CBBD COC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 234756283 IMSAAWCTXOLFNL-LURJTMIESA-N 271.229 -0.568 5 20 CBBD O=[N+]([O-])c1c(N2C[C@H](O)[C@H](O)C2)nc2sccn12 236556653 SFSGHMVVVYAVBY-OLQVQODUSA-N 270.270 -0.154 5 20 CBBD NC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])cc1F 268598470 DHENMSXBNMMIKY-UHFFFAOYSA-N 285.231 -0.034 5 20 CBBD Cc1ccc(NC(=O)[C@H](CO)NC(N)=O)cc1[N+](=O)[O-] 270756062 KMPYUSMKMXEOJP-QMMMGPOBSA-N 282.256 -0.129 5 20 CBBD Cn1nnnc1CNC(=O)COc1ccc([N+](=O)[O-])cc1 275189035 FFBNYALWDSBMIQ-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD COCCCN(CCO)c1ncc([N+](=O)[O-])c(N)n1 275411817 GCZNRKHOJFEOIW-UHFFFAOYSA-N 271.277 -0.198 5 20 CBBD O=C(NC[C@@H](CO)[C@H]1CCOC1)c1cc([N+](=O)[O-])[nH]n1 285878803 IKWKZSPNDDBYJV-YUMQZZPRSA-N 284.272 -0.307 5 20 CBBD CNC(=O)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 341805865 CLRYMFXXEVMOKC-UHFFFAOYSA-N 254.250 -0.461 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2cnnn2C)c1 351673235 JCTUBERTEVCYER-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1cc([N+](=O)[O-])c[nH]1 354507984 JAKLZGDQBSSKNE-UHFFFAOYSA-N 281.228 -0.796 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] 568727435 YOKFLYGTHYKKNA-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCNC1 577192380 GNHNPLOYTVFMGZ-JTQLQIEISA-N 292.295 -0.311 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1C[C@H](O)CN1 577222476 MEWPHXHFKZHFPC-OIBJUYFYSA-N 291.267 0.132 5 20 CBBD O=C(NCCn1cnnn1)c1ccc([N+](=O)[O-])o1 807921622 PSBMOPWNUABISG-UHFFFAOYSA-N 252.190 -0.396 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C(=O)O1 808200156 CLGDHGGKQLQLKR-XPUUQOCRSA-N 268.229 -0.389 5 20 CBBD CC(C)(COC(=O)CCNS(C)(=O)=O)[N+](=O)[O-] 851125875 IMGRCDSIHPRULB-UHFFFAOYSA-N 268.291 -0.476 5 20 CBBD CCCN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cn1 1101227381 JPARUPGDDXIFLE-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD C[C@]1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CCS(=O)(=O)C1 1320983138 XTFYXHGYKKMCCF-VIFPVBQESA-N 288.285 -0.375 5 20 CBBD CN1C[C@@H](NC(=O)c2c([N+](=O)[O-])cnn2C)CC1=O 1341457060 UAQHDCZDRIOXFV-LURJTMIESA-N 267.245 -0.711 5 20 CBBD CC[C@H](COC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 1595183615 RWJOSHQRBJEIQJ-ZCFIWIBFSA-N 272.217 -0.160 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCC(=O)C(=O)O)n1 1605501211 IBYZJORJTWVTCR-UHFFFAOYSA-N 257.158 -0.861 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1607417807 WYFMZPWWLVOUIL-ZETCQYMHSA-N 283.240 -0.264 5 20 CBBD O=C(O)c1cn(C2CN(Cn3cc([N+](=O)[O-])cn3)C2)nn1 1608963046 RQEJAHFSVKBEQL-UHFFFAOYSA-N 293.243 -0.405 5 20 CBBD O=C(O)Cc1noc(Cn2cc([N+](=O)[O-])cn2)n1 1611519309 HSSRNPZZLKOSIW-UHFFFAOYSA-N 253.174 -0.150 5 20 CBBD COCCS(=O)(=O)CCn1cc([N+](=O)[O-])cn1 158304302 RWTIVPSALWJBTI-UHFFFAOYSA-N 263.275 -0.148 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 217714684 XEQXQSHYZXWLCZ-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1n[nH]cc1[N+](=O)[O-] 272768036 RROCXMKWTSAKGI-UHFFFAOYSA-N 272.261 -0.619 5 20 CBBD CC(=O)NC1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 276176469 KGHRUJCVJMZPOX-UHFFFAOYSA-N 294.267 -0.897 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)N1CCOCC1 343389563 VGLOBVRCQNBWAZ-SSDOTTSWSA-N 297.271 -0.705 5 20 CBBD Nc1nc(N2C[C@H]3CCS(=O)(=O)[C@H]3C2)ncc1[N+](=O)[O-] 343507905 OIMSUYWIFQLIAN-SVRRBLITSA-N 299.312 -0.410 5 20 CBBD COC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)OC 351793057 MNZRFUYTXSLWJU-SSDOTTSWSA-N 286.244 -0.905 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1nccc(C(N)=O)c1[N+](=O)[O-] 357459161 NNWFCQJXXVGDGY-ZETCQYMHSA-N 293.283 -0.244 5 20 CBBD CC[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)C(=O)NC 412411611 QTOXHQHQOOUEEA-QMMMGPOBSA-N 282.256 -0.050 5 20 CBBD N[C@@H]1C[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN2C1=O 571702583 NMXGHLKRVDNQGH-GXSJLCMTSA-N 294.315 -0.965 5 20 CBBD CCCNC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 572915699 ZTLFMDQFSVGIEJ-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD NC(=O)c1ccc(N2CC[C@@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 582519192 INZYYXOYEMIDTM-CABZTGNLSA-N 295.295 -0.127 5 20 CBBD O=C(NCCn1cnnn1)c1ccc([N+](=O)[O-])cc1O 807921593 ORNUTEJACJZNIB-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD O=C(NC1CN(C(=O)c2cccnc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280419 QRJCALOOBDWSCH-GHMZBOCLSA-N 290.279 -0.313 5 20 CBBD CN1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 1118908628 FZINPMOYNJETIT-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD CCn1nncc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767788 UORJZAIHRMRBSY-GHMZBOCLSA-N 296.331 -0.441 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(=O)NCC(F)F 1325063240 GTNPPDRAXAQGBG-UHFFFAOYSA-N 291.214 -0.561 5 20 CBBD Cn1cc(CN2C[C@H](O)C[C@H]2C(=O)O)c([N+](=O)[O-])n1 1600953126 MLQFHZWBAKIXBT-SFYZADRCSA-N 270.245 -0.652 5 20 CBBD Cn1cc(CN[C@@](C)(CO)C(=O)O)c([N+](=O)[O-])n1 1608115354 SAHNBPZZBCFLPX-VIFPVBQESA-N 258.234 -0.747 5 20 CBBD C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 49098043 XFIBXYMKNIVVIT-WCBMZHEXSA-N 285.304 -0.782 5 20 CBBD NC(=O)[C@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1 76267119 IVCODPVRMZSGIU-RXMQYKEDSA-N 252.234 -0.579 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H](O)CO)cc1 95082616 DOASXPUDFCLNMD-QWRGUYRKSA-N 256.258 -0.429 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C(=O)O 111252188 KCZQLFIXSWJPFH-IONNQARKSA-N 282.256 -0.030 5 20 CBBD COCCCS(=O)(=O)NCCn1nccc1[N+](=O)[O-] 127980788 BVJGJSLYXKCXBH-UHFFFAOYSA-N 292.317 -0.253 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(C(=O)O)CCOCC1 131735246 UVUIZHUIMDOICD-UHFFFAOYSA-N 298.255 -0.459 5 20 CBBD CC(=O)NCCCNC(=O)NCCn1cc([N+](=O)[O-])cn1 132962621 ZROOIIHANOVJPZ-UHFFFAOYSA-N 298.303 -0.383 5 20 CBBD CCS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285290854 KHCBBYTYNONHBI-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 354781049 ZWKAXXOPXOADMC-JTQLQIEISA-N 286.244 -0.638 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@@H](O)[C@@H]1CCOC1 359017448 JOQYCTAAZPSJEZ-LDYMZIIASA-N 296.283 -0.069 5 20 CBBD NC[C@H]1CCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 429184484 BQCIJSPHEHAHPP-SFYZADRCSA-N 268.277 -0.570 5 20 CBBD O=[N+]([O-])c1ccc(-c2noc(NC[C@@H](O)CO)n2)cc1 436444718 ANLIXGHUJFDJPF-SECBINFHSA-N 280.240 0.410 5 20 CBBD Nc1nccc(C(=O)N2CC[C@](F)(CO)C2)c1[N+](=O)[O-] 594356871 DZYNXIWNEHONOQ-LLVKDONJSA-N 284.247 0.119 5 20 CBBD CN1C(=O)CC[C@H]1CC(=O)NCCn1cc([N+](=O)[O-])cn1 597410894 SEXYTVVFMUJNPL-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCc1nnnn1C 733425607 NXWLQXHROIRGSF-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)C1CC1 771041569 IWSUULZRQBOCHC-QMMMGPOBSA-N 254.246 -0.322 5 20 CBBD Cc1cc(C(=O)NC[C@@H](O)C(N)=O)c(N)c([N+](=O)[O-])c1 788206451 AHUGCGYDCSNPSL-MRVPVSSYSA-N 282.256 -0.939 5 20 CBBD C[C@@H](C(=O)N1CCCC1)N1CCN(CC[N+](=O)[O-])CC1 791053057 SEXLTAOVYYTFPE-LBPRGKRZSA-N 284.360 -0.108 5 20 CBBD COC(=O)[C@H](CO)NC(=O)CCC(C)(C)[N+](=O)[O-] 846651973 BORFEGMNSQZBJG-ZETCQYMHSA-N 262.262 -0.528 5 20 CBBD COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 857330643 LAMFZQMDXKCTCC-JLIMGVALSA-N 286.284 -0.169 5 20 CBBD O=C(N[C@H](CO)CN1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 879993669 ZRRZVLCGOQGORV-IVZWLZJFSA-N 257.290 -0.776 5 20 CBBD CN(CCNC(=O)CNC(N)=O)c1ccccc1[N+](=O)[O-] 1099910552 HUAYPNKTSHYUTP-UHFFFAOYSA-N 295.299 -0.185 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1)C1CC1 1261208650 ARXJOIMZMAVBQP-QMMMGPOBSA-N 283.288 -0.655 5 20 CBBD COC(=O)NC1CN(c2c([N+](=O)[O-])ncn2C)C1 1320427187 VNUMVFUVACXPNZ-UHFFFAOYSA-N 255.234 -0.127 5 20 CBBD CN(C)c1nc(NC(=O)c2c([N+](=O)[O-])cnn2C)n[nH]1 1323194458 VDIQPXRLJROHTF-UHFFFAOYSA-N 280.248 -0.235 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)[C@H](CO)C1 1333428879 LKLUVSAVKRZOSP-LBPRGKRZSA-N 296.327 -0.635 5 20 CBBD CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 35203578 QEWSUKXBQDNUKB-ZCFIWIBFSA-N 255.230 -0.216 5 20 CBBD CN(C)S(=O)(=O)CCNc1ncc([N+](=O)[O-])cn1 231010000 ZFRHSKKOPBMLFN-UHFFFAOYSA-N 275.290 -0.312 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@H]1C 262704938 BJMCSOPRDMHVDQ-UWVGGRQHSA-N 294.311 -0.035 5 20 CBBD NS(=O)(=O)c1cc(N2CC(O)C2)cc([N+](=O)[O-])c1 265431056 FTVCFJRDZKNVRH-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD CNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 274413391 WEUBMZZVLRPITO-UHFFFAOYSA-N 252.230 -0.259 5 20 CBBD Cc1nn(C)c(N)c1C(=O)NCCn1cc([N+](=O)[O-])cn1 339959513 MYFCCIXLCSHYBR-UHFFFAOYSA-N 293.287 -0.155 5 20 CBBD Cc1cnc(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)nc1 340081480 TZJDRGWRZHQUEJ-UHFFFAOYSA-N 275.272 0.142 5 20 CBBD COCC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 343927347 OAKDJKIHJBQEIL-VIFPVBQESA-N 286.288 -0.387 5 20 CBBD CN(C)C(=O)COC1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 343939623 GVGIDDFCXFPTHE-UHFFFAOYSA-N 297.271 -0.753 5 20 CBBD Nc1nc(N2CCC[C@H]3C(=O)NC[C@@H]32)ncc1[N+](=O)[O-] 358687480 TWTVHGDPXLLZBT-RQJHMYQMSA-N 278.272 -0.318 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC1(O)CCC1 360734937 GBYCNAZCFYZREA-UHFFFAOYSA-N 254.246 -0.027 5 20 CBBD CC(C)[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1C 490298650 KTSKFNLLSKROKU-SNVBAGLBSA-N 296.331 -0.015 5 20 CBBD CNc1nccc(C(=O)N[C@H](CCO)COC)c1[N+](=O)[O-] 563379776 XVSPAPQHRQIFRK-MRVPVSSYSA-N 298.299 0.159 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1COC[C@H]1O 563434623 MBVVHBKOMOEBII-RNFRBKRXSA-N 289.269 -0.972 5 20 CBBD COC[C@@]1(CNC(=O)c2c([N+](=O)[O-])cnn2C)CCCN1 564449622 GTRMFOREQQPKHH-LBPRGKRZSA-N 297.315 -0.173 5 20 CBBD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC[C@H](O)CO)cc21 588002340 SLFLFPMCIPMEJG-ZETCQYMHSA-N 296.283 -0.450 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCCN1 599922035 XPUWMVJJHRJKJP-SECBINFHSA-N 298.303 -0.921 5 20 CBBD O=C(CNC(=O)c1cc(F)ccc1[N+](=O)[O-])NCCO 746225139 BBINNGVOLNALRB-UHFFFAOYSA-N 285.231 -0.428 5 20 CBBD Cn1c(C(=O)NS(=O)(=O)c2cc[nH]n2)ccc1[N+](=O)[O-] 796872206 FYMSRBXVUORRHY-UHFFFAOYSA-N 299.268 -0.225 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC(CO)CO 801935953 HHOITCFKQLVDCX-UHFFFAOYSA-N 273.220 -0.601 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840427600 GWISJGMSRKCERT-FNCVBFRFSA-N 272.257 -0.824 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C(F)F 990022073 IJTZOPOFSHHAND-PHDIDXHHSA-N 263.200 -0.756 5 20 CBBD Cn1cnc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1 990822703 GFSYRQYKDHJJQW-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCn2ncnc2C1 1116634434 OWKCEUCSPWOTCB-UHFFFAOYSA-N 289.255 -0.181 5 20 CBBD C[C@H](CN)NC(=O)C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 1117985658 SSDCYJHGJSXNRU-MRVPVSSYSA-N 292.295 -0.100 5 20 CBBD COC(=O)c1ncn(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 1322998158 GDHATALXASCQFN-QMMMGPOBSA-N 296.243 -0.770 5 20 CBBD CN(C)C1CN(c2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 1591012627 ZZYYXJWYGJPZTD-UHFFFAOYSA-N 290.287 -0.080 5 20 CBBD Nc1nc(N2CCOC[C@H]2CC(=O)O)ncc1[N+](=O)[O-] 1601220540 YVHDFRJOOFTEGF-ZCFIWIBFSA-N 283.244 -0.353 5 20 CBBD CN(CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 61996166 XDXLECAZJBEGQN-GFCCVEGCSA-N 283.332 -0.164 5 20 CBBD O=C(NCCCOCCO)c1cc([N+](=O)[O-])cnc1O 227551662 PWCOURXNFQZIRF-UHFFFAOYSA-N 285.256 -0.176 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H](CO)O1 230419609 LBQPBDDDQGQHNG-VXNVDRBHSA-N 296.283 -0.206 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@H](O)C1CC1 304788101 QBJUAQXSWKBRAO-RYUDHWBXSA-N 284.316 -0.145 5 20 CBBD CN(C)c1nccc(CN=c2nc(N)c([N+](=O)[O-])c[nH]2)n1 342780306 FRKNFHZEOCTEBG-UHFFFAOYSA-N 290.287 -0.143 5 20 CBBD CCC[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(N)=O 343466647 YTQBIKZJAPQXDU-RXMQYKEDSA-N 255.234 -0.298 5 20 CBBD O=C(NC1(CO)CCOCC1)c1cc([N+](=O)[O-])n[nH]1 354740027 XBFDCQOMHMTFBR-UHFFFAOYSA-N 270.245 -0.411 5 20 CBBD CNC(=O)[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CCO1 408172420 WAPOQNKSCIABNE-MRVPVSSYSA-N 283.288 -0.412 5 20 CBBD O=C(Nc1nn[nH]n1)c1cnc(O)c([N+](=O)[O-])c1 444844204 CDAVCEQRZIAYGE-UHFFFAOYSA-N 251.162 -0.539 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2C[C@@H](O)C2)c1 576159933 MDDMCLFZYYKAAL-SFGNSQDASA-N 256.262 -0.735 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@H](CN)C1 581883046 FGDRRHVKTCMTML-SNVBAGLBSA-N 296.331 -0.717 5 20 CBBD CCS(=O)(=O)C1CN(CCn2cc([N+](=O)[O-])cn2)C1 595517960 DXDVQHDIUYVGQO-UHFFFAOYSA-N 288.329 -0.090 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nccc(N)n1 597719015 DXAMTZOVZUHUQM-SSDOTTSWSA-N 291.271 0.041 5 20 CBBD O=C(O)C[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 833220364 PXBFIVYCRZHNAA-SECBINFHSA-N 270.245 -0.076 5 20 CBBD CC(=O)NCC(=O)NCCN(C)c1ccc([N+](=O)[O-])cn1 1099900436 DHAOBXVSPBBNPA-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2C(=O)NC[C@@H]2C1 1326786182 BUMMSCWTFSBNFS-ZCFIWIBFSA-N 280.244 -0.833 5 20 CBBD C[C@H](COC(=O)c1cnc(C(=O)O)cn1)[N+](=O)[O-] 1592771997 LBGHVSXMEQQPAO-RXMQYKEDSA-N 255.186 -0.003 5 20 CBBD Nc1ccn([C@@H]2CCN(CC(=O)O)C2=O)c(=O)c1[N+](=O)[O-] 1594666286 HQENYFMHQWPYQB-SSDOTTSWSA-N 296.239 -0.803 5 20 CBBD Cn1c(C(=O)NCCOCCO)ccc1[N+](=O)[O-] 55470851 BNXYJTBVSCXACQ-UHFFFAOYSA-N 257.246 -0.328 5 20 CBBD CC(=O)NCCNC(=O)CCn1cc([N+](=O)[O-])nc1C 132280848 QTMIUYOFFLZIPA-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD C[C@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262926620 FRADTJGWUIVVIG-MRVPVSSYSA-N 297.267 -0.064 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](C)C(=O)N(C)C 330457853 OWLSRJNFGBULAS-SSDOTTSWSA-N 283.288 -0.307 5 20 CBBD Cc1cc(=O)n(CC(=O)N2CCN(C)CC2)cc1[N+](=O)[O-] 330541687 YFSWWYVQHXTLPX-UHFFFAOYSA-N 294.311 -0.161 5 20 CBBD COCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1O)C(N)=O 436690984 SMXXFVMXCASWMN-QMMMGPOBSA-N 297.267 -0.079 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCCC(=O)N1 447743403 HAOYRPXYYOBOSW-MRVPVSSYSA-N 281.272 -0.424 5 20 CBBD Cc1nn(C)c(N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 589102035 ULOHUNSMKYBAQY-QMMMGPOBSA-N 257.294 -0.029 5 20 CBBD CNC(=O)CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 734490329 FQOMDHRLKZLHAT-UHFFFAOYSA-N 287.297 -0.072 5 20 CBBD O=[N+]([O-])c1c(N2C[C@@H](CO)[C@@H](O)C2)ccnc1F 882443314 ZPSPUNMIOPQACI-XPUUQOCRSA-N 257.221 -0.082 5 20 CBBD CSCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1123166762 RVNXTJJCAJXBIE-UHFFFAOYSA-N 287.345 -0.103 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NCC(=O)N1CCOCC1 1320781100 BKSMKWLZVZDALB-UHFFFAOYSA-N 280.284 -0.009 5 20 CBBD Cc1cnc(NC(=O)Cn2cnc([N+](=O)[O-])n2)[nH]1 1327623961 YXXSAMFXSSOMOH-UHFFFAOYSA-N 251.206 -0.143 5 20 CBBD COC[C@]1(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)CCNC1 1578977557 AFZJAVPNAVOBRN-JTQLQIEISA-N 269.261 -0.118 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCN[C@H]2C[C@@H]21 1579877706 ZQMSGKUFFAYNJE-IUCAKERBSA-N 265.273 -0.328 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@H]2C(=O)O)n1 1605501416 PDGSMXUIBXZJAL-ZETCQYMHSA-N 284.228 -0.746 5 20 CBBD CN(CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)CC(=O)O 1610118889 LDUQMVZBJNEAEN-UHFFFAOYSA-N 296.283 -0.077 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC(=O)NC1CC1 74061643 RPYBJIQHMHLYNC-UHFFFAOYSA-N 253.218 -0.221 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCOCCS(C)(=O)=O 78361804 DVWWJJQEJOCWKP-UHFFFAOYSA-N 292.317 -0.199 5 20 CBBD COC(=O)[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 103134563 PJPGGYZUTHLLTO-SECBINFHSA-N 270.245 -0.377 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)NC(CO)CO 158508272 KFRFSGNSDSVBKY-UHFFFAOYSA-N 254.242 -0.393 5 20 CBBD CC(C)(CC(N)=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 184634110 PZWPVKUBCCJVAW-UHFFFAOYSA-N 283.288 -0.048 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 194332352 QPEFAIVBWKYYSM-GZMMTYOYSA-N 295.299 -0.178 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H](O)CO 275772487 WASLQQPUGSZMBI-VIFPVBQESA-N 297.267 -0.689 5 20 CBBD NC(=O)N1CCC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 301412725 ACUYDAOZUPKMNL-LURJTMIESA-N 281.276 -0.078 5 20 CBBD CN(C)C[C@@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CCO1 330650995 JYUSCFYZWGVLFX-SECBINFHSA-N 297.315 -0.269 5 20 CBBD NCCNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 347498043 NOQPOFDOTGPTQH-UHFFFAOYSA-N 280.284 -0.210 5 20 CBBD NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1c1ncc([N+](=O)[O-])c(N)n1 365003094 XPDARSHMNRIBRX-ZKWXMUAHSA-N 292.299 0.057 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 425093480 SHPQVUDOPFFKIH-RXMQYKEDSA-N 281.228 -0.805 5 20 CBBD O=C1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CN1 436892851 LKJPPQGJQJGYCW-LURJTMIESA-N 265.225 -0.081 5 20 CBBD CCc1[nH]nc(C(=O)N2CCC[C@@H]2C(N)=O)c1[N+](=O)[O-] 444096947 MCQYVTZXTIIUAY-SSDOTTSWSA-N 281.272 -0.030 5 20 CBBD Nc1nccc(C(=O)NCCNC(=O)C2CC2)c1[N+](=O)[O-] 539449237 QWTQPNZKLCYUQV-UHFFFAOYSA-N 293.283 -0.172 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 545988158 KHROUQXRYMUPRE-CBAPKCEASA-N 298.299 -0.304 5 20 CBBD COC(=O)[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])OC 580211022 KPFURHDYCFESIP-ZETCQYMHSA-N 298.255 -0.510 5 20 CBBD COC(=O)c1cc(C)nc(NCCNC(N)=O)c1[N+](=O)[O-] 587979814 VGYHCBKFFUKXFC-UHFFFAOYSA-N 297.271 0.165 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 588866126 BGGWSYIFWDMQKO-ZETCQYMHSA-N 256.262 -0.425 5 20 CBBD Nc1nccc(C(=O)NC[C@H]2CCCC(=O)N2)c1[N+](=O)[O-] 594348424 RRLCEVQHHCMWHR-SSDOTTSWSA-N 293.283 -0.030 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1[C@H]2CC[C@H]1CNC2 595992048 NJHRJYLYJZQYDY-BQBZGAKWSA-N 251.246 -0.106 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCNC(=O)C1 726779749 UGHBAIFDNRJEOA-UHFFFAOYSA-N 281.272 -0.552 5 20 CBBD CC[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 726998486 VRJKTDFFUAHWHF-ZCFIWIBFSA-N 256.218 -0.402 5 20 CBBD Nc1ccc(NC(=O)N2C[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] 823926989 KACPMDUJTCDSKT-RDDDGLTNSA-N 296.283 -0.006 5 20 CBBD CN1CC[C@@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 847789773 HDMFQHKMCPMWBG-QMMMGPOBSA-N 282.256 -0.187 5 20 CBBD CC(=O)NCC1CN(Cc2c([N+](=O)[O-])ncn2C)C1 1031502875 MHJVPUSGYCCBFK-UHFFFAOYSA-N 267.289 -0.104 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC1)CN(CCCO)C2 1035707625 PKASFVMSLMKGBC-VXGBXAGGSA-N 297.355 -0.042 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@@H]([C@H](C)N)C2)c1[N+](=O)[O-] 1118139946 DBUAKYRRZQNGHY-IONNQARKSA-N 297.315 -0.175 5 20 CBBD Cn1nncc1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1340090714 RGDYSXKCBXLTOY-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD COc1cc(CNC[C@H]2CNC[C@H]2O)c([N+](=O)[O-])cc1O 1579153303 YIWHWJVULJSPQK-JOYOIKCWSA-N 297.311 -0.021 5 20 CBBD Cn1cc(CN2CC[C@](O)(C(=O)O)C2)c([N+](=O)[O-])n1 1608113557 VEJOIGXCVJIVPG-SNVBAGLBSA-N 270.245 -0.650 5 20 CBBD NC(=O)CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 70285481 GZPDGPJFZIXSSP-UHFFFAOYSA-N 289.251 -0.004 5 20 CBBD CN(CC(=O)N(C)C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75619329 CBHQIGJJZIUTHK-JTQLQIEISA-N 285.304 -0.828 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](CN)C1 165592624 FDMWFXRDBCJXLE-SECBINFHSA-N 268.273 -0.267 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCNC1 178485145 DIGRMWRHPOZVGE-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD CO[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 189181963 RJSSCRRWPVUAPM-QMMMGPOBSA-N 269.257 -0.092 5 20 CBBD COc1cc(C(=O)NC[C@@H](O)C(N)=O)ccc1[N+](=O)[O-] 228511827 UZFIUQTWPYKMIF-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD COc1cc(NC[C@H](O)C(N)=O)c([N+](=O)[O-])cc1OC 228597420 LVMVYRBGLKWWMH-QMMMGPOBSA-N 285.256 -0.130 5 20 CBBD CNc1c(C(=O)N2C[C@H](O)[C@@H](O)C2)cccc1[N+](=O)[O-] 234552736 HWZXPUGROODYCX-UWVGGRQHSA-N 281.268 -0.186 5 20 CBBD O=C(CO)N1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1 330527761 PWDZZZBSXCJUCY-UHFFFAOYSA-N 295.295 -0.063 5 20 CBBD COC1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 332439621 JOZUJZRWNIQNGE-UHFFFAOYSA-N 267.241 -0.386 5 20 CBBD COC(=O)CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 338639876 IFLNGHAENUQDGN-UHFFFAOYSA-N 270.245 -0.184 5 20 CBBD NCCN(CCO)CC(=O)Nc1ccccc1[N+](=O)[O-] 342423326 PBDQSOWUOAWYHW-UHFFFAOYSA-N 282.300 -0.214 5 20 CBBD C[S@](=O)CCCN=c1nc(N)c([N+](=O)[O-])c[nH]1 346641988 XBGNHHBCIQVOOC-QGZVFWFLSA-N 259.291 -0.431 5 20 CBBD CCN1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1=O 348811713 CKKCXQBJJSTDFB-UHFFFAOYSA-N 267.289 -0.008 5 20 CBBD CNC(=O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 354348805 QEJYFWLZLZWSJT-UHFFFAOYSA-N 252.230 -0.347 5 20 CBBD NC(=O)c1ccnc(NCCn2ncnn2)c1[N+](=O)[O-] 357527590 GCWATRRJSBKSCY-UHFFFAOYSA-N 278.232 -0.813 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 358058900 RKVYVEZAYLSMKO-NSHDSACASA-N 268.273 -0.281 5 20 CBBD Cn1cnnc1NC(=O)c1ccc([N+](=O)[O-])n1C 429467508 KHBHWSGGQQDENL-UHFFFAOYSA-N 250.218 0.314 5 20 CBBD Cn1c(C(=O)N2CCN3C(=O)NC[C@H]3C2)ccc1[N+](=O)[O-] 430761338 LNYCIVPNSHBKDY-QMMMGPOBSA-N 293.283 -0.217 5 20 CBBD O=C1C[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CN1 440474977 DEYZIALPRGNOEV-MRVPVSSYSA-N 292.251 -0.462 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1ccc([N+](=O)[O-])cn1 516136866 JLLHHLYJGWSQIO-LLVKDONJSA-N 281.224 -0.037 5 20 CBBD CCNC(=O)CCC(=O)NCCn1cc([N+](=O)[O-])cn1 610892202 CSJKGEIVQOBYDH-UHFFFAOYSA-N 283.288 -0.176 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619836844 YKQUZWKVZOLFGA-LURJTMIESA-N 267.245 -0.379 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(N)=O 760075071 FJZJZUWMYOUMOQ-LURJTMIESA-N 256.218 -0.847 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H](C)c1nnnn1C 787670121 FTLJFQSKLXRWKQ-LURJTMIESA-N 295.259 -0.072 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NOCCN1CCCC1=O 856042019 PGEAQASWZOUKDC-UHFFFAOYSA-N 297.271 -0.388 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CC[C@H](C1)N2CCO 1029305426 YJTYBILUDCNNME-LMLFDSFASA-N 269.301 -0.681 5 20 CBBD Cc1nn(C)c(C(=O)NC(C)(CO)CO)c1[N+](=O)[O-] 1320692056 WWRIFLQMDZIPIB-UHFFFAOYSA-N 272.261 -0.890 5 20 CBBD C[C@@H]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C(=O)O1 1326800274 QBOGKYSGDLRLND-XINAWCOVSA-N 254.202 -0.248 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1c[nH]nc1[N+](=O)[O-] 1328676707 DPCQUACCSIOBND-SECBINFHSA-N 256.218 -0.801 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CO1 1349444896 YCHBWEUTLOVERP-RNFRBKRXSA-N 255.234 -0.520 5 20 CBBD C[C@H](O)[C@H](O)CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1589997630 TUVQSHXUVHUBES-QUBYGPBYSA-N 294.271 -0.072 5 20 CBBD O=C(O)[C@]1(NCCn2ccc([N+](=O)[O-])n2)CCOC1 1594881723 CMRAEAKOSDZCTA-JTQLQIEISA-N 270.245 -0.375 5 20 CBBD CNC(=O)[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 78619888 QTKKVRUOPXSIOO-ZETCQYMHSA-N 280.288 -0.071 5 20 CBBD NC(=O)C[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 174726820 VELUYRCSFVWGLY-SECBINFHSA-N 295.299 -0.095 5 20 CBBD NC(=O)c1ccc(N2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 236174035 JVKZYNHBSVGGAO-UWVGGRQHSA-N 267.241 -0.765 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C 264510541 NOUVIERISYJVOQ-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD NC(=O)NC(=O)CCNc1ccc([N+](=O)[O-])cn1 301610195 CALMZDBKMIZTPS-UHFFFAOYSA-N 253.218 -0.013 5 20 CBBD C[S@@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 355857654 UZGZXMMTCXAXSN-GOSISDBHSA-N 272.286 -0.041 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCC2(CO)CC2)c1 395895409 HSIVRASRWKITQE-LLVKDONJSA-N 284.316 -0.096 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cccc(OC)c1[N+](=O)[O-] 443910699 VHKPVARNYQTEAI-QMMMGPOBSA-N 298.251 -0.133 5 20 CBBD CNc1nc(C(=O)N[C@@]2(CO)CCOC2)ccc1[N+](=O)[O-] 456014100 VZCGYBLMKVCARX-GFCCVEGCSA-N 296.283 -0.087 5 20 CBBD CNc1nccc(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 580580055 BNCBMHONQBYVPY-ZCFIWIBFSA-N 279.256 -0.350 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](C)CO)c1[N+](=O)[O-] 590441227 CMZFDORIXZXFGR-SSDOTTSWSA-N 268.273 0.390 5 20 CBBD N[C@@H]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])o3)CCN2C1=O 594873898 QOMRCZFUNIBJMN-JGVFFNPUSA-N 294.267 -0.428 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NN1CCCNC1=O 779446672 PVYGWSRZCAADPZ-UHFFFAOYSA-N 282.260 -0.454 5 20 CBBD COC(=O)CCC(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 783038460 ALCRQICZWPKKQD-UHFFFAOYSA-N 299.239 -0.143 5 20 CBBD CC(C)C(=O)NCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839714173 CPCPETLTIWTZEM-RKDXNWHRSA-N 257.290 -0.070 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(n2cnnc2O)CC1 848019145 HOPZSCYNEFVLRP-RKDXNWHRSA-N 281.272 -0.188 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cocn1 1001189009 LDOVRFHVYTVDDY-PSASIEDQSA-N 294.267 -0.472 5 20 CBBD CCCC(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042975537 NSPJFMYHSJIKED-RKDXNWHRSA-N 285.300 -0.859 5 20 CBBD O=C(NCCNCCOC1CCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936399 FXTBWOAPGYEVFO-GHMZBOCLSA-N 271.317 -0.074 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CC[C@@H](C(N)=O)C1 1263465422 PSSYLFFTWUTQHT-MRVPVSSYSA-N 282.304 -0.664 5 20 CBBD CC1(C)CNCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 1325855821 KVKUFXLIDOLLPT-QMMMGPOBSA-N 282.304 -0.309 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)CC(N)=O 1328148958 FKKLYBARIYASJD-ZCFIWIBFSA-N 269.261 -0.520 5 20 CBBD CCCNCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1329513669 IRWFTUHVOHKIBF-UHFFFAOYSA-N 282.300 -0.128 5 20 CBBD C[C@@H](CCCCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1349417968 LARFHLZEZSQOAM-QMMMGPOBSA-N 270.293 -0.180 5 20 CBBD COC(=O)CN(CC(=O)OC)C(=O)c1cc([N+](=O)[O-])c[nH]1 61875619 GDICXWNAWZKVNC-UHFFFAOYSA-N 299.239 -0.289 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC(C)(CO)CO 126045146 FXGOVKNHTDCOAS-UHFFFAOYSA-N 257.246 -0.594 5 20 CBBD Cn1c(C(=O)N2CCO[C@H](CN)C2)ccc1[N+](=O)[O-] 165595854 JRNHUILCBARUEV-MRVPVSSYSA-N 268.273 -0.267 5 20 CBBD O=C1NC[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN12 175934495 AATYJRQLTFQVLT-SECBINFHSA-N 280.288 -0.499 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 189608558 NPZIZLIFECWEGZ-GHMZBOCLSA-N 298.299 -0.210 5 20 CBBD COC[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)OC 272766123 GKRFHMUGEORPMO-SNVBAGLBSA-N 286.288 -0.041 5 20 CBBD Cc1nn(CC(=O)NCC(=O)N2CCCC2)cc1[N+](=O)[O-] 272971193 VOOLZVPLNUYLCM-UHFFFAOYSA-N 295.299 -0.162 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H](C)O 274802236 SOVQBBPNVOTBNL-LHLIQPBNSA-N 298.251 -0.047 5 20 CBBD COC(=O)CCCONC(=O)c1cc([N+](=O)[O-])[nH]n1 290428868 ATBSDDQRIOYTFE-UHFFFAOYSA-N 272.217 -0.068 5 20 CBBD COC(=O)C[C@@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 340879469 PWVXPAGXXHAFQQ-SSDOTTSWSA-N 297.271 -0.265 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@@H](O)CO 355627051 GRYVKYXGYPIMQD-SECBINFHSA-N 286.288 -0.699 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])nn1C 356462429 QXOOKCWSKNLAOQ-JTQLQIEISA-N 295.299 -0.075 5 20 CBBD NC(=O)[C@H]1[C@@H]2CCC[C@H]2CN1c1ncc([N+](=O)[O-])c(N)n1 365003092 XPDARSHMNRIBRX-LKEWCRSYSA-N 292.299 0.057 5 20 CBBD N[C@@H]1CCC[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 446400407 JXPVBOZMARJSMW-HTQZYQBOSA-N 268.277 -0.428 5 20 CBBD CCO[C@H]1C[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 515033901 AYHFWXBPTYZFRE-BQBZGAKWSA-N 255.234 -0.520 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)N1CCOCC1 574705978 BAGWORXFSOODLJ-SSDOTTSWSA-N 297.271 -0.705 5 20 CBBD COC(=O)C[C@H](O)CNc1c([N+](=O)[O-])c(C)nn1C 599162320 JKDCQUVFRSPAKD-ZETCQYMHSA-N 272.261 -0.027 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@H]1C[C@@H](O)C1 599670376 FGCPQDXXUYDYHF-WCQGTBRESA-N 284.316 -0.145 5 20 CBBD CN1CCC[C@@H]1C(=O)N1CCN(CC[N+](=O)[O-])CC1 929847612 XXJQFZNLHBMORU-LLVKDONJSA-N 270.333 -0.499 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(CCN(CCCO)CC2)C1 1050516982 LRRZMTAMDMKQQS-VXGBXAGGSA-N 297.355 -0.042 5 20 CBBD CN(CCNc1ccnc(O)c1[N+](=O)[O-])C(=O)CC(N)=O 1101537080 MSVLZPPVINIASK-UHFFFAOYSA-N 297.271 -0.559 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(Cc2ccon2)c1=O 1116066244 ZFHIOUWMJGZELK-UHFFFAOYSA-N 264.197 -0.108 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@](C)(O)CN(C)C)c1[N+](=O)[O-] 1116367165 SJULYJPRFRYHKH-GFCCVEGCSA-N 299.331 -0.321 5 20 CBBD O=[N+]([O-])c1ncn(Cc2nnnn2CC(F)(F)F)n1 1116766937 ZLBILEWMBIRIGJ-UHFFFAOYSA-N 278.154 -0.217 5 20 CBBD CC(C)N(CC(N)=O)C(=O)c1c([N+](=O)[O-])cnn1C 1320418414 QTRSKSGRCIJYQP-UHFFFAOYSA-N 269.261 -0.336 5 20 CBBD Cc1nn(C)c(C(=O)N2CCC(O)(CN)CC2)c1[N+](=O)[O-] 1579889152 FCMQVPCLZSMEMC-UHFFFAOYSA-N 297.315 -0.437 5 20 CBBD C[C@](O)(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C(F)F 1589993416 VMSNUSIJNHVIHG-QMMMGPOBSA-N 289.202 -0.013 5 20 CBBD C[C@@H](C(=O)O[C@H](C)C[N+](=O)[O-])n1cnc(-c2nn[nH]n2)n1 1603571651 IPKMARXQBNPCHD-RITPCOANSA-N 296.247 -0.772 5 20 CBBD Cn1c(C(=O)OCC(=O)NCCC(=O)O)ccc1[N+](=O)[O-] 1608086352 NSBYVPOVYLXYIS-UHFFFAOYSA-N 299.239 -0.319 5 20 CBBD CN1CCN(c2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC1 1609285720 QRHKTYDAHODHQB-UHFFFAOYSA-N 290.287 -0.078 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N(C)CC(N)=O)n1 1610438695 QGVHEIWUBOTPEI-UHFFFAOYSA-N 268.229 -0.082 5 20 CBBD O=C(O)C[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])o1 70215738 WHKXAECIJOLWJX-LURJTMIESA-N 297.223 -0.397 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC(n2cc(C(=O)O)nn2)C1 92697709 OTFMJVQYBQDDKL-UHFFFAOYSA-N 293.243 -0.321 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 131454642 ZVOOBKMAZYOCOE-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@H](C)NC)c([N+](=O)[O-])n1 261858128 YARIESWTKXGZLH-ZETCQYMHSA-N 291.333 -0.303 5 20 CBBD Nc1nc(NCCCOCCO)ncc1[N+](=O)[O-] 272437604 QGZZULXZRZMLOX-UHFFFAOYSA-N 257.250 -0.222 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCNC1=O 340484687 PEVMUEWAFVULLV-VIFPVBQESA-N 295.299 -0.163 5 20 CBBD Nc1nc(N2CCN3C(=O)CC[C@H]3C2)ncc1[N+](=O)[O-] 345191767 RNAAYOYHTIAICP-ZETCQYMHSA-N 278.272 -0.222 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@]1(CO)CCOC1 354324889 CIOJBHBFNFFASY-LLVKDONJSA-N 282.256 -0.547 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCOC[C@@H]1c1ncon1 354417819 XFGTXMFWCXAWKY-SSDOTTSWSA-N 294.227 -0.085 5 20 CBBD CC(C)(C(=O)N1CC(O)C1)n1cc([N+](=O)[O-])cn1 408022819 OFJVYACZGUYBRX-UHFFFAOYSA-N 254.246 -0.271 5 20 CBBD CNC(=O)CNC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] 433668457 YGWKRPPIQPDCDV-UHFFFAOYSA-N 269.261 -0.083 5 20 CBBD CCNCCCNC(=O)Cn1ccc([N+](=O)[O-])n1 577395668 KZRYRJQMDWDJOH-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1(O)CNC1 595926409 FBKAFNBSMRPLTQ-UHFFFAOYSA-N 265.269 -0.113 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 597654560 UJLDWSBYAUBWHB-VIFPVBQESA-N 283.284 -0.047 5 20 CBBD O=[N+]([O-])c1ccn(-c2nccnc2-c2nn[nH]n2)n1 738370195 RKOLPFFALSREFF-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD COC[C@H](NC(=O)N=c1cc[nH]cc1[N+](=O)[O-])C(N)=O 791848767 JRGXJGZKCVAEQQ-ZETCQYMHSA-N 283.244 -0.967 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)Cn1nnc2ccccc2c1=O 814044789 UNDASCPZZNJLDZ-QMMMGPOBSA-N 292.251 0.000 5 20 CBBD CNC[C@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843081720 UQTALSYGTDQZQI-NWDGAFQWSA-N 269.301 -0.202 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](C(N)=O)C1 1115994841 HQUDXAFFWRNCFY-QMMMGPOBSA-N 281.272 -0.566 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)c1c[nH]nc1[N+](=O)[O-] 1116853007 XJBCKCHRCHSKPO-UHFFFAOYSA-N 276.274 -0.566 5 20 CBBD CCCNC(=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319889729 MVUFJOWMCFAEDI-UHFFFAOYSA-N 283.288 -0.026 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1326086807 FYGXZEATTGMKTO-VXNVDRBHSA-N 283.288 -0.484 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1601770880 ZXYIKEVCHCWFNA-NTSWFWBYSA-N 284.228 -0.775 5 20 CBBD O=C(O)[C@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 1601851484 XBOWPYOZZZKSRN-SECBINFHSA-N 282.256 -0.188 5 20 CBBD C[C@@H](O)[C@@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1603694017 NAVLGOHTNLWCCH-VDTYLAMSSA-N 295.259 -0.677 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 230706262 LGTFKYMSGILVAZ-IONNQARKSA-N 296.283 -0.206 5 20 CBBD CN(C)C1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 342142829 UUNCDVILINXYGK-UHFFFAOYSA-N 253.262 -0.286 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@H]1COC[C@H]1O 342367514 DMPQADWOSSBYCL-VHSXEESVSA-N 298.299 -0.256 5 20 CBBD NC(=O)c1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cn1 343825843 JONPTNNEDDSHPA-UHFFFAOYSA-N 290.239 -0.258 5 20 CBBD CCNC(=O)CNC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] 344925995 YFZBNHBQKZRNLO-UHFFFAOYSA-N 269.261 -0.254 5 20 CBBD CC(C)C[C@@H](CO)NC(=O)Cn1cnc([N+](=O)[O-])n1 348004039 LCILCWDLLZZWKF-QMMMGPOBSA-N 271.277 -0.291 5 20 CBBD Cn1cnnc1NC(=O)CCn1cc([N+](=O)[O-])cn1 361344050 OXETXZAJEUGITH-UHFFFAOYSA-N 265.233 -0.051 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CNCCO1 423719699 GEKVZVNEEOHYMP-SNVBAGLBSA-N 291.267 0.398 5 20 CBBD CS(=O)(=O)c1cc(C(=O)NCCN)cc([N+](=O)[O-])c1 428764650 NBXNSVNZRNXTBC-UHFFFAOYSA-N 287.297 -0.313 5 20 CBBD CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O 436958676 ITJHWGSSHIQDDO-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD O=C1CN=C(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)N1 543705140 KZTJZXPVMQACQQ-UHFFFAOYSA-N 292.207 -0.461 5 20 CBBD CC(C)(C)n1nnc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])n1 594397727 NJRKQMMKTXURQD-UHFFFAOYSA-N 294.275 -0.011 5 20 CBBD CO[C@@](C)(CO)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 594590180 VYBWHWOIFXGRNF-LLVKDONJSA-N 284.272 -0.102 5 20 CBBD O=C(OCCn1ccc([N+](=O)[O-])n1)[C@@H]1COCCO1 748112836 WZEZSXMLGQUHQQ-QMMMGPOBSA-N 271.229 -0.250 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H](CO)C2CC2)c1 763068666 MMQDUQBVIMXKKD-QWRGUYRKSA-N 270.289 -0.487 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1=O 773658072 KYHDGVPPMGWMMJ-QMMMGPOBSA-N 292.251 -0.336 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)C(=O)NC 808048046 GPDGFXJSEMOMFI-SNVBAGLBSA-N 296.283 -0.527 5 20 CBBD O=C(O)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 819327507 YBJXZRJIHKTFOL-SECBINFHSA-N 270.245 -0.423 5 20 CBBD COCCN(CCC(=O)O)c1ncc([N+](=O)[O-])c(N)n1 831730007 OFTBVDMTDWFYOC-UHFFFAOYSA-N 285.260 -0.106 5 20 CBBD CCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093445460 CGJKNOWNRKQHDE-UHFFFAOYSA-N 254.250 -0.095 5 20 CBBD COc1ccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1 1126932145 JHAHEJPGKKWPFX-NXEZZACHSA-N 295.299 -0.644 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)N(C)C)c1[N+](=O)[O-] 1320367622 OXCYWCXPQRGBDS-UHFFFAOYSA-N 255.234 -0.556 5 20 CBBD C[C@H](c1nnc(N2CCS(=O)CC2)n1C)[N+](=O)[O-] 1338832366 JSVUBVOPLZKNAG-SSDOTTSWSA-N 273.318 -0.279 5 20 CBBD CCc1[nH]nc(C(=O)NCCOCC(=O)O)c1[N+](=O)[O-] 1597400072 SQUQEOUVYPPLEJ-UHFFFAOYSA-N 286.244 -0.289 5 20 CBBD COc1cccc(C(=O)N[C@@H](CO)C(=O)O)c1[N+](=O)[O-] 1599641740 XMTGCVWETQXAPF-ZETCQYMHSA-N 284.224 -0.221 5 20 CBBD Cc1nn(C)c(N2CC[C@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1608002078 QRQVQXQOQKGICE-SNVBAGLBSA-N 270.245 -0.337 5 20 CBBD O=C(O)CC1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1608683757 FCRNEMOMDZPWAK-UHFFFAOYSA-N 269.217 -0.690 5 20 CBBD CO[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[C@@H]1C(=O)O 1777176949 IQPXFGHXGLIALX-POYBYMJQSA-N 297.271 -0.107 5 20 CBBD CC(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 28813822 YQOIOZPYSIUTMT-UHFFFAOYSA-N 282.256 -0.463 5 20 CBBD NC(=O)[C@@H]1CN(c2ncccc2[N+](=O)[O-])CCO1 50955656 AVNCGELSECQODW-QMMMGPOBSA-N 252.230 -0.320 5 20 CBBD O=C(CN1C[C@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-] 245687678 LAXFLQPKVOEJIT-VHSXEESVSA-N 295.295 -0.039 5 20 CBBD COc1cc(OCC(=O)NOCC(N)=O)ccc1[N+](=O)[O-] 271404060 NDMYGLJUQWSVPL-UHFFFAOYSA-N 299.239 -0.485 5 20 CBBD C[C@@H]1OCC[C@@]1(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330865043 YTFFIMAEERPDAZ-OIBJUYFYSA-N 269.261 -0.130 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H](O)C(F)F 355151692 ICYKQAWHCSYKHU-SSDOTTSWSA-N 291.210 -0.501 5 20 CBBD CC(C)NC(=O)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 549158909 PAPSTLOSQXNFQS-UHFFFAOYSA-N 269.261 -0.086 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCS(=O)(=O)C1 612623423 XYZWBJYMYKGUIJ-ZETCQYMHSA-N 287.297 -0.150 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCc1cnn[nH]1 735142813 RZMOBMQTOKKFJF-UHFFFAOYSA-N 266.217 -0.305 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc([N+](=O)[O-])o2)C1=O 779542309 YHJZWKNURYQELV-UHFFFAOYSA-N 268.185 -0.273 5 20 CBBD O=C(CN1CCCN(CC[N+](=O)[O-])CC1)N1CCCC1 791054791 XVRLJDNLUKIUCO-UHFFFAOYSA-N 284.360 -0.107 5 20 CBBD COC(=O)CCCONC(=O)Cn1cc([N+](=O)[O-])cn1 811562371 OTKIGBUGXRQOFJ-UHFFFAOYSA-N 286.244 -0.208 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@]3(CCCN3)C2)c1 923380110 MNIHFTXBEOJMFV-CHWSQXEVSA-N 295.343 -0.020 5 20 CBBD CC(C)C(=O)N1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 976479639 AAOLOJRBRUABPI-NZFPMDFQSA-N 281.312 -0.119 5 20 CBBD Cc1nonc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022063700 IAVLKOIYBNTMGM-PKIKSRDPSA-N 295.299 -0.220 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1c[nH]nc1[N+](=O)[O-] 1261839610 IOOZMQJXDKPLNT-ZETCQYMHSA-N 269.261 -0.886 5 20 CBBD CNC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329300459 SLAZLLGPIAUOPN-SSDOTTSWSA-N 253.262 -0.001 5 20 CBBD CNC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])cnc1N 1337826410 LOLSAHCGYDXLIC-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD CCOC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 1596891856 WWTDEBRQWNPOGE-QMMMGPOBSA-N 286.240 -0.148 5 20 CBBD Nc1ccc(N2C[C@@H](C(=O)O)C[C@@H](O)C2)nc1[N+](=O)[O-] 1601216193 YNBKXFLGZVKONV-NKWVEPMBSA-N 282.256 -0.156 5 20 CBBD O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H](CO)C(=O)O 19429319 SLUCIXDVIYYPLO-SECBINFHSA-N 268.225 -0.301 5 20 CBBD CC(=O)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(C)C 48353471 QTQXIMYQFIOUEA-VIFPVBQESA-N 269.261 -0.084 5 20 CBBD O=C(O)c1cn(CCn2cccc([N+](=O)[O-])c2=O)nn1 50445352 QLYYFQCBLCFFPU-UHFFFAOYSA-N 279.212 -0.254 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(C(=O)O)CCC1 164890942 BCEXXFISLNPEEH-UHFFFAOYSA-N 268.229 -0.085 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N(C)CC(N)=O)n1 166674254 DOVILNBGWUMYEC-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD O=C1NC[C@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 267521100 YEKZEQSZOAVDIV-VIFPVBQESA-N 291.267 -0.863 5 20 CBBD COC(=O)CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 267717598 XZNFZCINVXJOTO-LLVKDONJSA-N 298.299 -0.210 5 20 CBBD Cc1nn(Cc2nc(N)nc(N(C)C)n2)cc1[N+](=O)[O-] 272352313 LCGMTZOVNFTCIB-UHFFFAOYSA-N 278.276 -0.019 5 20 CBBD Nc1nc(N(CCO)C2CCOCC2)ncc1[N+](=O)[O-] 275400364 BGIKBZNIJKPUDS-UHFFFAOYSA-N 283.288 -0.055 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)N(C)[C@@H](C)C1 282348549 LQCACPFUVBXVKQ-QMMMGPOBSA-N 295.299 -0.211 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)O1 285624196 JZQRFFNRSVZSLA-CAHLUQPWSA-N 283.244 -0.919 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)NC(CO)(CO)CO 294286100 SIZHJJSOAOMIMG-UHFFFAOYSA-N 299.283 -0.260 5 20 CBBD NC(=O)[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])CCN1 296378116 HNQYLBCZDTUAKB-MRVPVSSYSA-N 268.248 -0.003 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H](O)CC2)c1 339782176 WXKGXNOSZBQAGF-NWDGAFQWSA-N 284.316 -0.001 5 20 CBBD NS(=O)(=O)c1cccc(NC[C@H](O)CO)c1[N+](=O)[O-] 353268894 SDMSTSPPGLWLLL-LURJTMIESA-N 291.285 -0.993 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 445174157 QSVDRBJCZFKRBL-LURJTMIESA-N 280.240 -0.357 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@H](C)O1 593843667 WHGJZLXNJZHUHP-XPUUQOCRSA-N 298.255 -0.280 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1C[C@H](O)C1 598530802 YVAZSAKVWJRWHY-XWEPSHTISA-N 267.241 -0.604 5 20 CBBD COC(=O)c1ccc(OCC(=O)NC(N)=O)cc1[N+](=O)[O-] 613109053 HRKJVRFVKYPSSA-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD O=C1CC(C(=O)OCCn2ccc([N+](=O)[O-])n2)CC(=O)N1 748120421 LCDCQMZNTQVYMY-UHFFFAOYSA-N 296.239 -0.613 5 20 CBBD CNC(=O)CNS(=O)(=O)c1csc([N+](=O)[O-])c1 768794414 OQMAZHKOUVOUEW-UHFFFAOYSA-N 279.299 -0.319 5 20 CBBD C[C@@](O)(CO)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 798264705 SPPQBRQAJKGNRR-NSHDSACASA-N 299.239 -0.024 5 20 CBBD Cn1c(C(=O)OCC(=O)NCC(=O)O)ccc1[N+](=O)[O-] 821269133 MSMWWUKUJGWDEA-UHFFFAOYSA-N 285.212 -0.709 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 863018299 SRZQAYCZAKGRPB-MRVPVSSYSA-N 297.267 -0.169 5 20 CBBD Cc1nc(N[C@H]2C[C@H](NC(=O)C(N)=O)C2)ccc1[N+](=O)[O-] 1059393834 MCNBMWGQLGZIFE-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](O)C[C@@H]2C(=O)O)c1[N+](=O)[O-] 1599967860 DDEXYBUWLYBEGV-PHDIDXHHSA-N 284.228 -0.714 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(CCO)CC1 40419696 AEXNNLGOAOCDSK-UHFFFAOYSA-N 255.278 -0.557 5 20 CBBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)n[nH]1 86507448 XJOCIPOEXZTIIJ-UHFFFAOYSA-N 264.201 -0.038 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN[C@@H](C)C1 155082003 DOMTVSKALZADEV-QMMMGPOBSA-N 267.289 -0.080 5 20 CBBD CCN(CCO)C(=O)NCCn1cc([N+](=O)[O-])cn1 161555475 GRUFQRWDTOIFBH-UHFFFAOYSA-N 271.277 -0.185 5 20 CBBD CCN(C)C(=O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 218121389 FBIYHZPJTDUSHV-JTQLQIEISA-N 285.304 -0.780 5 20 CBBD Cc1ccc(NC(=O)C(=O)NC[C@@H](O)CO)cc1[N+](=O)[O-] 275601473 FSZRZXBCPFBMMU-SECBINFHSA-N 297.267 -0.689 5 20 CBBD CCOC1CC(O)(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 286906496 CASQQLBCILMJLE-UHFFFAOYSA-N 284.272 -0.022 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1COC[C@@H]1O 342431459 JGVUPTVMHLMKKH-BQBZGAKWSA-N 256.218 -0.850 5 20 CBBD COc1cc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)ccn1 342938419 LBDPRLPVDBQNKS-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD CC(C)[C@@H](CO)CN=c1nc(N)c([N+](=O)[O-])c[nH]1 343750156 APGNMQNEMMBOGC-SSDOTTSWSA-N 255.278 0.065 5 20 CBBD O=C(NC[C@@]1(O)CCSC1)c1n[nH]cc1[N+](=O)[O-] 344000142 FNOOXOZJKAZXRT-VIFPVBQESA-N 272.286 -0.084 5 20 CBBD COC(=O)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1 539931076 IWPAWACAIPRENR-UHFFFAOYSA-N 295.251 -0.386 5 20 CBBD C[C@@H](CN)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 565598420 YKVFYAYXTIHJCZ-ZETCQYMHSA-N 274.302 -0.137 5 20 CBBD Cn1cnnc1CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 581200273 PZGVOUABCDBBLO-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD CO[C@@H]1CN(c2ccnc(O)c2[N+](=O)[O-])C[C@H]1O 596258178 WLAHVYVDJNTEDF-HTQZYQBOSA-N 255.230 -0.109 5 20 CBBD CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 597540935 PSKPSVBDVHYTRI-MRVPVSSYSA-N 256.218 -0.237 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OC[C@H]1COC(=O)O1 763955371 NJHOZFZRYGPENH-QMMMGPOBSA-N 298.207 -0.165 5 20 CBBD CN1CC[C@H](OC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 766963145 IAGLJVKYMBQBJX-ZETCQYMHSA-N 268.229 -0.284 5 20 CBBD CC(C)(C)OC(=O)[C@](C)(O)CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839725624 HWBUHFLABZYUFF-DNSOKLHBSA-N 288.300 -0.140 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)c1cc([N+](=O)[O-])n[nH]1)C2 861868457 FMWIUFMBBMFZQK-UJURSFKZSA-N 252.186 -0.542 5 20 CBBD NC(=O)C(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1 949971328 PZGJBXASUNXSSH-UHFFFAOYSA-N 292.295 -0.276 5 20 CBBD O=C(NC1CN(C(=O)c2n[nH]cc2F)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991292782 CLZBRNRQFBIVEB-HTRCEHHLSA-N 297.246 -0.845 5 20 CBBD Cc1nn(C)c(C(=O)O[C@@H](C)C(N)=O)c1[N+](=O)[O-] 1322008726 USYDXKQOGNIJLR-YFKPBYRVSA-N 256.218 -0.333 5 20 CBBD CC1(C)CNCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 1325855820 KVKUFXLIDOLLPT-MRVPVSSYSA-N 282.304 -0.309 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2CNC[C@@H]21 1326168540 MAVMTNJVPSHDJF-SFYZADRCSA-N 265.273 -0.238 5 20 CBBD COCc1nnc(CCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1515535251 ORVPTJIBLXUXPA-RNFRBKRXSA-N 271.229 -0.033 5 20 CBBD C[C@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CNCCO1 1576341924 PCNMAAVKSASNCZ-LLVKDONJSA-N 283.288 -0.714 5 20 CBBD O=C1C[C@@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)CN1 1593387001 XHRBQIWALQHQHU-RXMQYKEDSA-N 278.232 -0.893 5 20 CBBD NC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 165572529 AVQYECUFCFQCGH-ZETCQYMHSA-N 254.246 -0.277 5 20 CBBD C[C@H](O)C[C@@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 252764773 PCQWISNNIRXJSQ-YWVKMMECSA-N 272.305 -0.099 5 20 CBBD NCC(=O)NCC(=O)NCCNc1ccccc1[N+](=O)[O-] 262471532 ZBXPVNBSOKASJO-UHFFFAOYSA-N 295.299 -0.802 5 20 CBBD NC(=O)CCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 266465400 ADHGTFQQLTXOCZ-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NOCC(C)(C)O 279126174 DKLMAFRYTMYADS-UHFFFAOYSA-N 272.261 -0.082 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCC1 337321964 QSCLBMDQYWBYSF-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD O=C(O)[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 337677771 YZLJKVZHRSHPCO-ZETCQYMHSA-N 283.244 -0.491 5 20 CBBD NC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 353933208 MIBXNMDTSJNKNL-UHFFFAOYSA-N 290.239 -0.258 5 20 CBBD COCCCNC(=O)CN(C)c1ncc([N+](=O)[O-])cn1 354531602 ZQRNYUZNUJCGGV-UHFFFAOYSA-N 283.288 -0.026 5 20 CBBD CO[C@@]1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1 359465382 KZBORAQVSCLMSB-LLVKDONJSA-N 284.272 -0.287 5 20 CBBD O=C(O)c1ccnc(NC[C@H](O)CO)c1[N+](=O)[O-] 385867659 YBTAPFFWHPCGTQ-YFKPBYRVSA-N 257.202 -0.547 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC(O)(C(F)F)C2)c1 424135933 NBLIGHJPODXQHL-QMMMGPOBSA-N 292.242 -0.536 5 20 CBBD NC[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 428514459 WDGNPCRELXHSPO-SNVBAGLBSA-N 294.311 -0.046 5 20 CBBD CN1CCC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548955861 QUERUQVPWJAXHN-ZETCQYMHSA-N 267.245 -0.332 5 20 CBBD O=C(CCNC[C@H](O)CO)Nc1ccccc1[N+](=O)[O-] 572556991 DCBRSFUGXMQFQN-VIFPVBQESA-N 283.284 -0.134 5 20 CBBD CNC(=O)[C@H]1CN(c2cccnc2[N+](=O)[O-])CCO1 611618257 WBXSJXARUSOICS-SECBINFHSA-N 266.257 -0.059 5 20 CBBD NC(=O)CNC(=S)NNc1ccccc1[N+](=O)[O-] 727066089 SQNUUBMMSWZQKN-UHFFFAOYSA-N 269.286 -0.129 5 20 CBBD NC(=O)[C@H](O)CNc1nc2ccccn2c1[N+](=O)[O-] 808050501 CWHWPYQPYQEWAK-ZCFIWIBFSA-N 265.229 -0.499 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])NCCn1cnnn1 816289217 YNTHDJVJTBOYQV-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD C[C@@H](C(=O)NC1CC1)N1CCN(CC[N+](=O)[O-])CC1 929111658 MDPZPXQUWUVINF-JTQLQIEISA-N 270.333 -0.452 5 20 CBBD CCOC(=O)[C@H]1CN(CC[N+](=O)[O-])CC12COC2 930599806 ZJMWGEVCXHZWFJ-SECBINFHSA-N 258.274 -0.225 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@]2(CCOC2=O)C1 1135068768 QPXSKEDMHAKDKW-SOCHQFKDSA-N 254.242 -0.183 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411992 UMIIDDZWZQNWRM-MRVPVSSYSA-N 297.267 -0.176 5 20 CBBD CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CCNC1=O 1253923040 PIYFQYCFHUWMTP-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD Cc1[nH]nc(C(=O)N=c2nc[nH]n2C)c1[N+](=O)[O-] 1319169140 QPOFEVBIVXOGPU-UHFFFAOYSA-N 251.206 -0.571 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1=CCNCC1 1326594955 CUPJJJUYYQDQOA-UHFFFAOYSA-N 266.261 -0.778 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ncnn1C 1343513934 ZHUQQBRVGAEOST-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD O=C(N[C@@H](CCF)C(=O)O)c1c[nH]nc1[N+](=O)[O-] 1601415531 YYUBGWKPMXCEIM-YFKPBYRVSA-N 260.181 -0.140 5 20 CBBD O=C(O)CNC(=O)CNc1cccnc1[N+](=O)[O-] 1602070789 IZMRYLXDRRJIPC-UHFFFAOYSA-N 254.202 -0.398 5 20 CBBD CC1(O)CN(c2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 1603820879 YCEZCMKVUUSHGW-UHFFFAOYSA-N 277.244 -0.259 5 20 CBBD Cc1[nH]nc(C(=O)NCCN(C)CC(=O)O)c1[N+](=O)[O-] 1607500142 LGQNMXJGWZOIAY-UHFFFAOYSA-N 285.260 -0.627 5 20 CBBD CN(CC(N)=O)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 49270376 HQABBSXGSZWJQL-UHFFFAOYSA-N 280.240 -0.523 5 20 CBBD O=C(NCc1c[nH]cn1)c1cc([N+](=O)[O-])c[nH]c1=O 88759054 KWRSESQHKKLSEL-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])cnc1O 230277324 NJGWFCSVABOMOU-SSDOTTSWSA-N 285.256 -0.177 5 20 CBBD O=C(O)c1cnc(N2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 236617694 OUVNNMAMBHDMFI-YUMQZZPRSA-N 269.213 -0.770 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)NCCn1cc([N+](=O)[O-])cn1 269113317 YARPCSHVZIKQMM-QMMMGPOBSA-N 298.303 -0.385 5 20 CBBD COCCN(CC(=O)OC)c1ncc([N+](=O)[O-])c(N)n1 270330455 BQQVRFOVLZKPFH-UHFFFAOYSA-N 285.260 -0.407 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCO[C@@H]1C1CC1 340659307 AABGOFIMRFLXSR-PSASIEDQSA-N 281.272 -0.130 5 20 CBBD Cn1nnnc1Cn1cc(Cl)cc([N+](=O)[O-])c1=O 347756962 LKQDPEAIZSONNI-UHFFFAOYSA-N 270.636 -0.018 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[C@@H](CO)O1 349625527 FDTLIARCIKQEDT-UWVGGRQHSA-N 298.299 -0.244 5 20 CBBD Nc1nc(N2CCN3C(=O)OC[C@H]3C2)ncc1[N+](=O)[O-] 378163405 YVTLAFGJAOUXIO-ZCFIWIBFSA-N 280.244 -0.392 5 20 CBBD COCCCN(CCO)C(=O)c1c([N+](=O)[O-])cnn1C 438534056 UHAJZRHBRHCWSG-UHFFFAOYSA-N 286.288 -0.201 5 20 CBBD C[C@@](O)(CNc1ncc([N+](=O)[O-])c(N)n1)C(=O)O 567983342 BPRFFWYXAPOXCI-MRVPVSSYSA-N 257.206 -0.786 5 20 CBBD C[C@H](CNCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 578619175 DBBKHRNPKBIRQR-MRVPVSSYSA-N 276.318 -0.186 5 20 CBBD C[C@@H](CC(N)=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593550957 OSCZOSVFHMITBR-LURJTMIESA-N 288.285 -0.468 5 20 CBBD O=C(N[C@H]1CCO[C@H]1C(=O)O)c1cc([N+](=O)[O-])c[nH]1 595245011 PHCLHTWTURZUMU-POYBYMJQSA-N 269.213 -0.105 5 20 CBBD CN1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1=O 596136261 RFZDSPHXSGCSKY-UHFFFAOYSA-N 252.230 -0.026 5 20 CBBD C[C@@H](Nc1ccc(N)c([N+](=O)[O-])n1)C(=O)NCCF 596228235 ZDTMJRJDSNDEFT-ZCFIWIBFSA-N 271.252 0.458 5 20 CBBD CCN(OC)C(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 826756530 SXRYLAQPKNPCHO-UHFFFAOYSA-N 297.271 -0.090 5 20 CBBD Nc1nc(N2CC[C@@H](N3CCOC3=O)C2)ncc1[N+](=O)[O-] 853806847 OFDGUJAKOFPPNI-SSDOTTSWSA-N 294.271 -0.002 5 20 CBBD C[C@@H]1C[C@H](NCC[N+](=O)[O-])C(=O)N1c1cnn(C)c1 905146919 SWBMKHFKJYEZIX-SCZZXKLOSA-N 267.289 -0.220 5 20 CBBD CCCCC(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1041512226 XILRGEYADSVZJT-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD CC(C)NC(=O)CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767798 VCDCHOIVMIFDTD-NXEZZACHSA-N 286.332 -0.728 5 20 CBBD O=C(O)[C@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 1608577040 XZWZAHQGLAAKJF-JTQLQIEISA-N 270.245 -0.375 5 20 CBBD CN(CC(N)=O)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 63749284 ZETGLZGRWBDCKW-UHFFFAOYSA-N 294.267 -0.732 5 20 CBBD CCc1nn(C)c(NCCS(N)(=O)=O)c1[N+](=O)[O-] 91575860 SRNXBDHVKKFRFX-UHFFFAOYSA-N 277.306 -0.409 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCN1CCNCC1 158750884 CEUROZCSLHXENA-UHFFFAOYSA-N 296.331 -0.797 5 20 CBBD CNCCN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 263259717 SEBICTWHQKVJDY-UHFFFAOYSA-N 255.278 -0.072 5 20 CBBD Nc1nc(NCC(=O)NCC(F)F)ncc1[N+](=O)[O-] 281143316 ZSTAYABVCBZDQL-UHFFFAOYSA-N 276.203 -0.240 5 20 CBBD O=C(N[C@@H]1CCCCNC1=O)c1cc([N+](=O)[O-])[nH]n1 285007813 DBYWUHLHBRCYEB-ZCFIWIBFSA-N 267.245 -0.284 5 20 CBBD O=C(O)c1cnc(N2C[C@@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 316877511 POADTLJEYNEZND-CBAPKCEASA-N 283.240 -0.523 5 20 CBBD CCC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 339627547 JLLLOKAATRKPSQ-UHFFFAOYSA-N 253.214 -0.166 5 20 CBBD COC(=O)[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)OC 347834521 QMQVKUYYYCUUEU-QMMMGPOBSA-N 286.244 -0.905 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)C(=O)N(C)C 352855223 ABUWYFXKJCRZTJ-RXMQYKEDSA-N 255.234 -0.476 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])nn2C)C1 357044407 BHOXFLDVGPSNFS-UHFFFAOYSA-N 267.245 -0.711 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCc1ncc[nH]1 360812658 MJPYKFDBINRDNR-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CCN1C[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 391568004 BYGOBVWWGMJEMN-ONGXEEELSA-N 297.315 -0.637 5 20 CBBD CN1C[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)C(=O)N1 450607455 ALZMDZAHPLKPRW-ZCFIWIBFSA-N 270.270 -0.269 5 20 CBBD O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H](O)CO)c1 561383135 WXPCMEXYDPEBBB-MNOVXSKESA-N 286.284 -0.723 5 20 CBBD NC(=O)[C@]1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1 575136630 FSYYAMNHMSMPNJ-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD CNc1nccc(C(=O)N[C@@](C)(CO)COC)c1[N+](=O)[O-] 594342814 IYJZFAGWFOIEAP-LBPRGKRZSA-N 298.299 0.159 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCCN1CCNC1=O 741114794 JZFSJHUETLISEY-UHFFFAOYSA-N 297.271 -0.250 5 20 CBBD COC(=O)[C@H](C)OC(=O)Cn1ccc([N+](=O)[O-])n1 759784270 GDXOOZXXJWEYNE-LURJTMIESA-N 257.202 -0.104 5 20 CBBD CN(C)C1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 825854493 BSKIIQVYOOVSMB-UHFFFAOYSA-N 290.287 -0.080 5 20 CBBD O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CC(O)C1 827042591 UIYGTKRDDAFMDP-JTQLQIEISA-N 252.226 -0.169 5 20 CBBD Cc1nn(CC(=O)OC[C@H](C)[N+](=O)[O-])c(=O)n1C 847714440 UJTJVHBVHMUFJJ-LURJTMIESA-N 258.234 -0.901 5 20 CBBD O=C1CC[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@H]2N1 855676974 MQPQOIZAKIGRHC-SGIHWFKDSA-N 267.285 -0.221 5 20 CBBD O=C(NC[C@H](CO)[C@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1322483761 HCBZSKVQTRLASQ-JGVFFNPUSA-N 284.272 -0.307 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1[C@H]2CCNC[C@H]1CC2 1331894259 JFIMECRIJULDDG-RKDXNWHRSA-N 280.288 -0.461 5 20 CBBD C[C@H](C[S@@](C)=O)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1337707052 HEJFSZQOGJPTME-WXQGDBPDSA-N 260.275 -0.185 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 1340661237 BEWJVANSLGJNSZ-SSDOTTSWSA-N 290.301 -0.659 5 20 CBBD CN1CCN(C)[C@@H](CNc2c([N+](=O)[O-])ncn2C)C1 68806638 JRXWJACOQKTNJE-VIFPVBQESA-N 268.321 -0.014 5 20 CBBD CCCNC(=O)CN(C)C(=O)Cn1cnc([N+](=O)[O-])c1 78820323 LFBUELADKIXHTF-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1OC 122029401 AMNFHRIJRHDGPS-QMMMGPOBSA-N 298.251 -0.133 5 20 CBBD CNS(=O)(=O)[C@H]1CCN(Cn2nccc2[N+](=O)[O-])C1 138264095 IHGNUBUKPBNOOY-QMMMGPOBSA-N 289.317 -0.628 5 20 CBBD NC(=O)[C@H](O)CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 227830560 REXOHNSOMMGVDX-SNVBAGLBSA-N 294.267 -0.262 5 20 CBBD COc1cc(C(=O)NC[C@H](O)C(N)=O)ccc1[N+](=O)[O-] 228511833 UZFIUQTWPYKMIF-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CC(C(N)=O)=NO1 278818044 IWAAYIQGAYCUNG-YFKPBYRVSA-N 268.233 -0.630 5 20 CBBD CCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 283053317 RHQAUSMTEKTRSQ-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1ccccc1=O 353609053 YUSJGUYPRYBNEE-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@]2(O)CCN(C)C2)c1[N+](=O)[O-] 358428516 WRLBPSWOQCUIKK-LBPRGKRZSA-N 297.315 -0.323 5 20 CBBD CO[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H](CN)C1 359211930 KAUDIHNENVQUEZ-ZJUUUORDSA-N 297.315 -0.244 5 20 CBBD COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O 436893985 PXQSAZAAWLJPIC-SECBINFHSA-N 297.267 -0.079 5 20 CBBD NC1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCC1 521039668 JWFDQWLMTRCNAJ-UHFFFAOYSA-N 253.262 -0.211 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 548735395 GSDMOGCLPWXHDV-ZETCQYMHSA-N 293.283 -0.091 5 20 CBBD CC(C)Oc1nc(NC[C@@H](O)CO)ccc1[N+](=O)[O-] 571178440 DMZVNQXUISXNPD-MRVPVSSYSA-N 271.273 0.542 5 20 CBBD CC(=O)NC[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CCO1 590586507 XWXMLZXGKGJNGN-VIFPVBQESA-N 295.299 -0.087 5 20 CBBD O=C(c1csc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 600217033 MQYAYPNLDQLBTP-BQBZGAKWSA-N 258.255 -0.166 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCO 603824334 DFGPRBQLJNXLBE-SECBINFHSA-N 256.258 -0.084 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCCNS(C)(=O)=O 730601155 QCHMRUJJHNKLJX-UHFFFAOYSA-N 291.285 -0.361 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)NC(N)=O)n1 755572296 BCXSMOALKGZNAD-UHFFFAOYSA-N 285.216 -0.837 5 20 CBBD O=C(O)CCNC(=O)COC(=O)c1ccc([N+](=O)[O-])cn1 833237477 YRBHLZYZTVDNJL-UHFFFAOYSA-N 297.223 -0.263 5 20 CBBD O=C(NC(CO)CO)[C@H](O)c1cccc([N+](=O)[O-])c1 857715677 MKQJBEWRQVSHSO-SNVBAGLBSA-N 270.241 -0.902 5 20 CBBD CC(C)(COC(=O)[C@@H]1CC[C@H](C(N)=O)O1)[N+](=O)[O-] 860867182 CQNARMBKRSRGHT-RQJHMYQMSA-N 260.246 -0.382 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cc[nH]n2)C1 954234395 ATUOUJHWTYKTHD-PSASIEDQSA-N 293.283 -0.642 5 20 CBBD Cc1nn(C)cc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292867 ZNTDYRVCDIWBBV-VXGBXAGGSA-N 293.327 -0.306 5 20 CBBD Cc1cccc(C(=O)N[C@@H](CO)C(N)=O)c1[N+](=O)[O-] 1328505718 QLRKNQOOJWXRGK-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@H]2CCNC[C@H]2C1 1580812189 RLINEIKORCVDPX-SFYZADRCSA-N 265.273 -0.001 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601759025 WZLIJCWYNPNLBO-POYBYMJQSA-N 284.228 -0.632 5 20 CBBD O=C(NN1C(=O)NC2(CCCCC2)C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 47296157 KSDXDMFWTWWSAT-HTQZYQBOSA-N 296.283 -0.063 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)C(=O)O 90276620 IXJIRXRDVGLFOZ-SNVBAGLBSA-N 271.229 -0.501 5 20 CBBD O=C1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCCN1 112210172 POYLNUCCOUMSNK-UHFFFAOYSA-N 280.240 -0.343 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC(OCCO)CC1 129217971 MMTRTSJVBIVLDS-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD NC(=O)[C@@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCO1 153825914 GUCCIYNYWNEUKK-NEPJUHHUSA-N 295.295 -0.186 5 20 CBBD N[C@H]1CC[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]12 185196964 YIWORVQUTBKBER-BBBLOLIVSA-N 279.300 -0.013 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])cnc1N 195143946 JLKGCXNNFHLIRQ-IMTBSYHQSA-N 293.283 -0.174 5 20 CBBD CC(C)NC(=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 228361412 ZFHYEKRBPSIYEQ-NSHDSACASA-N 299.331 -0.344 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1Nc1ncc([N+](=O)[O-])c(N)n1 281765169 ZCNRRAGEAJWSRS-FSPLSTOPSA-N 266.261 -0.097 5 20 CBBD CNC(=O)[C@]1(C)CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285974816 ONLDUQFBKSVCSH-LLVKDONJSA-N 281.272 -0.084 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@@H]1CCCO1 344883232 SMOGOUZOOGPECW-CBAPKCEASA-N 284.272 -0.402 5 20 CBBD CN1CCC[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 519596165 KIBXWNZSBZUUKB-WDEREUQCSA-N 297.315 -0.637 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 548941761 HMRGPFAXFRNXGH-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD CNC(=O)CCCNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 565725932 ULLAUDGBQQNWOE-UHFFFAOYSA-N 295.299 0.288 5 20 CBBD CNC(=O)[C@H]1CN(Cc2onc(C)c2[N+](=O)[O-])CCO1 595426914 TYDUHYNOELPBIQ-SECBINFHSA-N 284.272 -0.162 5 20 CBBD Nc1nc(N2CC[C@@H]3NC(=O)CC[C@@H]3C2)ncc1[N+](=O)[O-] 596458334 HOZMAICKOZSEPK-SFYZADRCSA-N 292.299 0.072 5 20 CBBD CCN(C)S(=O)(=O)NC(=O)c1cc([N+](=O)[O-])cn1C 744239555 UVYNMNDAIKBOIH-UHFFFAOYSA-N 290.301 -0.140 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nn1c(O)nnc1O 820281452 CIKSCFUROJVICG-UHFFFAOYSA-N 298.190 -0.297 5 20 CBBD CN1C[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 825576137 XORNCICUUGBXGU-JOYOIKCWSA-N 293.279 -0.025 5 20 CBBD O=C1CC[C@@H](n2cc([N+](=O)[O-])cc(F)c2=O)C(=O)N1 842638227 XWFVOLOARVXWEP-SSDOTTSWSA-N 269.188 -0.127 5 20 CBBD CC(C)(C(=O)O[C@H]1CNOC1)n1cc([N+](=O)[O-])cn1 848059771 PJBYJWVBAPUMAN-QMMMGPOBSA-N 270.245 -0.027 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCCO1 862084221 HUNCFAMWKOZRGU-UHFFFAOYSA-N 295.255 -0.534 5 20 CBBD O=C(NC1CN(C(=O)c2cnsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282068 VTNAOFSEYPDJJW-HTRCEHHLSA-N 297.296 -0.856 5 20 CBBD COCC(=O)N(CCO)CCNc1ccc([N+](=O)[O-])cn1 1111420103 IJBBDDMTIZZONC-UHFFFAOYSA-N 298.299 -0.131 5 20 CBBD O=C(NCCCNCc1cnns1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767832 WRHLNNLOPMNVKP-RKDXNWHRSA-N 285.329 -0.201 5 20 CBBD N[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261434726 SYISRERRQNCZKA-SSDOTTSWSA-N 254.250 -0.864 5 20 CBBD Cc1noc(Cn2nnnc2[C@H](C)O)c1[N+](=O)[O-] 1333721126 JFNODRVUZJRRSV-YFKPBYRVSA-N 254.206 -0.021 5 20 CBBD COCCN(CC(=O)O)Cc1nn(C)cc1[N+](=O)[O-] 1777209622 HMTSCGIHXFOKMK-UHFFFAOYSA-N 272.261 -0.139 5 20 CBBD COC[C@H](C)OC[C@H](O)Cn1cnc([N+](=O)[O-])n1 234881024 NQSUJSYARXDDLP-JGVFFNPUSA-N 260.250 -0.401 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)C(=O)O 262049895 FKGSQNQNUDOTQD-ZCFIWIBFSA-N 270.245 -0.063 5 20 CBBD NC(=O)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285182270 NZJQKOBFEPZDGU-SSDOTTSWSA-N 267.245 -0.202 5 20 CBBD CN(C)C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 330610845 OAGYLXGTNGZBCX-QMMMGPOBSA-N 283.288 -0.280 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 345277381 BDYYZDPYYDQOEM-SECBINFHSA-N 284.224 -0.436 5 20 CBBD CN(C)CCOCCNC(=O)Cn1ccc([N+](=O)[O-])n1 349744426 MKSWDIGEQCYWNH-UHFFFAOYSA-N 285.304 -0.514 5 20 CBBD C[C@H](O)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](C)CO 442696084 SJYXYQAAMVGHPM-RQJHMYQMSA-N 272.261 -0.478 5 20 CBBD C[C@@H]1CNCCN1C(=O)c1c([N+](=O)[O-])cnn1C 564797954 XBYVXMLBXCZKOT-SSDOTTSWSA-N 253.262 -0.238 5 20 CBBD CNC(=O)CN(C)c1nccc(C(=O)OC)c1[N+](=O)[O-] 598590673 VIFDMWGLPPUFDC-UHFFFAOYSA-N 282.256 -0.041 5 20 CBBD O=C1CN(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCCN1 769228286 SPLFMVAGAAUEQR-UHFFFAOYSA-N 296.287 -0.677 5 20 CBBD CN(CC(N)=O)c1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C 786575070 ISQNBFAWBSKTBX-UHFFFAOYSA-N 293.283 -0.293 5 20 CBBD C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)S1(=O)=O 839773974 KLSQWFGOBAGHDB-FNCVBFRFSA-N 276.314 -0.314 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](N2CC[C@@H](O)C2)C1 861720316 XVDNSIFNMFJXHP-LNFKQOIKSA-N 269.301 -0.681 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC/C=C/C(=O)O)n1 863407071 DQPUKXRTMYVDKL-NSCUHMNNSA-N 290.257 -0.753 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCC(O)(CO)CC2)n1 1328430324 YHKVYNTWDSAYLV-UHFFFAOYSA-N 270.289 -0.390 5 20 CBBD CN(Cc1nncn1C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 1349799211 ZUXATYSENOCDTQ-UHFFFAOYSA-N 291.271 -0.027 5 20 CBBD CN(CC(N)=O)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] 43272424 VLXWMGUZTSUYES-UHFFFAOYSA-N 287.297 -0.080 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)c1n[nH]c(=O)[nH]1 48919408 SBYBHDYRVQCVEU-UHFFFAOYSA-N 277.240 -0.021 5 20 CBBD N[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 137343832 HZQZMUZNDPDXOZ-JTQLQIEISA-N 280.284 -0.390 5 20 CBBD NCC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 169191116 BQIRGXSQIGVWGV-MRVPVSSYSA-N 265.273 -0.039 5 20 CBBD COC(=O)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CCO1 174845859 ORAKYFGVKISQAB-SNVBAGLBSA-N 284.272 -0.335 5 20 CBBD C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])C(N)=O 183591512 JLLORVBBNKYKRN-YFKPBYRVSA-N 253.218 -0.015 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@@H](O)C2)c1 246692789 IOBVTAHBCCELMF-MNOVXSKESA-N 270.289 -0.391 5 20 CBBD CNC(=O)NC1CN(c2ncc([N+](=O)[O-])cn2)C1 282143991 BENIKLIAXVKHEI-UHFFFAOYSA-N 252.234 -0.498 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285430804 KOPNRFQICHFARN-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD O=C(NC[C@@]1(O)CCSC1)c1cc([N+](=O)[O-])[nH]n1 286258403 UZGCRSDZNKJKEW-VIFPVBQESA-N 272.286 -0.084 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@@H]2CNC[C@H]2C1 290073559 IJYSUAOJNZQNQO-ZJUUUORDSA-N 279.300 -0.141 5 20 CBBD COC(=O)[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)OC 347834519 QMQVKUYYYCUUEU-MRVPVSSYSA-N 286.244 -0.905 5 20 CBBD Cn1nnnc1Sc1nccc(C(N)=O)c1[N+](=O)[O-] 357332624 RZENQDRDPDKYCS-UHFFFAOYSA-N 281.257 -0.237 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)C1CCOCC1 360662715 YCPAEWBMOXSGLI-LLVKDONJSA-N 298.299 -0.305 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN([C@H]2CCOC2)CC1 378312249 FFWKUHXPRYHDFF-VIFPVBQESA-N 295.299 -0.135 5 20 CBBD CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 546017987 MRJDVNARDBIRMG-MRVPVSSYSA-N 266.257 -0.106 5 20 CBBD CC(C)(C(=O)NC[C@@H]1CNCCO1)n1cc([N+](=O)[O-])cn1 574311714 CGYGDMVPQMPYIF-JTQLQIEISA-N 297.315 -0.369 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@H]1CCCCN1 591677309 IIEITXBWQUYIEQ-MRVPVSSYSA-N 268.277 -0.555 5 20 CBBD NC(=O)[C@@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCO1 776579083 IWFNZWUDHNKDEC-RYUDHWBXSA-N 295.295 -0.186 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 788179798 ZVHKUDRRZXKUCS-SECBINFHSA-N 296.283 -0.678 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 795482337 GMDLYXGSUUHWPP-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1COCO1 861965952 NDCZIXDARJHVOD-ZETCQYMHSA-N 256.218 -0.720 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](N2CC[C@H](O)C2)C1 1117737925 XUVQGWJHZHOZTB-BDAKNGLRSA-N 295.299 -0.401 5 20 CBBD O=[N+]([O-])c1cccnc1N1CCN2CCOC[C@@]2(CO)C1 1120876479 BVQPTXZVSBXLEV-ZDUSSCGKSA-N 294.311 -0.127 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1ncnn1C 1339998222 MQZFJUMPEKYZPP-UHFFFAOYSA-N 280.244 -0.028 5 20 CBBD O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H](CO)C(=O)O 1601280188 BCKOOFBHZFAUQI-VIFPVBQESA-N 297.267 -0.042 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(=O)N1CCCC1 120748319 MDQVWUYJTIGWLJ-UHFFFAOYSA-N 295.299 -0.162 5 20 CBBD CN(CC(=O)NC1CC1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173501285 DRADBXSIQGBFMK-LLVKDONJSA-N 297.315 -0.637 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1OC 234571229 QTAPVHLYDUQRDI-SECBINFHSA-N 298.251 -0.133 5 20 CBBD O=C(CNc1ncc([N+](=O)[O-])cn1)N1CCOCC1 274001166 SXLQKOLBASMHMW-UHFFFAOYSA-N 267.245 -0.345 5 20 CBBD COCCOCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285164869 SREVZESDGPFKNK-UHFFFAOYSA-N 258.234 -0.289 5 20 CBBD C[C@@H]1[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCN1C 343565595 RUSZWJHHLGXTAD-RKDXNWHRSA-N 282.304 -0.215 5 20 CBBD CN(C)C(=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 357205145 USGIJTCIEWSFOP-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD COC(=O)[C@H]1COCCN1Cc1c([N+](=O)[O-])ncn1C 370035728 GLOXTLNWJVFXSZ-SECBINFHSA-N 284.272 -0.298 5 20 CBBD C[C@@H]1CC(=O)NCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 375844325 VGJXQIKPKVDCND-KOLCDFICSA-N 297.315 -0.637 5 20 CBBD COC(=O)C1(C)CN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 425157632 BLWCHFUAUCFLDG-UHFFFAOYSA-N 282.256 -0.037 5 20 CBBD NC(=O)COCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 431356114 YIICMCFCTXLFNT-UHFFFAOYSA-N 256.218 -0.845 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O 436992087 UDJOBNLHNVRSTG-UHFFFAOYSA-N 296.239 -0.385 5 20 CBBD NC(=O)CC(=O)NCc1nc2ccc([N+](=O)[O-])cc2[nH]1 444632852 IEKHGBTXUSJZQB-UHFFFAOYSA-N 277.240 -0.037 5 20 CBBD CNc1nccc(C(=O)N(C)[C@H]2CCNC2=O)c1[N+](=O)[O-] 565192961 XFEAFQSICBYMRX-QMMMGPOBSA-N 293.283 -0.008 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1CO 598909276 IAMBZHZQHGRLJS-DTWKUNHWSA-N 283.288 -0.337 5 20 CBBD O=C1NC(=O)N2CCN(c3ncc([N+](=O)[O-])s3)C[C@H]12 619697304 LXEIBVPIHPQFEJ-RXMQYKEDSA-N 283.269 -0.208 5 20 CBBD CN[C@H](C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 722166231 HCADVHCPQGMDCC-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD CN1CC[C@@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)CC1=O 749078885 JDXPHUKOEWYVPJ-MRVPVSSYSA-N 297.271 -0.402 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O 760891051 UAMNJVMDKQRQQO-ZETCQYMHSA-N 283.240 -0.470 5 20 CBBD Nc1ccc(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)cc1[N+](=O)[O-] 763269600 OTZNAZLKIPBCNB-CABZTGNLSA-N 295.295 -0.008 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)CN1CCCC1 808222798 XXKCYDMJEOVLBG-SNVBAGLBSA-N 297.315 -0.636 5 20 CBBD Nc1c(C(=O)OCC(=O)NCC(=O)O)cccc1[N+](=O)[O-] 821363912 HOYNSIBBHJPMJV-UHFFFAOYSA-N 297.223 -0.465 5 20 CBBD Cn1nccc1C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991279444 LMHJQMBOZHJOKN-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD O=C(NCC1CCN(CCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001398432 DWMJHYKDNOBXMX-VXGBXAGGSA-N 285.344 -0.138 5 20 CBBD COCC(=O)NC/C=C\CNc1ncc([N+](=O)[O-])c(N)n1 1107012862 GMCCXPYHROYROI-IHWYPQMZSA-N 296.287 -0.302 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H](O)CN1 37668499 POHDPCZDTWUIJU-QWRGUYRKSA-N 265.269 -0.066 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 159055015 RJIPVMUKHWDSMT-ZCFIWIBFSA-N 257.202 -0.248 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 191729496 GRDCXSNMPCZQCL-WPRPVWTQSA-N 284.272 -0.601 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN(CCO)CC(F)F)c1 193406945 PJJYZCFKXZIFQJ-VIFPVBQESA-N 294.258 -0.288 5 20 CBBD CN1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 265633406 FXBUALFVJAMJBP-SNVBAGLBSA-N 295.299 -0.130 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCN(C2CC2)C(=O)C1 337159615 RYORGBIBXFADSS-UHFFFAOYSA-N 293.283 -0.225 5 20 CBBD O=C1CCC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)N1 340230804 IIHOUPMUYPCYRK-VIFPVBQESA-N 281.272 -0.424 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1O 351853077 BLSYFAJBKPIBEK-HTQZYQBOSA-N 254.246 -0.370 5 20 CBBD CN(C)CCOCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 354727481 WAJFFOZGONYQDR-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD NC(=O)c1cccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1 358525174 DLQLBRKZPTUORO-UHFFFAOYSA-N 290.239 -0.076 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CN1 358891733 RMICHYCDGIZQGI-SSDOTTSWSA-N 285.281 -0.238 5 20 CBBD NC(=O)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 362603935 WYUFPORSOKPFFF-UHFFFAOYSA-N 295.251 -0.029 5 20 CBBD NCCNC(=O)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 419830229 GAERGGRUESVIAG-UHFFFAOYSA-N 292.295 -0.446 5 20 CBBD N[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 428369650 KLTJRBVZAFOQFG-MRVPVSSYSA-N 266.257 -0.684 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCC1=O 598773242 NJIZSLWAYBRFNR-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1[C@@H]2CNC[C@@H]21 598915816 QIAGGXCLKFAEAU-URLYPYJESA-N 290.279 -0.133 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nnnn1C 779467456 RNFYTJWROIEPAL-UHFFFAOYSA-N 280.248 -0.348 5 20 CBBD O=C(O)CCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 821525698 HHWNGVADQBLAHX-UHFFFAOYSA-N 283.240 -0.263 5 20 CBBD CS(=O)(=O)[C@@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840361311 VUXDGUSAXGZVPM-BWZBUEFSSA-N 294.354 -0.402 5 20 CBBD COCC[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 840437343 QAMDEVIFQVSJGH-FXPVBKGRSA-N 258.274 -0.037 5 20 CBBD O=C(CN1CCCC1)N1CCN(CC[N+](=O)[O-])CC1 929513839 XJTJQSOOTBRPOZ-UHFFFAOYSA-N 270.333 -0.497 5 20 CBBD CCCN(C)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323615316 IAWWQYCSRCWUJY-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD CC(=O)N1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC1 1355418139 YUGZXMBOKSFMOK-MRVPVSSYSA-N 282.304 -0.179 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H](F)C(=O)O 1601028973 PHISHDUXSCQGCB-BYPYZUCNSA-N 260.181 -0.519 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@](O)(C(=O)O)C1 1601216744 OWLORKRABGEZLW-LBPRGKRZSA-N 295.251 -0.161 5 20 CBBD O=C(O)C[C@H](O)CNc1ccnc(O)c1[N+](=O)[O-] 1601913243 ZSLDGFUXJMZPKP-YFKPBYRVSA-N 257.202 -0.057 5 20 CBBD Nc1ccc(C(=O)N2C[C@H](O)C[C@H]2C(=O)O)cc1[N+](=O)[O-] 1608271518 APHKXJBVTYPONM-XCBNKYQSSA-N 295.251 -0.163 5 20 CBBD CCNC(=O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 151724765 CHAGYEGVWIJLAA-UHFFFAOYSA-N 284.276 -0.773 5 20 CBBD O=C(O)c1nn(CC(=O)N2CCOCC2)cc1[N+](=O)[O-] 229735681 MCVQYWOSCSQPML-UHFFFAOYSA-N 284.228 -0.652 5 20 CBBD N[C@@H]1CC[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@@H]21 248694101 YIWORVQUTBKBER-KXUCPTDWSA-N 279.300 -0.013 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CC[C@@H](C(N)=O)O1 268317378 LVAVMOUEFZSSIL-BQBZGAKWSA-N 269.261 -0.227 5 20 CBBD NC(=O)[C@H](O)CNc1ncnc2cccc([N+](=O)[O-])c12 340914327 WPRKLLVHEJWRIX-MRVPVSSYSA-N 277.240 -0.204 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@@H](O)CO)n1 342533291 BPECXLDNICYDPM-SSDOTTSWSA-N 285.256 -0.434 5 20 CBBD Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])cnc2N)n1C 351121178 YMJVVJIDHLFADY-UHFFFAOYSA-N 291.271 -0.061 5 20 CBBD Cc1nc2n(n1)CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)C2 353585785 VTUSKBVAPXYBSX-UHFFFAOYSA-N 277.244 -0.126 5 20 CBBD O=C1N[C@H]2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]2CO1 491160728 PUOBNJKZXQLQCD-RQJHMYQMSA-N 295.255 -0.112 5 20 CBBD CO[C@@H]1C[C@@H](C(=O)O)N(CCn2cc([N+](=O)[O-])cn2)C1 574697361 RACPAJKPNWTRFX-ZJUUUORDSA-N 284.272 -0.035 5 20 CBBD CNC[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 595981527 DUJWBPDINALHPF-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD Cc1cc(OCC(=O)NC[C@H](O)C(N)=O)ccc1[N+](=O)[O-] 597586876 RLVUONSDEIZDEG-JTQLQIEISA-N 297.267 -0.756 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 763696850 LUEILBBEBJVAEL-JTQLQIEISA-N 297.267 -0.803 5 20 CBBD Cn1nccc1S(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])[nH]1 765664224 ZPPQVYNBCBZYLT-UHFFFAOYSA-N 299.268 -0.225 5 20 CBBD CCc1[nH]nc(C(=O)NCCn2ccnn2)c1[N+](=O)[O-] 782876735 DTILXCFYNHBNNR-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)C1CCC2(CC1)NC(=O)NC2=O 814041835 DPRUHWSSICXYIP-OQNPIJIBSA-N 299.283 -0.037 5 20 CBBD O=C1CN(c2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)CCN1 826481230 MDTLWLOHRALPHF-UHFFFAOYSA-N 289.255 -0.289 5 20 CBBD Cn1ncnc1CN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031661946 NZTCDDSBJUNWTR-NXEZZACHSA-N 294.315 -0.972 5 20 CBBD NC(=O)[C@H](CO)NC(=O)Cc1ccc([N+](=O)[O-])cc1 1117246844 GNXFTOIYISIPDE-VIFPVBQESA-N 267.241 -0.900 5 20 CBBD COCCOCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1342408294 XRNNRDPKONEWEC-UHFFFAOYSA-N 285.256 -0.482 5 20 CBBD CN(C[C@H](O)CO)c1ncc(C(=O)O)cc1[N+](=O)[O-] 1598503229 HONLYRCMJBQCJO-ZETCQYMHSA-N 271.229 -0.523 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1601908124 AKEDCXJRHITRJF-KOLCDFICSA-N 298.251 -0.420 5 20 CBBD C[C@H](OC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)C(=O)O 1604405130 UBRPMJSVNUTUID-LURJTMIESA-N 298.207 -0.658 5 20 CBBD Cc1cc([N+](=O)[O-])ccc1C(=O)NCC(=O)NCC(=O)O 44747682 FECKXWBHHWGGRT-UHFFFAOYSA-N 295.251 -0.166 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC(CO)CC2)c1 75626589 XQLYWIJFYHDBOG-LBPRGKRZSA-N 284.316 -0.144 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(F)(F)CO 183922819 HWJMSOOWKVJQPJ-UHFFFAOYSA-N 278.215 -0.156 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCCO 194969726 XVPOGBVWWNVOSY-UHFFFAOYSA-N 256.262 -0.012 5 20 CBBD Cc1[nH]nc(C(=O)NCC(F)(F)CN)c1[N+](=O)[O-] 275176993 VMDSPFAPNLBKLO-UHFFFAOYSA-N 263.204 -0.050 5 20 CBBD O=C(Cn1cnnn1)NCc1ccccc1[N+](=O)[O-] 337246954 JYQUNLXKBCDOHN-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD CCc1[nH]nc(C(=O)Nc2nc(C)n(C)n2)c1[N+](=O)[O-] 344535675 IIURPZNABYIFLI-UHFFFAOYSA-N 279.260 0.570 5 20 CBBD NC(=O)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 357639700 WDAQHDIZOMBVFI-UHFFFAOYSA-N 263.213 -0.314 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H](CO)COC)c1[N+](=O)[O-] 357706165 HYBSLBNDMYRKMP-LURJTMIESA-N 272.261 -0.383 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 358349669 CURUBXZCAIYLCG-NSHDSACASA-N 281.272 -0.485 5 20 CBBD CN(C)C(=O)O[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 495925396 CTVOCQSFGNXNLA-DJLDLDEBSA-N 271.273 -0.049 5 20 CBBD CN1CC[C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 584816754 YJLRVODXDOGKTB-SSDOTTSWSA-N 253.262 -0.001 5 20 CBBD CCOC(=O)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])n[nH]1 597675286 YCIITSVXYDXGHB-ZCFIWIBFSA-N 286.244 -0.638 5 20 CBBD COC(=O)C[C@@H](O)CNc1c([N+](=O)[O-])c(C)nn1C 599162319 JKDCQUVFRSPAKD-SSDOTTSWSA-N 272.261 -0.027 5 20 CBBD CN1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 615990759 LATUXZBJMPKGJZ-LURJTMIESA-N 266.261 0.000 5 20 CBBD COCCC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 761941037 DSDMOXCDTNVESP-UHFFFAOYSA-N 271.229 -0.060 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H](CO)C2CC2)c1 763068668 MMQDUQBVIMXKKD-WDEREUQCSA-N 270.289 -0.487 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CNC(=O)C1 801946629 LTGQGCSNMJTGNU-YFKPBYRVSA-N 282.231 -0.066 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccon1 973917038 ZWJAIGNZIYAVBC-IBCQBUCCSA-N 294.267 -0.283 5 20 CBBD O=C(CC1CC1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990039902 YMBPNECJBDVWPU-NXEZZACHSA-N 267.285 -0.221 5 20 CBBD NC(=O)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 1055746656 AAFYOYHLMSKSQR-UHFFFAOYSA-N 293.283 -0.486 5 20 CBBD CNC(=O)CC(=O)NCCN(C)c1ccc([N+](=O)[O-])cn1 1100066647 FXEVAWSLCRHPPF-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD CN(CCN(C)c1ccnc(O)c1[N+](=O)[O-])C(=O)C(N)=O 1105543455 BNMAWSSSHBYXCE-UHFFFAOYSA-N 297.271 -0.925 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1116275549 VAJSEGMEMWXZTI-ZCFIWIBFSA-N 270.245 -0.072 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 1320948935 MSBANACYEPMXRT-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD O=C(N[C@H]1CCCS(=O)(=O)C1)c1c[nH]nc1[N+](=O)[O-] 1325254192 FUTJYHGARKMONQ-LURJTMIESA-N 288.285 -0.375 5 20 CBBD O=C(O[C@@H]1CCN(C2CC2)C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1325278190 MAFZUVBWMXDSIV-IWSPIJDZSA-N 254.242 -0.042 5 20 CBBD CCN(CC(N)=O)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1343513240 RVJKXPSAHIEMMX-UHFFFAOYSA-N 269.261 -0.416 5 20 CBBD CN1C[C@@H](O)[C@H](N(C)c2nccc(C(=O)O)c2[N+](=O)[O-])C1 1777093355 WXTWGJITJKEMSB-RKDXNWHRSA-N 296.283 -0.201 5 20 CBBD Cc1nn(C)c(N2CC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 52394020 ZWSTVMLXKYBQLJ-ZETCQYMHSA-N 253.262 -0.052 5 20 CBBD O=C(NCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 135432729 FJZHCEQDXWVCPU-LLVKDONJSA-N 297.315 -0.732 5 20 CBBD O=C(O)Cn1cc(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)nn1 167222410 JWQLTUYEBDSHNS-UHFFFAOYSA-N 294.227 -0.471 5 20 CBBD CCN1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 264118206 MXDKVHRTBFOWJK-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)N2CCCC2)c1 269152427 SSYQNGMVLPDCRR-UHFFFAOYSA-N 289.317 -0.279 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1)NCCO 273795750 WASWDECBJLTVDI-UHFFFAOYSA-N 267.241 -0.567 5 20 CBBD C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)N(C)C 298868969 SOTHFAFGPDLKLI-MRVPVSSYSA-N 255.278 -0.142 5 20 CBBD CN1CCC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299638487 PORPISRRUKGEKZ-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@]1(O)CCSC1 331037728 OJEXZFLBQSTENP-JTQLQIEISA-N 286.313 -0.225 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 331197705 XLRZKBKXLCXYLF-VIFPVBQESA-N 297.315 -0.533 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC(=O)NCC1CC1 352104553 UUCSEDICWJTHPN-UHFFFAOYSA-N 293.283 -0.172 5 20 CBBD Cn1cnc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 352769170 HNLDCHQJNJPTLQ-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(=O)NCC1CC1 357864442 ZXASTAJFXOLYCV-UHFFFAOYSA-N 281.272 -0.416 5 20 CBBD CC[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 592952717 NJBYBFSFEAVPLW-LURJTMIESA-N 271.233 -0.587 5 20 CBBD COC(=O)[C@@H](N)Cc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 594650501 VKGHCESTXQBVOS-VIFPVBQESA-N 292.255 -0.387 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2ncccc2[N+](=O)[O-])CC1 594760542 QLBWUDYQFFMSFP-UHFFFAOYSA-N 286.269 -0.714 5 20 CBBD CS(=O)(=O)NC1CN(c2ncc([N+](=O)[O-])cc2F)C1 599148925 ROQHIJVLCUGLKC-UHFFFAOYSA-N 290.276 -0.133 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCc1cc(C(N)=O)no1 610886785 ZOZPSTUYAQXLEY-UHFFFAOYSA-N 293.239 -0.050 5 20 CBBD O=C(O)[C@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 738550319 BJABGICWCDCLCP-SSDOTTSWSA-N 256.218 -0.466 5 20 CBBD COC[C@@H](C(N)=O)N(C)C(=O)c1ccc(N)c([N+](=O)[O-])c1 817935642 FUXBINVAZHEQJE-JTQLQIEISA-N 296.283 -0.251 5 20 CBBD O=C(N[C@@H]1C[C@@H]2CCCCN2C1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839793586 UYYZHSQFUZUIRL-SGIHWFKDSA-N 267.285 -0.079 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CNC[C@H](O)CO)c1 843064568 ZIBTVPFIKWJUDG-WDEREUQCSA-N 256.258 -0.429 5 20 CBBD CC(=O)N[C@@H](C(=O)OCCn1cnc([N+](=O)[O-])n1)C(C)C 860585009 OLIRQJYCMHGPBA-SECBINFHSA-N 299.287 -0.110 5 20 CBBD O=C(NCCNCc1ncccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932086 HQRDFASTMKBSFK-RKDXNWHRSA-N 265.273 -0.652 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2nncn2C)c1 1253374970 TYCJSFQYGJGXTO-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD Nc1cc(N2CC[C@H](O)C2)cc(-c2nn[nH]n2)c1[N+](=O)[O-] 1592759993 OAWCWWVBWDRUIM-ZETCQYMHSA-N 291.271 -0.072 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCN2CCOCC2)c1 37880942 YPQFXBSYIGZUBB-GFCCVEGCSA-N 299.331 -0.926 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])c1n[nH]c(=O)[nH]1 48734885 DPDJGQZZKGDLIF-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD C[C@H](CCO)CNC(=O)Cn1ccc([N+](=O)[O-])n1 97442339 PPMNPLMSMNWIDB-MRVPVSSYSA-N 256.262 -0.074 5 20 CBBD N[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 137343889 HZQZMUZNDPDXOZ-SNVBAGLBSA-N 280.284 -0.390 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(C)C(=O)C2)c1[N+](=O)[O-] 152715409 SIICZRHHQHKWKY-UHFFFAOYSA-N 281.272 -0.449 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1CCNC1=O 340227051 VLCKQANVMMCKJU-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1COC[C@H]1O 352795688 UAQZAFHYQQSVJK-DTWKUNHWSA-N 256.262 -0.517 5 20 CBBD NC(=O)C1(CNc2ncc([N+](=O)[O-])c(N)n2)CCOCC1 357893448 NPLPUTNKMXVXCI-UHFFFAOYSA-N 296.287 -0.339 5 20 CBBD CN1CCC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 359022040 WFINENSJIOZWHK-LURJTMIESA-N 266.261 0.000 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@H](O)C[C@H]1CO 360187881 CUCAMNRGWWHKRO-JGVFFNPUSA-N 282.256 -0.629 5 20 CBBD CCCN1C[C@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 420654642 QBYSMXKPOPULCQ-QMMMGPOBSA-N 294.315 0.059 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O 436671555 AMEOXHMOTYIBJD-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cn1 531643813 YXSGBQHWIQXGGX-UHFFFAOYSA-N 274.258 -0.992 5 20 CBBD CN(C)CCOCCNC(=O)CCn1cc([N+](=O)[O-])cn1 537542533 FJISSLDOKDQXGK-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD CC(C)NC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 548926942 BZHXTMYHDNEJNP-UHFFFAOYSA-N 255.234 -0.428 5 20 CBBD CN[C@H]1CCN(S(=O)(=O)c2cccnc2[N+](=O)[O-])C1 563118472 UYIKGTFDWDJWKQ-QMMMGPOBSA-N 286.313 -0.028 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400546 NXNGAUOZXKICSI-HTRCEHHLSA-N 293.283 -0.174 5 20 CBBD CN(C)CCN(C)CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 571816462 NXJGGKHUDQDXGJ-UHFFFAOYSA-N 298.347 -0.069 5 20 CBBD C[C@H]1NCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@@H]1C 581370838 DQTYQVICKUMNBV-NXEZZACHSA-N 294.311 -0.035 5 20 CBBD CNc1nccc(C(=O)NC[C@H](C)CO)c1[N+](=O)[O-] 590441235 CMZFDORIXZXFGR-ZETCQYMHSA-N 268.273 0.390 5 20 CBBD O=C1[C@@H]2C[C@H]2C(=O)N1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 611165798 QHUZKJPNXXPYFM-IWSPIJDZSA-N 280.240 -0.843 5 20 CBBD CCC(=O)N[C@H](C)C(=O)OCCn1cnc([N+](=O)[O-])n1 749075689 GRHMFHPHOHESDN-SSDOTTSWSA-N 285.260 -0.356 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)[C@H]1COCCO1 761383804 HUONNOOTOKCMLK-SNVBAGLBSA-N 298.251 -0.285 5 20 CBBD C[C@@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CNC(=O)C1 802194131 UBAUWAOGUVTSOV-NSHDSACASA-N 282.256 -0.139 5 20 CBBD O=[N+]([O-])c1cnc(N2C[C@@H](O)[C@H](CO)C2)c(F)c1 894162237 PLTPOIXYGFUOLR-IMTBSYHQSA-N 257.221 -0.082 5 20 CBBD C/C=C(\C)C(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042430641 CLVIYTIFUSKOLV-ZCFALZCBSA-N 297.311 -0.693 5 20 CBBD COC(=O)NCC(=O)NCCNc1ncccc1[N+](=O)[O-] 1093490977 MZAGTZSXZJCKHT-UHFFFAOYSA-N 297.271 -0.126 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1 1117682797 ICGRWMCOYHNZMN-WYUUTHIRSA-N 282.300 -0.678 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCn2cccn2)c1=O 1318000871 SMKLDNGJMXNZME-UHFFFAOYSA-N 277.240 -0.248 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)O[C@H]1CCC(=O)NC1=O 1321635458 IGCRNRFJUQFDMV-LURJTMIESA-N 282.212 -0.710 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCn2ncnc2C1 1325708513 SZTSBFLYOYBJPH-UHFFFAOYSA-N 291.271 -0.266 5 20 CBBD C[C@H](C(N)=O)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1589033241 BCRLPBCNSHZBRJ-GSVOUGTGSA-N 252.194 -0.982 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 36981489 QNQRIVAMIVZIBT-YFKPBYRVSA-N 269.213 -0.124 5 20 CBBD O=C(Cn1cn[nH]c1=O)NCc1ccc([N+](=O)[O-])cc1 122023986 PXVNPEXSOSFETB-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCCNC1 238143807 NOLYCPQVBJBOMK-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD CC(C)[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(N)=O 276534158 ZBLYFGXHLYLUOW-MRVPVSSYSA-N 282.256 -0.065 5 20 CBBD O=C(NC[C@H](CO)[C@H]1CCOC1)c1cc([N+](=O)[O-])[nH]n1 285878776 IKWKZSPNDDBYJV-JGVFFNPUSA-N 284.272 -0.307 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 332681853 KBWMHVVYWAOVCW-ZETCQYMHSA-N 282.256 -0.037 5 20 CBBD CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@H]1COC[C@@H]1O 342367508 DMPQADWOSSBYCL-UWVGGRQHSA-N 298.299 -0.256 5 20 CBBD CN(C)C(=O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 352269443 PDLKIFVAJMDZGJ-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 425081764 GGSKLJVTDBZBSA-ZETCQYMHSA-N 294.267 -0.190 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@@H](CO)[C@@H]2CCCO2)c1 447901821 CWXKKFBJSDQPMO-QWRGUYRKSA-N 270.289 -0.079 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 449703325 VXPSAIWJRMTVNJ-JTQLQIEISA-N 294.311 -0.066 5 20 CBBD CCn1cnnc1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 586776313 AWGLJOYQHPTLMU-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD CNC(=O)C1CN(c2ccnc(O)c2[N+](=O)[O-])C1 596196025 PXOWHZKDGVESHH-UHFFFAOYSA-N 252.230 -0.122 5 20 CBBD O=C1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCCN1 726779237 WUDYCVHIKINBAY-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD CC[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 727001198 AUQLNMBJIKTNAY-MRVPVSSYSA-N 270.245 -0.012 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)Cn1nc2n(c1=O)CCCC2 845577095 JUGBNNNXKKGBBO-QMMMGPOBSA-N 284.272 -0.411 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1nnc(C[N+](=O)[O-])n1C 1338205767 MNRJJMCTOPXMPR-ZETCQYMHSA-N 268.277 -0.741 5 20 CBBD C[S@](=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1339171797 DYFDUMLEBAIQOF-SFHVURJKSA-N 274.302 -0.324 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](CO)[C@H]1CCOC1 1339740060 CNJMCQQBMWBTBW-UWVGGRQHSA-N 298.299 -0.448 5 20 CBBD Cc1nnc(CN(C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 1347140735 YTWQXQKLMKXQLR-SNVBAGLBSA-N 296.287 -0.024 5 20 CBBD C[C@@](CO)(NCCn1cc([N+](=O)[O-])cn1)C(=O)O 1604195714 LRUFILRQPCOZLF-VIFPVBQESA-N 258.234 -0.784 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 1610735131 DYPKJBGOTXZVHZ-WPRPVWTQSA-N 284.272 -0.441 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CCO)CC1 50693227 JSXFKWCMRYQVNE-UHFFFAOYSA-N 294.311 -0.073 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@H](CO)C1 168346824 IABTUTSCAFDUTE-VIFPVBQESA-N 270.245 -0.989 5 20 CBBD CC1(C)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCN1 175435901 ULFLFCLJIQMFOU-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD C[C@H](O)CN(CCn1cc([N+](=O)[O-])cn1)[C@@H](C)CO 190919020 NDNZQPUZEQHOCY-UWVGGRQHSA-N 272.305 -0.145 5 20 CBBD Cc1cc(C(=O)NCCOCC(N)=O)c(N)c([N+](=O)[O-])c1 268604967 FVXCOYMFQZWKMU-UHFFFAOYSA-N 296.283 -0.283 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCOC1 269067275 DDYRABZPMGMWPU-QMMMGPOBSA-N 254.246 -0.056 5 20 CBBD CNC(=O)N1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 347918323 OMXKQFSOPROBFD-UHFFFAOYSA-N 296.287 -0.725 5 20 CBBD C[C@H](N)[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 351829396 BDSDGIPHAGDOFA-IUCAKERBSA-N 267.289 -0.013 5 20 CBBD CCOC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 352945924 HFCWNHRVSTYIAC-UHFFFAOYSA-N 270.245 -0.070 5 20 CBBD COC[C@]1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCCN1 357277303 VXVHOYJLDYZASP-GFCCVEGCSA-N 297.315 -0.324 5 20 CBBD COC(=O)[C@@H]1CN(C)CCN(c2c([N+](=O)[O-])ncn2C)C1 413505579 VBGIFJXAPMVXQJ-SECBINFHSA-N 297.315 -0.131 5 20 CBBD Cn1cnc(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)n1 436368088 SBXOICQKOLIFMT-UHFFFAOYSA-N 264.249 -0.828 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 444313254 GZDFPFCYAHXPCU-BQBZGAKWSA-N 284.272 -0.552 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1COC[C@H]1O 563137186 ASSBVRXVFYNERZ-CKYFFXLPSA-N 298.295 -0.316 5 20 CBBD NC(=O)[C@@]1(NC(=O)Cc2ccc([N+](=O)[O-])cc2)CCOC1 571299274 YOYJCPAOMBGZGK-CYBMUJFWSA-N 293.279 -0.102 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@H]2CNC[C@H]21 582057234 WXRFXRYTTCQCNU-DTWKUNHWSA-N 280.288 -0.603 5 20 CBBD CCn1nncc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 600158866 OZBPSAKNENVEHU-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD NC(=O)NCCNc1ncc([N+](=O)[O-])cc1C(N)=O 610278510 OWNPDSSBAHQQSQ-UHFFFAOYSA-N 268.233 -0.831 5 20 CBBD CN(C)C(=O)COC1CN(Cn2cc([N+](=O)[O-])cn2)C1 751943357 JCNYPIIMCSVBRW-UHFFFAOYSA-N 283.288 -0.462 5 20 CBBD CCn1ncn(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1=O 820391651 QLUBCPIHCFISJI-UHFFFAOYSA-N 292.255 -0.061 5 20 CBBD C[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC(=O)N1 836853465 QFGWWBRZNQKNFH-PRHODGIISA-N 293.279 -0.025 5 20 CBBD C[C@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CN1CCOCC1 839688421 RIABMOYYACHQMX-GMTAPVOTSA-N 271.317 -0.264 5 20 CBBD Cn1c(=O)ccn(CC(=O)OCC(C)(C)[N+](=O)[O-])c1=O 851124700 IOCJPTAGILJLSR-UHFFFAOYSA-N 285.256 -0.855 5 20 CBBD O=C(N[C@H]1C[C@@H](NCC(=O)N2CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022061514 LWCOKHFKGWGFLQ-LMLFDSFASA-N 296.327 -0.879 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345537 ZWPPXQNBHCSFRK-QMMMGPOBSA-N 294.267 -0.897 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C1CCNCC1 1118195715 PGTKQDFVOHVVBR-UHFFFAOYSA-N 268.277 -0.603 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 1329088660 XULSOIDSJUJPKG-MRVPVSSYSA-N 293.283 -0.077 5 20 CBBD O=C(NCCn1ccnn1)c1n[nH]cc1[N+](=O)[O-] 1334960301 AATJMKVRZUWASD-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD Cc1nn(C)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1-c1nn[nH]n1 1592433500 BNJIKIDLAVAVGU-PHDIDXHHSA-N 292.259 -0.488 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc2c(cc1[N+](=O)[O-])OCO2 1601564793 ZTLIWICYHCCXBF-LURJTMIESA-N 298.207 -0.501 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 194174400 ZJUCPOSCHZXYHU-XCBNKYQSSA-N 281.272 -0.568 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2O)CCO1 267964627 UMQIXCZDWDTIFC-SECBINFHSA-N 295.251 -0.373 5 20 CBBD CC1(C)CNC(=O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 282750729 SLFOCDRTIXNRBK-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286686253 FGNUCEOOUBJWTF-VXNVDRBHSA-N 298.255 -0.544 5 20 CBBD Nc1nc(N2CCN3C(=O)CC[C@@H]3C2)ncc1[N+](=O)[O-] 345191766 RNAAYOYHTIAICP-SSDOTTSWSA-N 278.272 -0.222 5 20 CBBD Cc1ccn(CCCS(N)(=O)=O)c(=O)c1[N+](=O)[O-] 349170587 ZZIMNDQYASLVIX-UHFFFAOYSA-N 275.286 -0.256 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@]1(CO)CCOC1 349552010 FNVDWRSHJYQYDS-LBPRGKRZSA-N 297.267 -0.976 5 20 CBBD Cn1cnnc1NC(=O)Cn1ccc([N+](=O)[O-])n1 361339673 RPUFQGUBMRMWTE-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)N1 393923164 CLPDPMACFPAHGP-ZETCQYMHSA-N 280.240 -0.625 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@]1(CCO)CCOC1 447066047 JBSUZYYOARZQQJ-NSHDSACASA-N 284.272 -0.400 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 572403586 SAQGLZKPSNYDCN-YFKPBYRVSA-N 254.202 -0.135 5 20 CBBD CCNC(=O)CN(C)c1ncc([N+](=O)[O-])c(N)n1 609075085 YSMBTWNJHFSTNY-UHFFFAOYSA-N 254.250 -0.461 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)O[C@H]1CNOC1 816573201 QTQDPPKLGJNDEF-JTQLQIEISA-N 295.251 -0.229 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 844114810 LGQZKGNXFFNEKK-FNCVBFRFSA-N 272.257 -0.966 5 20 CBBD CNC(=O)CN1[C@H]2CC[C@H]1CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1029303598 VBDQENLSQYPNCY-UKKRHICBSA-N 296.327 -0.927 5 20 CBBD COCc1noc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932323 SFMPRWORHAHXBN-HTQZYQBOSA-N 299.287 -0.913 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CC[C@H]1C(=O)O 1608377138 NTAQYXZXSOSYMM-SFYZADRCSA-N 295.251 -0.264 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NCCS(N)(=O)=O 52812351 SXIOKDJJBZXWQK-UHFFFAOYSA-N 260.275 -0.001 5 20 CBBD CCC(CC)(CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 236760910 PDKHFSHHNULZHX-UHFFFAOYSA-N 270.293 -0.180 5 20 CBBD O=[N+]([O-])c1ccc2nc(N3C[C@H](O)[C@H](O)C3)nc(O)c2c1 343205858 MHSDCUIMSCLVOI-AOOOYVTPSA-N 292.251 -0.215 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](CO)O1 347667541 KSHLHHKNPJLVKJ-SFYZADRCSA-N 284.272 -0.450 5 20 CBBD O=C(NC1CC1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 371435314 BWBAGQZLXMQLQF-KXUCPTDWSA-N 267.285 -0.079 5 20 CBBD N=C(O)OCCNC(=O)Cn1ccc([N+](=O)[O-])n1 494741992 IWOQQTOPBWVBHA-UHFFFAOYSA-N 257.206 -0.583 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H](C)N)c1 521999515 XBZTZKJQEMTYKS-ZCFIWIBFSA-N 255.230 -0.110 5 20 CBBD COc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 537579110 QQCGFAUORLEAQA-QMMMGPOBSA-N 294.267 -0.322 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)C(N)=O 545915170 WUJSOGSFPSNVLC-ZCFIWIBFSA-N 295.251 -0.030 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@H]1C(N)=O 583827924 VJIZMSFCERETAU-HTRCEHHLSA-N 251.246 -0.058 5 20 CBBD NCCN(CCOc1cccc([N+](=O)[O-])c1)C[C@H](O)CO 595901129 ARICZJFJUJWFAX-LBPRGKRZSA-N 299.327 -0.413 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 619254988 SAORBWZUXUBGAE-MRVPVSSYSA-N 293.239 -0.953 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1=NCCS1 748598754 QSNRLMXNXGLUST-UHFFFAOYSA-N 282.281 -0.025 5 20 CBBD CNc1c(C(=O)N[C@H](COC)C(N)=O)cccc1[N+](=O)[O-] 765608390 GILUENJVIWMYQY-MRVPVSSYSA-N 296.283 -0.133 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 808174865 VZFGMIONOLOTNQ-MRVPVSSYSA-N 282.300 -0.171 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@H](CC(=O)O)C2)c1[N+](=O)[O-] 832847212 DKFJBSYCEVTOGN-ZETCQYMHSA-N 298.255 -0.058 5 20 CBBD CCO[C@@H]1COCC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839726181 NVWOYOOQTUVLPR-UTINFBMNSA-N 258.274 -0.038 5 20 CBBD O=[N+]([O-])c1cnc(N2CC(N3CCOCC3)C2)nc1 894369152 APUNELUFXCLKHK-UHFFFAOYSA-N 265.273 -0.094 5 20 CBBD COCCNC(=O)C1CCN(CC[N+](=O)[O-])CC1 929167933 WGWXKSUFVCDQCG-UHFFFAOYSA-N 259.306 -0.262 5 20 CBBD NC(=O)NCCC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093623630 NQGIJNGTHAHSII-UHFFFAOYSA-N 296.287 -0.424 5 20 CBBD CCCCNC(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936269 DNGVQVVOYZOTRP-NXEZZACHSA-N 286.332 -0.726 5 20 CBBD COCC[C@H](CO)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1321326235 VLVVIIJADPVRJT-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD N[C@@H](CC(F)F)C(=O)NCCn1cc([N+](=O)[O-])cn1 1332151332 BABXBZDWBJLWCI-ZETCQYMHSA-N 277.231 -0.110 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1336696757 DMPOIYYPVRKTPE-LLVKDONJSA-N 286.288 -0.154 5 20 CBBD CNC[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350908262 CAIRCBPLKBETHL-JQWIXIFHSA-N 283.332 -0.307 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N(C1CC1)C1CNC1 1580578162 ALDACBYXDJOZNQ-UHFFFAOYSA-N 266.261 -0.851 5 20 CBBD O=C(O)CC(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 1601888085 LGBLGXKIYPNAAN-BXKDBHETSA-N 298.251 -0.420 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)C1 1606247846 UTLANHUUCIVLKV-QMMMGPOBSA-N 281.272 -0.163 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCN(CC(=O)O)CC2)n1 1608122442 BMGRJMOZZGKNLK-UHFFFAOYSA-N 297.271 -0.829 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCCO 193119798 ZNOXTFPWWKEHQX-MRVPVSSYSA-N 281.268 -0.178 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 193569884 SUXYVRUSVAJWFD-MIMYLULJSA-N 297.315 -0.734 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCCCO)c1 236498498 JWUYMJGABAQLLV-JTQLQIEISA-N 258.278 -0.486 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[C@H]1O 286580536 QEMYBLCNIUGYTB-QJPTWQEYSA-N 284.316 -0.003 5 20 CBBD COC[C@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)OC 300562856 CVKGAJNIZCEQDG-MNOVXSKESA-N 288.304 -0.597 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](C(N)=O)C(C)C)c1[N+](=O)[O-] 337324138 TZMFGFKNJANBMB-LURJTMIESA-N 269.261 -0.134 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 343067463 AIYQEXKZUJUQFI-UHFFFAOYSA-N 284.276 -0.339 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[S@@]1=O 352315365 VVGFTCHSUHPZLE-YLVJLNSGSA-N 286.313 -0.229 5 20 CBBD C[C@H](CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1)c1nn[nH]n1 352473663 WTSXCYBYHXVHJD-SSDOTTSWSA-N 294.275 -0.434 5 20 CBBD C[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)Cn1cccn1 357934246 KTAHTIKUECEFHZ-SECBINFHSA-N 293.287 -0.165 5 20 CBBD C[C@H]1OCCN[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 424178165 VQOSKSGFQCOBAR-SCZZXKLOSA-N 283.288 -0.716 5 20 CBBD Cn1c(C(=O)Nc2nccn(C)c2=O)ccc1[N+](=O)[O-] 444104649 YJCMQRICVVFRNN-UHFFFAOYSA-N 277.240 0.279 5 20 CBBD CCn1cc(S(=O)(=O)NC[C@H](C)CN)c([N+](=O)[O-])n1 447239505 NICXVXRROIWVII-SSDOTTSWSA-N 291.333 -0.316 5 20 CBBD Nc1cc(N2C[C@H](O)C[C@@H]2CO)cc(CO)c1[N+](=O)[O-] 588008410 RNOBPNXODHKSAC-NXEZZACHSA-N 283.284 -0.399 5 20 CBBD NC(=O)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 593813686 NZSWHLFYYFWABL-SYDPRGILSA-N 253.218 -0.688 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])o1 737609326 XTIURLSHTYEFFR-UHFFFAOYSA-N 286.196 -0.112 5 20 CBBD O=C([C@@H]1CCCCN1CC[N+](=O)[O-])N1CCOCC1 791054164 YDNSATLMHKKIQH-NSHDSACASA-N 271.317 -0.024 5 20 CBBD Cn1cc(CCn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cn1 1345051592 IOQDGSILYLZDAK-UHFFFAOYSA-N 291.267 -0.168 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 1610731779 AOSHLRVEYXRTHM-XVKPBYJWSA-N 298.255 -0.772 5 20 CBBD CCOC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 42694034 RBPBYRAPICURKJ-UHFFFAOYSA-N 283.240 -0.082 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCS(=O)CC2)c1 75720690 KPGOPLAPFRQCHW-SNVBAGLBSA-N 288.329 -0.784 5 20 CBBD CCNC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 284881654 FWVWKTUHCRPKLN-UHFFFAOYSA-N 296.287 -0.195 5 20 CBBD CCc1nn(C)c(N2CC(NC(=O)COC)C2)c1[N+](=O)[O-] 289643196 NFPKGJRNLLUFHF-UHFFFAOYSA-N 297.315 -0.158 5 20 CBBD Cc1nc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)nn1C 344561815 UGXKUVWUMUFPAT-UHFFFAOYSA-N 292.255 -0.168 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC1(C(=O)O)CCCC1 354176291 DBPXKVUSIZGEPB-UHFFFAOYSA-N 283.244 -0.300 5 20 CBBD Cn1nnc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)n1 398164828 JDEDGSUCQNNLTI-UHFFFAOYSA-N 295.234 -0.230 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CN(C)NC1=O 427719736 CULXZQZIEHUTEF-VIFPVBQESA-N 294.267 -0.322 5 20 CBBD O=C(NC[C@@H]1CNC[C@@H]1O)c1ccc(O)c([N+](=O)[O-])c1 436731151 NYMHMYPRAYYFBR-KWQFWETISA-N 281.268 -0.390 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 550161726 VALXTMLCSKZWAO-ZCFIWIBFSA-N 295.255 -0.876 5 20 CBBD CC[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 592952735 NJBYBFSFEAVPLW-ZCFIWIBFSA-N 271.233 -0.587 5 20 CBBD CNc1nccc(C(=O)N2CCO[C@H](OC)C2)c1[N+](=O)[O-] 597541051 QEUQTLKREQXWTJ-VIFPVBQESA-N 296.283 0.476 5 20 CBBD CC1(C)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCN1CCO 619838903 KVBOFWDPHCPHNT-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD CNC(=O)[C@@H](O)CNc1ccc([N+](=O)[O-])c2nonc12 758114635 OKFJZVGCNGUQAT-ZETCQYMHSA-N 281.228 -0.350 5 20 CBBD O=C1CN(C(=O)N=c2cc[nH]cc2[N+](=O)[O-])CCCN1 775697921 RJSVDSYJSDIZTK-UHFFFAOYSA-N 279.256 -0.235 5 20 CBBD O=C(O)C[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCO1 833220365 PXBFIVYCRZHNAA-VIFPVBQESA-N 270.245 -0.076 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](N2CCOC2=O)C1 855501029 RZCSYRNETICIIN-SSDOTTSWSA-N 295.255 -0.015 5 20 CBBD CN(CCCNC(=O)CC(N)=O)c1ccc([N+](=O)[O-])cn1 1095503056 TZDHMMORBLQJFC-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1319652182 RVJMUSYYKYNWQG-MRVPVSSYSA-N 298.255 -0.658 5 20 CBBD NC(=O)C1(O)CCN(c2cccnc2[N+](=O)[O-])CC1 1329716386 FNOQTGQHPPUEMJ-UHFFFAOYSA-N 266.257 -0.194 5 20 CBBD O=C1CC[C@@H](n2cc(C(=O)O)cc([N+](=O)[O-])c2=O)C(=O)N1 1602642509 XACRHWGCAMPKMI-ZCFIWIBFSA-N 295.207 -0.568 5 20 CBBD O=[N+]([O-])c1ccc(N[C@@H]2COC[C@H]2O)c(-c2nn[nH]n2)c1 1607081644 GGWDOAUQJFPNBG-NXEZZACHSA-N 292.255 -0.054 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCC[C@@H]1C(=O)O 1608380221 ITKGRMHSMHIELJ-BQBZGAKWSA-N 283.244 -0.444 5 20 CBBD C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)NC(N)=O 6121900 KORXRLSEMJZMOZ-YFKPBYRVSA-N 296.239 -0.083 5 20 CBBD CCNC(=O)CN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 29529347 OSDRXXKJPVRSIS-UHFFFAOYSA-N 296.331 -0.414 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CCCNC1 178388647 QGXPXMBXHMLMMW-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD O=C(O)[C@@H]1COCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 262465019 IWDIVHYSXZSHPC-VIFPVBQESA-N 298.255 -0.507 5 20 CBBD CCc1nnc(Sc2ncc([N+](=O)[O-])c(N)n2)n1N 268852601 YIPDWLHTBQUWFQ-UHFFFAOYSA-N 282.289 -0.014 5 20 CBBD O=C(N[C@@]1(CCO)CCOC1)c1cc([N+](=O)[O-])[nH]n1 287274065 YKKQAPXCPYTCEO-JTQLQIEISA-N 270.245 -0.411 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CCn2c(O)nnc2C1 331943072 XXMRPUKJUWBHTD-UHFFFAOYSA-N 279.260 -0.359 5 20 CBBD COC(=O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 354857825 XFYLBQYKZMLSMA-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD O=C1CC[C@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])C(=O)N1 360409966 ZQPSKKGUQUZVCG-ZETCQYMHSA-N 293.239 -0.662 5 20 CBBD CC(C)(CCC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 362477493 VDVNUUVXNYDKIR-UHFFFAOYSA-N 285.260 -0.054 5 20 CBBD O=C1CNC(=O)N1CCCn1nccc1[N+](=O)[O-] 428274889 SPIMHVGOVTUXRD-UHFFFAOYSA-N 253.218 -0.267 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OC[C@H]1CNC(=O)O1 495649873 IAKOOPKXHNSAGA-ZCFIWIBFSA-N 282.212 -0.163 5 20 CBBD O=C1CN=C(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)N1 515931247 ULKVYMWATVBRSO-UHFFFAOYSA-N 264.197 -0.484 5 20 CBBD COCC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 548739628 FSVKUEYWIQKTGQ-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD C[C@@H](Cn1cncn1)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 553393492 VOLQHRSAEWAHFR-ZETCQYMHSA-N 291.271 -0.018 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)[C@@H](N)C[C@@H]2C1 584124285 ABXSSGFWJGGGDF-SFYZADRCSA-N 280.288 -0.924 5 20 CBBD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NOCCO 787293352 XICKWJVQPCWLNC-UHFFFAOYSA-N 297.267 -0.245 5 20 CBBD CC(C)OCCONC(=O)Cn1cnc([N+](=O)[O-])n1 795069328 NMTKZMKZHLPCLJ-UHFFFAOYSA-N 273.249 -0.341 5 20 CBBD C[C@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)COC(=O)N1 860993553 HVKSGNCJFMBDCL-JTQLQIEISA-N 284.228 -0.167 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CN1CC(NC(=O)C(F)F)C1 1030037804 BBXWLUZSYOQVSR-UHFFFAOYSA-N 289.242 -0.106 5 20 CBBD NC(=O)C(=O)N1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 1055999279 FMQPGIZHOMEXPX-UHFFFAOYSA-N 296.258 -0.132 5 20 CBBD CCCNC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1112835824 QFZJPFIDTYLTNT-GHMZBOCLSA-N 298.343 -0.678 5 20 CBBD Cc1c(CN)c(NC(=O)Cn2cc([N+](=O)[O-])cn2)nn1C 1328456027 UCMGHWCRTJUPJM-UHFFFAOYSA-N 293.287 -0.069 5 20 CBBD Cc1nncn1CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1339805880 ZSDDSYTXWRIUTI-UHFFFAOYSA-N 279.260 -0.492 5 20 CBBD Cn1cnnc1CCOC(=O)Cn1cc([N+](=O)[O-])cn1 1524739744 CZBBGXAKWPCRGQ-UHFFFAOYSA-N 280.244 -0.294 5 20 CBBD O=[N+]([O-])c1cn([C@H]2CCOC2)nc1-c1nn[nH]n1 1593487120 UZFBFFBGTMBOBQ-YFKPBYRVSA-N 251.206 -0.067 5 20 CBBD O=C(O)CN1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1608748955 DSAAJKKEIPLGIZ-UHFFFAOYSA-N 283.244 -0.840 5 20 CBBD O=C(O)c1cc(C(=O)NOCCO)cc([N+](=O)[O-])c1 1610810092 MWUXOUGUHLJQJO-UHFFFAOYSA-N 270.197 -0.053 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1ccccc1[N+](=O)[O-] 40507802 ZEQIXJUFTMXWQQ-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD COC(=O)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 48484796 IGYXSYFALTUOQE-UHFFFAOYSA-N 289.269 -0.173 5 20 CBBD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NC1CNC1 123482689 WTBSWNTVKZLUFT-UHFFFAOYSA-N 275.261 -0.016 5 20 CBBD C[C@H](C(=O)NC[C@H](O)C(N)=O)c1cccc([N+](=O)[O-])c1 228493147 CSRSYQQTVLCPDU-XVKPBYJWSA-N 281.268 -0.339 5 20 CBBD CC(C)[C@](C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 287909272 OIIOYWKSIMFRRX-NSHDSACASA-N 283.288 -0.193 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@](C)(O)CO)c1[N+](=O)[O-] 338618824 BCBFVQCBSWFRLU-JTQLQIEISA-N 272.261 -0.647 5 20 CBBD CCn1cc(S(=O)(=O)N(C)CCO)c([N+](=O)[O-])n1 339040686 SGSYWPUFBGBJKR-UHFFFAOYSA-N 278.290 -0.576 5 20 CBBD COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 343576438 GTYFAFUEWUXTSY-ZETCQYMHSA-N 283.244 -0.655 5 20 CBBD CCc1[nH]nc(C(=O)NCC(=O)NC2CC2)c1[N+](=O)[O-] 358603257 PKCKTNIJZZUXSP-UHFFFAOYSA-N 281.272 -0.111 5 20 CBBD CNc1nc(C(=O)N2CCN(C)C(=O)C2)ccc1[N+](=O)[O-] 556666597 NAIKDWBHMBJDGD-UHFFFAOYSA-N 293.283 -0.054 5 20 CBBD C[C@](O)(CO)CNc1cc(N)c([N+](=O)[O-])c(CO)c1 588038213 KGFBECXRLZVNFQ-LLVKDONJSA-N 271.273 -0.176 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CCO[C@H]1C(=O)O 595245743 ZUGLEBLQGPIRIX-IONNQARKSA-N 284.228 -0.850 5 20 CBBD C[C@@H](COC(=O)C1CCN(S(N)(=O)=O)CC1)[N+](=O)[O-] 813109216 PSPUCSASQSPVEU-ZETCQYMHSA-N 295.317 -0.890 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H](c2nc[nH]n2)C1 819722695 QYHCYGFGEPVHIA-XLPZGREQSA-N 251.246 -0.214 5 20 CBBD C[S@@](=O)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821943927 YFGSHEGFAPSEAP-HXUWFJFHSA-N 297.300 -0.040 5 20 CBBD O=[N+]([O-])c1ccn(Cc2nc(N3CCNCC3)no2)n1 823335816 YRXHYLJGGOWBMR-UHFFFAOYSA-N 279.260 -0.368 5 20 CBBD CCON(C)C(=O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 845715192 HBKSICYNVNVSLF-UHFFFAOYSA-N 297.271 -0.090 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1ncc([N+](=O)[O-])n1 863374944 GQEIIEMTEHCXDW-ZCFIWIBFSA-N 286.248 -0.953 5 20 CBBD O=C(NCC1CN(CCCO)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1031660832 TXEQVSCZYTUTGC-NXEZZACHSA-N 257.290 -0.918 5 20 CBBD CNC(=O)CC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-] 1093568043 OHLBKRBXRKKCPP-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD C[C@@H]1CN=C(NC(=O)Cn2cnc([N+](=O)[O-])n2)S1 1325905204 YIUROXZTKFPKFX-RXMQYKEDSA-N 270.274 -0.206 5 20 CBBD O=C(NC[C@@H](O)CN1CCCC1=O)c1ccc([N+](=O)[O-])[nH]1 1340752296 WGTVIWVXSXUUIO-MRVPVSSYSA-N 296.283 -0.364 5 20 CBBD O=[N+]([O-])c1cn(CCn2cccn2)nc1-c1nn[nH]n1 1593487423 XJYRXHUOCIFTEU-UHFFFAOYSA-N 275.232 -0.132 5 20 CBBD O=C(N[C@H]1C[C@H](C(=O)O)C1)c1cc([N+](=O)[O-])n[nH]1 1594799721 VBCRUZGCXNVPJE-URHBZAFASA-N 254.202 -0.089 5 20 CBBD CN(CC(N)=O)c1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1604718240 PWFZJBXPALHCPV-UHFFFAOYSA-N 277.244 -0.304 5 20 CBBD O=C1CC[C@@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)N1 1607045346 HVDWRJMRZKBJNA-YFKPBYRVSA-N 278.232 -0.750 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])o1 19274153 NCJXBBROJGMQJN-RITPCOANSA-N 270.197 -0.152 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1CO 42434130 QXFOMDQUVRXAJF-QMMMGPOBSA-N 254.246 -0.225 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](O)[C@@H](O)C1 236602254 BHYMSWXKJLYIEP-IUCAKERBSA-N 288.281 -0.679 5 20 CBBD COC[C@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 280056909 QJLPIQDHGYXVIV-QMMMGPOBSA-N 269.257 -0.086 5 20 CBBD CS(=O)(=O)[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 337418733 SWBBEFVHYIHDCY-JTQLQIEISA-N 288.329 -0.090 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C(=O)N1 538681762 HMOGARNYVIIQTB-SECBINFHSA-N 282.231 -0.191 5 20 CBBD CO[C@H](CN)C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 568393331 SVOAPLAXLCRSLM-LLVKDONJSA-N 280.284 -0.152 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 572899091 SKPUCRIMGUSSPZ-GFCCVEGCSA-N 295.299 -0.632 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCC(=O)N1CCCO1 599088576 GYBSWBTUEUXEFF-UHFFFAOYSA-N 295.255 -0.336 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@@H](O)CO)c(-c2nn[nH]n2)c1 823639678 FPJCJIHRLRBTDV-SSDOTTSWSA-N 280.244 -0.460 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840418051 DQQCKJUTAPLPJH-UTINFBMNSA-N 258.274 -0.350 5 20 CBBD CNCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923361955 PEOGTOTXMURPIB-JTQLQIEISA-N 257.294 -0.697 5 20 CBBD CCC(=O)N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 973756484 DAHAYRHDSLMSAL-BZNPZCIMSA-N 255.274 -0.175 5 20 CBBD O=C(NC1CN(C(=O)c2cc[nH]n2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991279168 JKGBQJFLXFWCRG-VXNVDRBHSA-N 279.256 -0.985 5 20 CBBD COCCCONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1117278490 NSWHFDDLCSWFGG-UHFFFAOYSA-N 285.256 -0.159 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H](C(N)=O)C(C)C)c1[N+](=O)[O-] 1117714033 QRNIBIPBBPQGHH-SSDOTTSWSA-N 283.288 -0.124 5 20 CBBD Cc1noc(CN2CC[C@H](S(N)(=O)=O)C2)c1[N+](=O)[O-] 1327517708 FSYFANHGIGZRTL-ZETCQYMHSA-N 290.301 -0.246 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CC=CC1 1330695695 SBVIECJYSBSEBR-UHFFFAOYSA-N 265.273 -0.221 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCc1nc(N)nc(N)n1 24536551 GGABLJWIKFASOW-UHFFFAOYSA-N 293.243 -0.360 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)N1CCCC1 44686736 LWXHSIILJXQOTM-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 156665496 MZVWDTFRAOODLE-UHFFFAOYSA-N 285.281 -0.109 5 20 CBBD Cc1c(C(=O)NC[C@H](O)C(N)=O)cccc1[N+](=O)[O-] 227865342 BVTOKVNQEZBCIP-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD Cc1cc(C(=O)NC[C@H](O)C(N)=O)cc([N+](=O)[O-])c1 228486719 LCPXACYMYWIDHX-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD Cc1nn(CCC(=O)N(C)CC(N)=O)c(C)c1[N+](=O)[O-] 264019981 XTYLFTZBGWZYQZ-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD COC(=O)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274918790 WXZJYUNCLDMNSW-UHFFFAOYSA-N 269.213 -0.012 5 20 CBBD CN(CC1(O)CCOCC1)c1ncc([N+](=O)[O-])c(N)n1 275804261 KUAWROOQFMYWHA-UHFFFAOYSA-N 283.288 -0.055 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 332739271 YHDIBBFFEHOAHM-SSDOTTSWSA-N 282.256 -0.037 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2C(=O)NCC[C@H]2C)c1[N+](=O)[O-] 443040953 WQBHJKIQBRTZGH-IYSWYEEDSA-N 281.272 -0.119 5 20 CBBD Cn1c(C(=O)N[C@@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 541707680 MJWYIFIQMNCDKO-LURJTMIESA-N 252.230 -0.448 5 20 CBBD CCOC(=O)c1cc(NC(=O)c2c[nH]nc2[N+](=O)[O-])n[nH]1 549201559 LKJCCYZHQCHSSZ-UHFFFAOYSA-N 294.227 0.470 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H](CO)CCF 593655796 BPGBGNSHAWYJPD-SSDOTTSWSA-N 293.276 -0.011 5 20 CBBD COC(=O)[C@@](C)(CO)NCCn1cc([N+](=O)[O-])cn1 595526236 IECJMIMJEZLDCX-SNVBAGLBSA-N 272.261 -0.695 5 20 CBBD CC(C)c1[nH]nc(C(=O)Nn2c(O)nnc2O)c1[N+](=O)[O-] 816731224 GYCSWKSUDPKCFL-UHFFFAOYSA-N 297.231 -0.172 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)C1 840424859 FGGHTEINJIJZNI-GWOFURMSSA-N 271.317 -0.435 5 20 CBBD NC(=O)C1=NO[C@H](CNc2ccnc(O)c2[N+](=O)[O-])C1 853512852 NTEPQKKZMYLRTO-YFKPBYRVSA-N 281.228 -0.263 5 20 CBBD Cn1cc(C[C@@H]2CC(=O)N(CC[N+](=O)[O-])C2=O)cn1 899877988 NDUCMLMMVXMEHV-SECBINFHSA-N 266.257 -0.386 5 20 CBBD CN(CCCNc1ncc([N+](=O)[O-])cc1F)C(=O)C(N)=O 1109601192 LHSNVQRVLMJOBD-UHFFFAOYSA-N 299.262 -0.125 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C(N)=O)C1 1318073193 BRTYWPJVFGXKKU-VIFPVBQESA-N 282.256 -0.740 5 20 CBBD COCCOCCN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 1325493905 CCMMBFDFFQDAEY-UHFFFAOYSA-N 287.276 -0.692 5 20 CBBD NCCc1noc(Cn2cc([N+](=O)[O-])ccc2=O)n1 1349326158 UQBKNGRZPPCTNJ-UHFFFAOYSA-N 265.229 -0.311 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)C1 1606242700 QNLHKGRZLHNTOR-JTQLQIEISA-N 297.315 -0.261 5 20 CBBD COCCNC(=O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 10057468 HUDZUSVJUHBCAK-UHFFFAOYSA-N 296.283 -0.331 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 46825604 MGEXSZGATUMEOR-ZETCQYMHSA-N 269.261 -0.616 5 20 CBBD COCCN(C)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 55341538 GLFUGDVYTJOUSL-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD NC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1N 133606330 WHTXYKZDQAXXKZ-UHFFFAOYSA-N 267.245 -0.425 5 20 CBBD CCN1CCO[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 157005365 GDDONIHIAQETBF-NSHDSACASA-N 297.315 -0.372 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 230753630 WEHAIFKRJANTLP-UHFFFAOYSA-N 293.283 -0.077 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCSC1=O 266098450 JQIPNHKUZKUKKI-QMMMGPOBSA-N 297.292 -0.095 5 20 CBBD COC(=O)[C@H]1CNC(=O)CN1C(=O)c1cc([N+](=O)[O-])c[nH]1 344836259 AMYPWUOAWZJVTO-MRVPVSSYSA-N 296.239 -0.964 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCO[C@@H](CN)C1 358514559 VKIYNKKIXBGWTH-JTQLQIEISA-N 297.315 -0.324 5 20 CBBD COC(=O)C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 364879147 UGMGRGCCXKXQIZ-ZETCQYMHSA-N 297.271 -0.265 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCOCC(N)=O 533562439 AUWMACAWAUPGFR-UHFFFAOYSA-N 270.245 -0.835 5 20 CBBD N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 562964750 RENGAWQKEKGXSE-WDEREUQCSA-N 291.311 -0.014 5 20 CBBD NCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(F)F 564995267 LGPBFGJDUDBZKX-SSDOTTSWSA-N 277.231 -0.110 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCNCC1 570449492 IMTVKUOTIDIVDT-UHFFFAOYSA-N 272.286 -0.416 5 20 CBBD O=C(NC[C@H]1CNCCCO1)c1cc([N+](=O)[O-])n[nH]1 571679902 XYQSJOGQVOQOSD-SSDOTTSWSA-N 269.261 -0.574 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](CO)CN(C)C 588864659 LTCFJBHFTYCSHL-SNVBAGLBSA-N 299.331 -0.471 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCn1cnnc1 596484288 UIEXAAKPUBVIDK-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD CO[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 597541552 URSMQXPOBRATHH-SSDOTTSWSA-N 256.218 -0.237 5 20 CBBD N[C@]12CCC[C@H]1CN(C(=O)Cn1cnc([N+](=O)[O-])n1)C2 598670286 TVCFVRWCSLEROW-KWQFWETISA-N 280.288 -0.474 5 20 CBBD NC(=O)CONC(=O)c1ccc([N+](=O)[O-])c(O)c1 772932465 HIKVLTVODPIIDY-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)OCC1(CO)COC1 781667800 OEDSBJJGJFHYNO-UHFFFAOYSA-N 283.240 -0.262 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCS(=O)(=O)C[C@H]1C1CC1 854809231 PSYDCMCGGBTDQJ-BBBLOLIVSA-N 288.325 -0.313 5 20 CBBD O=C1CN=C(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)N1 918354959 HXYAKGLPAPUZMY-UHFFFAOYSA-N 293.195 -0.281 5 20 CBBD O=C(C[C@H]1CCC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 1118741468 YEGKKLCCPORNBG-MRVPVSSYSA-N 281.272 -0.424 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 1320513247 JLWWVOXVBXFBLV-SNVBAGLBSA-N 269.261 -0.886 5 20 CBBD COC(=O)CN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1332679806 KZEOISYJGGSQSF-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD CONC(=O)CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] 1605143672 BLYYZJHKPXPBTP-UHFFFAOYSA-N 293.243 -0.136 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H](C(N)=O)O1 122593784 FOIZAYJWQZUHNX-PSASIEDQSA-N 283.288 -0.634 5 20 CBBD NC1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCCCC1 237832007 AVUPRTUGDGMHND-UHFFFAOYSA-N 282.304 -0.036 5 20 CBBD C[C@H]1C[C@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262110494 ZZWFODCPXIXAMR-VHSXEESVSA-N 294.311 -0.048 5 20 CBBD CS(=O)(=O)C1(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285970533 OFTPRMCYUYYUFQ-UHFFFAOYSA-N 288.285 -0.375 5 20 CBBD COC[C@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 338455316 VFUSKYDJOPGTNI-SECBINFHSA-N 287.276 -0.902 5 20 CBBD O=C(N[C@@H]1CCCCNC1=O)c1n[nH]cc1[N+](=O)[O-] 343097461 IKARPUYPASQLKF-ZCFIWIBFSA-N 267.245 -0.284 5 20 CBBD CN1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 353560509 IEJQGRXKCHZUCV-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD O=C(NC[C@H](O)C(F)F)c1cc([N+](=O)[O-])n[nH]1 354059764 WLFBXSGCEVCHMK-BYPYZUCNSA-N 250.161 -0.326 5 20 CBBD CN1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C(=O)N1 537579722 BQPUCIRYDRRIHD-JTQLQIEISA-N 278.268 -0.401 5 20 CBBD NC(=O)[C@@H](O)CNCCC(=O)Nc1ccccc1[N+](=O)[O-] 577221270 KPXUBADIHSMBPX-JTQLQIEISA-N 296.283 -0.641 5 20 CBBD COCCN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 580060746 NZLGQOOFBJSGJY-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD C[C@H]1[C@@H](C)NCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 581370841 DQTYQVICKUMNBV-ZJUUUORDSA-N 294.311 -0.035 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 600836772 BVRXCADHLLVINE-SSDOTTSWSA-N 299.239 -0.651 5 20 CBBD CC(C)C1(O)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 773895345 IFNCZYIZZOBFSI-LLVKDONJSA-N 284.316 -0.145 5 20 CBBD CC(CO)(CO)CNC(=O)c1cc([N+](=O)[O-])ccc1N 820487497 NWYGDCQBECAGCR-UHFFFAOYSA-N 283.284 -0.102 5 20 CBBD CO[C@@H]1COCC[C@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783667 JZDXGELBDKKLQV-SGIHWFKDSA-N 258.274 -0.181 5 20 CBBD CCOCC(=O)N(CC)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1079249281 AAOOYVFEHDQXTA-GHMZBOCLSA-N 299.327 -0.253 5 20 CBBD CS(=O)(=O)CCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1326218066 JGSBNUPLZZVWII-HTQZYQBOSA-N 264.303 -0.407 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2CCCN(C)C2=O)c1[N+](=O)[O-] 1329162519 VCXATJNSXTWLRN-MRVPVSSYSA-N 295.299 -0.013 5 20 CBBD CCOC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1339257317 LRKPXXLHYQJIGT-MRVPVSSYSA-N 285.256 -0.747 5 20 CBBD CO[C@@H]1CNC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 1579123763 SFWHHYLNBXAATE-IYSWYEEDSA-N 255.234 -0.966 5 20 CBBD CNc1nccc(C(=O)NCC(=O)O)c1[N+](=O)[O-] 1593804624 POIWXVCTHYNBPF-UHFFFAOYSA-N 254.202 -0.154 5 20 CBBD C[C@H]1OCCN(CCn2cc([N+](=O)[O-])cn2)[C@@H]1C(=O)O 1777411456 RATYJMZZDMRXEM-SCZZXKLOSA-N 284.272 -0.035 5 20 CBBD Cc1nn(C)c(N2CCO[C@H](CO)C2)c1[N+](=O)[O-] 94267295 DNQZLWIIFRWKEG-QMMMGPOBSA-N 256.262 -0.166 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCN1 178738634 NZACEIXVKVJPBW-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD COCCNCCNC(=O)c1ccc([N+](=O)[O-])n1C 212743324 WFMOTTVLUXSAOW-UHFFFAOYSA-N 270.289 -0.101 5 20 CBBD NC(=O)[C@@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 247475089 JOPJPZIPFSHDCK-UWVGGRQHSA-N 283.288 -0.898 5 20 CBBD COC(=O)[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H](C)O 274445659 ICNZBPVPOMUUIK-QUBYGPBYSA-N 297.267 -0.171 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)CO 293941325 JBAVGBAPKXUTER-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD Nc1nc(N2CCC[C@]3(CNC(=O)C3)C2)ncc1[N+](=O)[O-] 361173036 ZLVHVZHIMVLLEC-LBPRGKRZSA-N 292.299 0.074 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H]2CCO)c1 426257370 VPZJLVZWIISJRA-CMPLNLGQSA-N 284.316 -0.001 5 20 CBBD CNS(=O)(=O)[C@@H]1CCN(c2ncc([N+](=O)[O-])cn2)C1 544846525 UOAZOAUIFBMNSZ-MRVPVSSYSA-N 287.301 -0.487 5 20 CBBD CC(C)N1C(=O)C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548748084 NYWRFRUQHXDZSF-SSDOTTSWSA-N 295.255 -0.416 5 20 CBBD CNCCCC(=O)NCCn1cc([N+](=O)[O-])cn1 582604683 VGWKSUFEZWNDPN-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD CC(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 584175378 VZQOIOWYXNLDKW-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)N1 593412578 LGTWPIIWJPXUBE-SNVBAGLBSA-N 299.308 -0.097 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CCC1=O 596493958 RZWAOMMCHCYJQI-UHFFFAOYSA-N 266.261 -0.365 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1CO 598909274 IAMBZHZQHGRLJS-BDAKNGLRSA-N 283.288 -0.337 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1nn[nH]n1 801891112 TWBKDEOUYIMVIL-UHFFFAOYSA-N 281.207 -0.241 5 20 CBBD Cn1ncc(COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1 802973762 LSJQDGAUUOFMHE-UHFFFAOYSA-N 293.239 -0.372 5 20 CBBD O=C(O)[C@H]1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 833188896 JTBLLPQIBMAMPA-GXSJLCMTSA-N 298.299 -0.051 5 20 CBBD COC(=O)N(C)CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 855942507 UOLXCXNOTIHNQT-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 863017195 PBSPRYNRERCBAG-ZETCQYMHSA-N 298.255 -0.774 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@]3(CCCN3)C2)c1 923380114 MNIHFTXBEOJMFV-QWHCGFSZSA-N 295.343 -0.020 5 20 CBBD CNC(=O)CC(=O)NCCNc1ncc([N+](=O)[O-])cc1C 1093568368 YXULSBPNOPQTFM-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD NC(=O)C(=O)NCCCNc1ccc([N+](=O)[O-])cc1 1094742345 TZMLLUINMPYETE-UHFFFAOYSA-N 266.257 -0.002 5 20 CBBD COCC(=O)N[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1 1097143319 OYIXKROIMISACD-KNVOCYPGSA-N 296.287 -0.328 5 20 CBBD CCN(C)C(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1320406279 CIWSBKDKIHBDOH-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD CCNC(=O)NCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1324360295 SUXAHWGCGAUFGD-UHFFFAOYSA-N 298.303 -0.314 5 20 CBBD CCONC(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1326564838 QFQPRSWNEDDGKV-UHFFFAOYSA-N 271.233 -0.874 5 20 CBBD CCN[C@H](C)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1349417484 GDSARISKPJNCMU-SECBINFHSA-N 282.300 -0.129 5 20 CBBD C[C@H]1CN(C)C(=O)CN1c1nnc([C@@H](C)[N+](=O)[O-])n1C 1355414476 CSAUIIUVBDNEEI-JGVFFNPUSA-N 282.304 -0.180 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)C[C@H](C)N 1579877206 CTMICBAWAJJWGV-ZETCQYMHSA-N 255.278 -0.095 5 20 CBBD COC(=O)C(=O)[C@@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591226054 KDQXFLNMPZSZKL-SCSAIBSYSA-N 295.215 -0.726 5 20 CBBD COc1cc(CN[C@@H](CO)C(=O)O)c([N+](=O)[O-])cc1O 1777301063 QCURLRXAAKIXAC-ZETCQYMHSA-N 286.240 -0.156 5 20 CBBD COC(=O)[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 63604958 VJXRENVPKBCXMH-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1C(=O)O 111248047 VSRGCRCMCSRHSK-HTQZYQBOSA-N 282.256 -0.030 5 20 CBBD CC1(C)[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 128544497 ZFBPEIJYJDYRFR-GARJFASQSA-N 284.316 -0.099 5 20 CBBD Cc1nn(CC(=O)N[C@H](C)C(=O)N(C)C)cc1[N+](=O)[O-] 181822977 OUSYSCATJPGODD-MRVPVSSYSA-N 283.288 -0.307 5 20 CBBD NC(=O)OCCNC(=O)c1cc([N+](=O)[O-])cnc1N 230721582 PMWZWQOZSRDLPQ-UHFFFAOYSA-N 269.217 -0.603 5 20 CBBD CNCCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 237296198 NGUPKEATVMMQGF-UHFFFAOYSA-N 268.273 -0.566 5 20 CBBD CCN1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1=O 332711776 YUUQCGGNSFMYFJ-UHFFFAOYSA-N 253.218 -0.420 5 20 CBBD Nc1nc(NC[C@@H](O)[C@H]2CCOC2)ncc1[N+](=O)[O-] 346435953 WHKYLJARYQFQJL-POYBYMJQSA-N 269.261 -0.224 5 20 CBBD CN(C)C(=O)Cn1ccc(Nc2ncc([N+](=O)[O-])cn2)n1 354588580 AAMZKSLEIOKVTJ-UHFFFAOYSA-N 291.271 0.413 5 20 CBBD Nc1nnc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)o1 354849158 XRQIZMNKJGJERL-UHFFFAOYSA-N 252.190 -0.182 5 20 CBBD Cn1cncc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 356752949 DJBMWUZVNZEDML-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD CCN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H](C)C1=O 426344862 KGQGZVOPDWXLTL-SECBINFHSA-N 295.299 -0.130 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc([N+](=O)[O-])ccc1O 436950685 QBOGWBYQUNJTPW-QMMMGPOBSA-N 270.241 -0.274 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CO)[C@H](O)C1 547403081 ZQVMNHCSIPNJKP-LDYMZIIASA-N 283.284 -0.251 5 20 CBBD Cn1c(NCCn2cc([N+](=O)[O-])cn2)cc(=O)n(C)c1=O 596166918 ZCDXBGGKRCPKCY-UHFFFAOYSA-N 294.271 -0.699 5 20 CBBD CCOC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 600410548 JSOPQLZUSSGSMI-VIFPVBQESA-N 299.287 -0.550 5 20 CBBD CN(C[C@H](O)CO)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 823955948 LIGQVBPJDXDPGO-QMMMGPOBSA-N 284.272 -0.006 5 20 CBBD CNC(=O)C1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 829516181 RKOKIFTVTRZTIR-NSHDSACASA-N 293.279 -0.167 5 20 CBBD CCC(=O)N1CCOC2(C1)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 965245015 HXMUHKIWJOHMEL-NXEZZACHSA-N 297.311 -0.499 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cn1)c1cnn[nH]1 1094242768 GKGQIACQANYSRG-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)N1CCCCO1 1117605211 XHWSDSWZXDYVSF-UHFFFAOYSA-N 297.271 -0.539 5 20 CBBD CC(C)n1nnnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932089 HXCQHTQCLPQTHB-RKDXNWHRSA-N 297.319 -0.875 5 20 CBBD NC1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCC1 1261494805 FYZXGFXPAOKVLF-UHFFFAOYSA-N 254.250 -0.816 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OC[C@H]1CCOC1 1317959914 YKAGCKJZTXNRRJ-ZETCQYMHSA-N 256.218 -0.234 5 20 CBBD COc1cccc(C(=O)NCCOCC(N)=O)c1[N+](=O)[O-] 1320807226 DFCBCHSWIUMBMX-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD O=C1CN(c2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CCN1 1593398879 LOTCVSRENSQIGX-UHFFFAOYSA-N 289.255 -0.289 5 20 CBBD C[C@@](CO)(NC(=O)CNc1ccccc1[N+](=O)[O-])C(=O)O 1604190376 GZCBPBSERSZHHV-LBPRGKRZSA-N 297.267 -0.042 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](O)CC(=O)O 1607984867 NIAAXNNJTCDFCQ-SSDOTTSWSA-N 286.244 -0.948 5 20 CBBD C[C@@H](O)CN1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 189401196 JNDKXCGIXZOKQX-LLVKDONJSA-N 283.332 -0.210 5 20 CBBD C[C@]1(O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 225179249 XAFJRIVWLZUHQU-JTQLQIEISA-N 254.246 -0.225 5 20 CBBD O=C(O)c1cnc(NC[C@H](O)CO)c([N+](=O)[O-])c1 236494489 RZTNJSCZAOROHN-LURJTMIESA-N 257.202 -0.547 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337799514 YCKBVGDQJPQOGK-MUWHJKNJSA-N 281.272 -0.417 5 20 CBBD Nc1nc(=NCCN2CCSCC2)[nH]cc1[N+](=O)[O-] 352324131 FHQRZDOAFKTWDX-UHFFFAOYSA-N 284.345 -0.150 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 436676623 RGELKAFUDHDAOH-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD O=C(O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CCO1 567056298 MOYCWZDKPZEJHG-SECBINFHSA-N 281.224 -0.085 5 20 CBBD Cc1noc(CN(C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 594054033 TVANFYOCUSVBMA-JTQLQIEISA-N 296.287 -0.024 5 20 CBBD CCc1[nH]nc(C(=O)NCCN2CC[C@@H](O)C2)c1[N+](=O)[O-] 600531246 GEBAQHCHRCPPNB-MRVPVSSYSA-N 297.315 -0.323 5 20 CBBD O=C(NCc1cnn[nH]1)C(=O)Nc1cccc([N+](=O)[O-])c1 615164478 AWWDJDQUZSLWKF-UHFFFAOYSA-N 290.239 -0.032 5 20 CBBD COC[C@@](C)(O)C(=O)OCCn1cc([N+](=O)[O-])cn1 748130128 VTHILLKWCLOBGH-SNVBAGLBSA-N 273.245 -0.268 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCC(=O)N1CCOCC1 766638162 FPVNCABKUPCKKP-UHFFFAOYSA-N 298.255 -0.656 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H](C)c1nnnn1C 787670122 FTLJFQSKLXRWKQ-ZCFIWIBFSA-N 295.259 -0.072 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@]3(CCCN3)C2)c1 923380112 MNIHFTXBEOJMFV-OLZOCXBDSA-N 295.343 -0.020 5 20 CBBD O=C(NC1CN(C(=O)c2cc(F)c[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991289877 GUWMHSYHBKSGLX-PSASIEDQSA-N 296.258 -0.240 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnns2)C1 1042711431 SYCCRILZTNIDDE-NXEZZACHSA-N 297.340 -0.154 5 20 CBBD Cc1nn(C)c(C(=O)NC2(C(=O)O)CC2)c1[N+](=O)[O-] 1116491956 QMGUBUSJQZZOAM-UHFFFAOYSA-N 268.229 -0.016 5 20 CBBD O=CN1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1117773517 SHGQJNBRIIDKRP-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CC(C)(CCC(=O)N1C[C@@H](CO)[C@H](CO)C1)[N+](=O)[O-] 1329200772 HDTOJZWZDMGQDF-UWVGGRQHSA-N 274.317 -0.119 5 20 CBBD CN(CCO)c1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1604778883 YPRSKPAIUSNROB-UHFFFAOYSA-N 265.233 -0.402 5 20 CBBD COC(=O)[C@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 35220818 ASORFXZZCIJWGE-SECBINFHSA-N 282.256 -0.045 5 20 CBBD O=C(NCCCN1CCNCC1)c1ccc([N+](=O)[O-])[nH]1 35307409 YHWUYHZKJVIYLL-UHFFFAOYSA-N 281.316 -0.052 5 20 CBBD O=C(NCCCN1CCNCC1)c1cc([N+](=O)[O-])c[nH]1 35307426 LZLKFRFEAHFSIQ-UHFFFAOYSA-N 281.316 -0.052 5 20 CBBD O=C(CCc1cccc([N+](=O)[O-])c1)NC(CO)CO 119584691 OQEHLQAHXZIJNC-UHFFFAOYSA-N 268.269 -0.003 5 20 CBBD CN(C)C(=O)CN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 123849527 UOEAXOWITMKYGS-UHFFFAOYSA-N 283.288 -0.272 5 20 CBBD N[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 178323271 GEINCBOFPVVOOY-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD CC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 293692774 MMSPWLQSGNKQGH-VIFPVBQESA-N 269.257 -0.356 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[C@@H](CO)O1 293739057 SEHUYGYKGAUSNR-MNOVXSKESA-N 298.299 -0.163 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)CO 305123999 CFOQFJLYJUSFSO-ZETCQYMHSA-N 256.262 -0.013 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCNC1=O 340449063 CUAWTKDPKKTPIY-SECBINFHSA-N 294.267 -0.897 5 20 CBBD O=C(O)c1cnc(N2CC[C@@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 396795560 DUOGSHHRZGVFRU-PSASIEDQSA-N 297.267 -0.133 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CN(C)NC1=O 427719734 CULXZQZIEHUTEF-SECBINFHSA-N 294.267 -0.322 5 20 CBBD O=C(NC[C@H](O)[C@H]1CCOC1)c1cnc(O)c([N+](=O)[O-])c1 445008150 PWPUSMRMQVVOFH-XVKPBYJWSA-N 297.267 -0.177 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)c3c[nH]nc3[N+](=O)[O-])C[C@@H]21 599992214 UHKAZJIOGIGYCX-BRPSZJMVSA-N 265.273 -0.050 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 619788144 HVJMNKLOUOVJMV-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)Cn2cnc([N+](=O)[O-])c2)c1 743259326 XBONTOJYHIALCV-QMMMGPOBSA-N 282.216 -0.043 5 20 CBBD CC(C)N1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839684406 VFFVCUZYVZYJJO-IWSPIJDZSA-N 255.274 -0.223 5 20 CBBD CC(C)(COC(=O)[C@H]1CCS(=O)(=O)N1)[N+](=O)[O-] 851129601 KVKCUEPBRQXBED-ZCFIWIBFSA-N 266.275 -0.723 5 20 CBBD CC(C)[C@H](CO)ONC(=O)c1c[nH]nc1[N+](=O)[O-] 857286254 VZZGRWINYOHCJS-ZETCQYMHSA-N 258.234 -0.004 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2cnns2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020140026 VBSFHCZTAZWXAO-KHUVANEUSA-N 297.340 -0.060 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])cn2)C1 1068574510 PBIXYCRVTURHAU-ZKCHVHJHSA-N 293.283 -0.218 5 20 CBBD CCCOCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093511726 BBISQVNEHRVQMT-UHFFFAOYSA-N 298.303 -0.078 5 20 CBBD CN1CC[C@H](COC(=O)Cn2cnc([N+](=O)[O-])n2)C1=O 1263519309 HMBNMKLULRJFCX-SSDOTTSWSA-N 283.244 -0.792 5 20 CBBD CCc1[nH]nc(C(=O)NCc2nncn2C)c1[N+](=O)[O-] 1324653597 DVBMXZWHBUXXRN-UHFFFAOYSA-N 279.260 -0.061 5 20 CBBD Cc1cc(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)nn1C 1340601616 NOYVYNIQQGVGBN-UHFFFAOYSA-N 291.267 -0.054 5 20 CBBD O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1N1CC(O)C1 1593476604 ZDMQMCXASDBEBW-UHFFFAOYSA-N 262.229 -0.044 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601759026 WZLIJCWYNPNLBO-SVRRBLITSA-N 284.228 -0.632 5 20 CBBD Nc1ccc(C(=O)NCCS(N)(=O)=O)cc1[N+](=O)[O-] 48446566 CTDCPEPPABGQEE-UHFFFAOYSA-N 288.285 -0.805 5 20 CBBD COCCOC(=O)Cn1cc([N+](=O)[O-])ccc1=O 71515167 JKJRFHASHFSVRD-UHFFFAOYSA-N 256.214 -0.054 5 20 CBBD C[C@@H]1C(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C(=O)[C@@H]1C 176630334 XMANCOFWGLSFCC-KHQFGBGNSA-N 296.283 -0.207 5 20 CBBD O=C1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CN1C1CC1 279198498 USZMIFIVHSVIAP-LLVKDONJSA-N 295.299 -0.584 5 20 CBBD CN(CC1(O)CCC1)C(=O)Cn1cnc([N+](=O)[O-])n1 331610712 PGUUGGUMPRITOE-UHFFFAOYSA-N 269.261 -0.440 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1COC[C@@H]1O 342504703 WLNHFBSRQJEJOQ-BDAKNGLRSA-N 282.256 -0.596 5 20 CBBD Cc1cnc(NCC(=O)NCCO)c([N+](=O)[O-])c1 347223840 KHVDCWYWSCNCMY-UHFFFAOYSA-N 254.246 -0.181 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])o1 358902458 JWEJEZILAPDKIR-SNVBAGLBSA-N 272.213 -0.158 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N(CCO)C1CC1 360753907 JRVAYYIOSMBHJH-UHFFFAOYSA-N 254.246 -0.075 5 20 CBBD Cc1cc([N+](=O)[O-])c[nH]c1=NCCc1nc(N)n[nH]1 590567576 OITMIKINTAMJCF-UHFFFAOYSA-N 263.261 0.075 5 20 CBBD Nc1nccc(C(=O)NCC[C@]2(O)CCOC2)c1[N+](=O)[O-] 594375585 DAZBPXNNPIWPDE-LBPRGKRZSA-N 296.283 -0.157 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CO)C1CC1 771034893 PAZZQWZYRNOEFT-SECBINFHSA-N 268.273 -0.013 5 20 CBBD O=C(O)C[C@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 833222854 DAKDIKQSRYOQBU-SSDOTTSWSA-N 297.227 -0.814 5 20 CBBD CC[C@@H](OC(=O)c1ccnc(N)c1[N+](=O)[O-])C(N)=O 848786871 KLAMLBPIZTUUQZ-ZCFIWIBFSA-N 268.229 -0.007 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2ccon2)C1 1042705187 LGPJDCJTCFLQHO-GHMZBOCLSA-N 280.284 -0.018 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)C(N)=O)n1 1100294862 SSJCHPOOFBLHSI-UHFFFAOYSA-N 281.272 -0.664 5 20 CBBD Cc1ncc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126936229 BWDYSWGTEVVWCJ-GHMZBOCLSA-N 279.300 -0.344 5 20 CBBD Cc1nonc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157761396 QVSSOKWDIGIZGF-PSASIEDQSA-N 283.288 -0.361 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H](O)C1CC1 1319864320 SPEJBGPAVOIBML-QMMMGPOBSA-N 254.246 -0.171 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC(CO)CO 1321011090 QTSLZVSMJMCITO-UHFFFAOYSA-N 288.231 -0.418 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCn2cncc2C1 1327709071 QENUVJINUUVDLP-UHFFFAOYSA-N 277.244 -0.575 5 20 CBBD O=C(N[C@]1(C(=O)O)C[C@H](O)C1)c1ccc([N+](=O)[O-])o1 1601579062 SNTGFZVBFIZPOA-LNCKLZMNSA-N 270.197 -0.104 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1601752040 OGRMOQGDOKOUHU-RQJHMYQMSA-N 284.228 -0.632 5 20 CBBD CCNC1CCN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1754848596 MFNLDCISSNQXDR-VXGBXAGGSA-N 284.360 -0.158 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 28443094 QJCZQTFCROWHEM-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD Cn1c(C(=O)N2CCOC[C@H]2C(=O)O)ccc1[N+](=O)[O-] 88373460 KHBIXYXXADPRFV-QMMMGPOBSA-N 283.240 -0.141 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(O)CCOCC1 91438363 XTQDRBAWZUTXFN-UHFFFAOYSA-N 284.272 -0.551 5 20 CBBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C(N)=O 134873644 LPFNIIUPLCPMHT-RXMQYKEDSA-N 252.230 -0.219 5 20 CBBD O=C1NC[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN12 175934514 AATYJRQLTFQVLT-VIFPVBQESA-N 280.288 -0.499 5 20 CBBD C[C@H](O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247525560 NTJYTNGCEUJWMW-WCBMZHEXSA-N 258.278 -0.535 5 20 CBBD CNC(=O)[C@@H](C)CN(C)c1ncc([N+](=O)[O-])c(N)n1 267138178 XGHDFNMBKZCZFS-LURJTMIESA-N 268.277 -0.215 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 274422761 ONYCTBKOVZOXNH-ZJUUUORDSA-N 298.299 -0.210 5 20 CBBD Cc1cc(OCC(=O)NOCC(N)=O)ccc1[N+](=O)[O-] 280947975 ZUYASERSJWWMGN-UHFFFAOYSA-N 283.240 -0.185 5 20 CBBD COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 281244881 DEPCQJLAYLIWOJ-SSDOTTSWSA-N 285.256 -0.177 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H]1COC[C@@H]1O 342432506 KMDVCEAAFPFAID-BDAKNGLRSA-N 283.240 -0.473 5 20 CBBD O=[N+]([O-])c1ccc2nc(N3C[C@H](O)[C@@H](O)C3)nc(O)c2c1 343205860 MHSDCUIMSCLVOI-UWVGGRQHSA-N 292.251 -0.215 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] 345205762 VTFRGUUWMYEIKH-SNVBAGLBSA-N 298.251 -0.133 5 20 CBBD NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c[nH]1 353933595 NQHGCTNEYPHEJV-UHFFFAOYSA-N 264.201 -0.003 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)N1CCOCC1 356498563 QTMSVULXVQTENT-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1Nc1ccn(CC(N)=O)n1 360952600 DBHYFJXZDDNXRW-UHFFFAOYSA-N 293.287 0.545 5 20 CBBD Cn1nnc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)n1 362850159 JYEXNOVRWCWDOO-UHFFFAOYSA-N 278.232 -0.776 5 20 CBBD CO[C@H](CN)CC(=O)NCCn1cc([N+](=O)[O-])cn1 565595983 FKQQJQPWPYELTC-VIFPVBQESA-N 271.277 -0.729 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)CCn1cc([N+](=O)[O-])cn1 568091306 RQOOJBNGECJKIM-NXEZZACHSA-N 284.272 -0.289 5 20 CBBD CCn1cc(S(=O)(=O)N(C)CCCN)c([N+](=O)[O-])n1 580324669 AZPSKAPUKLXJNS-UHFFFAOYSA-N 291.333 -0.220 5 20 CBBD COC[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])OC 594341713 RPUXFAHZSQGXBA-ZETCQYMHSA-N 284.272 -0.037 5 20 CBBD CN1CC[C@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)CC1=O 749078886 JDXPHUKOEWYVPJ-QMMMGPOBSA-N 297.271 -0.402 5 20 CBBD C[C@H](NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)C(N)=O 780299754 WOUGOZNJHKPKJE-ZETCQYMHSA-N 291.267 -0.066 5 20 CBBD O=C1CC[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C(=O)N1 798606133 OCHKLLQSVXSYEM-MRVPVSSYSA-N 296.239 -0.470 5 20 CBBD COCCN(C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839526014 BPFDACVCVYEWNV-NXEZZACHSA-N 259.306 -0.264 5 20 CBBD NCCN(Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H](O)CO 852753430 AXKXRRCPZHOFOK-LLVKDONJSA-N 287.291 -0.152 5 20 CBBD C[C@@H](CN1CCN(C)CC1)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1253825851 RGOZDGNWLPTURZ-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD COC(=O)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1337685281 AHXKSZINCRAICC-UHFFFAOYSA-N 270.245 -0.070 5 20 CBBD O=[N+]([O-])c1cnn(CCN[C@]2(CO)CCCNC2)c1 1580876890 YSNHICUJNMMKLN-LLVKDONJSA-N 269.305 -0.505 5 20 CBBD CN(CCNC(=O)c1ccc([N+](=O)[O-])cn1)CC(=O)O 1606133136 KDUYXMDBFSIQCU-UHFFFAOYSA-N 282.256 -0.264 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1F 38102932 BKANZPJCZMQQOZ-SECBINFHSA-N 286.215 -0.002 5 20 CBBD COC[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)OC 273053670 XPSWEOMLLHJILZ-MRVPVSSYSA-N 272.261 -0.431 5 20 CBBD CN1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 298688727 CMPAOWMNXCYADM-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD CCOc1ccc(C(=O)N[C@@H](CO)C(N)=O)cc1[N+](=O)[O-] 341736835 LTVLZUQIFAEUHT-QMMMGPOBSA-N 297.267 -0.431 5 20 CBBD O=C(NC[C@@H]1CC[C@H](CO)O1)c1cc([N+](=O)[O-])n[nH]1 349696853 RAZRBQDYXPOKHM-NKWVEPMBSA-N 270.245 -0.412 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CS(=O)(=O)CCO1 351507115 XPAAIJIDYZVNTH-SSDOTTSWSA-N 290.301 -0.446 5 20 CBBD CCC(=O)N1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 355107550 CKRQKRHWMFJVDK-SECBINFHSA-N 295.299 -0.082 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 361035347 AZOTXQMAESRDFV-LURJTMIESA-N 255.234 -0.829 5 20 CBBD NC(=O)[C@H]1CC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 580568797 PQRVMRUKYJWNPK-IUCAKERBSA-N 281.272 -0.581 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1[C@H]2CC[C@H]1CNC2 595991810 LIOZJYSMEDPHMS-IUCAKERBSA-N 265.273 -0.246 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)NC(=O)[C@@H]3C2)c1[N+](=O)[O-] 611509878 IKVFXEUWRBIWHJ-ZETCQYMHSA-N 294.271 -0.623 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@@H](O)C(=O)NC)c1[N+](=O)[O-] 763721951 CLDQSAHRWPYGGN-SSDOTTSWSA-N 299.287 -0.893 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 804357069 WIAGGFKDRWGJDK-ZETCQYMHSA-N 287.659 -0.176 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1 923285411 BJAWIUBBGPUIBC-ONGXEEELSA-N 269.305 -0.554 5 20 CBBD CC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1 1093455430 IVJNBSUNKYVCRI-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD CN(C[C@H]1COCCO1)c1nnc(C[N+](=O)[O-])n1C 1121392607 VEOUJIXTKOJHOR-QMMMGPOBSA-N 271.277 -0.557 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 1336289180 FDUFKMJDHKSVET-LURJTMIESA-N 288.285 -0.423 5 20 CBBD C[C@H](/C=C/C(=O)O)NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1592202264 SXRCBDUCIRTSQV-UFUPEUMYSA-N 295.251 -0.098 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)CC(=O)O 1600748417 QDWAJOPQEOSPLS-QMMMGPOBSA-N 283.240 -0.136 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1c1ncc([N+](=O)[O-])c(N)n1 129987587 SXTUWEBTNJZEPT-JGVFFNPUSA-N 283.288 -0.057 5 20 CBBD C[S@@](=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 158092936 KARDUUPJHDACBC-YYSFKGJASA-N 276.318 -0.880 5 20 CBBD CCNC(=O)CN(CC)C(=O)c1n[nH]cc1[N+](=O)[O-] 159703801 DOAVTKAVZWQOGF-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD CC(C)(CNC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230753616 LIBFQKHSGJFLQU-UHFFFAOYSA-N 281.272 -0.187 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 264265366 VERVFDMRSWUHSC-MRVPVSSYSA-N 294.267 -0.897 5 20 CBBD NC(=O)CONC(=O)CCNc1ccccc1[N+](=O)[O-] 271386639 KMNHDSKGZIGBJS-UHFFFAOYSA-N 282.256 -0.070 5 20 CBBD CCCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])nn1C 346883596 RLSFMIPKECMLDO-UHFFFAOYSA-N 269.261 -0.334 5 20 CBBD CNCCCNS(=O)(=O)c1cccnc1[N+](=O)[O-] 519830609 WYYBDJGBCDMBMD-UHFFFAOYSA-N 274.302 -0.122 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548937399 FDAUURWVFMTCFO-SSDOTTSWSA-N 267.245 -0.379 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1n[nH]cc1[N+](=O)[O-] 592468518 BAXLWDNHJIAJOZ-UHFFFAOYSA-N 282.304 -0.705 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 592477201 SLURAZXATHXFNB-PSASIEDQSA-N 283.288 -0.634 5 20 CBBD C[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@H]1O 594334602 DEYSARYADLQBBS-HTRCEHHLSA-N 266.257 0.025 5 20 CBBD COC(=O)c1ccnc(N2C[C@@H](O)[C@@H](CO)C2)c1[N+](=O)[O-] 598629051 BFRNTEONNGPMEN-VXNVDRBHSA-N 297.267 -0.434 5 20 CBBD O=C1NC[C@@H]2CN(c3ccc([N+](=O)[O-])s3)CCN2C1=O 610864663 XDAHORDJYIMHPG-SSDOTTSWSA-N 296.308 -0.197 5 20 CBBD O=Cc1ccc(OCC(=O)N2CC(O)C2)c([N+](=O)[O-])c1 765855920 HYQKYHWADGYYHV-UHFFFAOYSA-N 280.236 -0.011 5 20 CBBD CC(C)(C)C(=O)NCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839619494 XPGICCAHRQHYEH-HTQZYQBOSA-N 257.290 -0.070 5 20 CBBD Nc1nccc(C(=O)NN2CCCNC2=O)c1[N+](=O)[O-] 847675948 GKHMXHXCEMIOPI-UHFFFAOYSA-N 280.244 -0.368 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc(F)c[nH]1 996214925 QLMPBBLRJQXTRZ-PSASIEDQSA-N 296.258 -0.240 5 20 CBBD NC(=O)C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 1055999548 VQESRSDUKILLTD-UHFFFAOYSA-N 279.256 -0.876 5 20 CBBD CNC(=O)CC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093567800 GLTWJNPTBLQSRK-UHFFFAOYSA-N 281.272 -0.346 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](C)CS(C)(=O)=O)c1[N+](=O)[O-] 1116059551 COUOVHJTUFVGEY-YFKPBYRVSA-N 290.301 -0.211 5 20 CBBD O=C(NC1(CCO)CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1300543867 XONNZUHDZGDLKT-RKDXNWHRSA-N 258.274 -0.301 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](CO)[C@H](CO)C1 1329077272 AUPXOUQDGVNBCG-IUCAKERBSA-N 295.295 -0.150 5 20 CBBD Cc1nc(N2CC[C@@](O)(C(=O)O)C2)ncc1[N+](=O)[O-] 1777509329 CMYLKHCZCAFXCN-JTQLQIEISA-N 268.229 -0.281 5 20 CBBD CC(=O)NC[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 172169121 XPKNMKPKHSVSDE-SNVBAGLBSA-N 283.288 -0.414 5 20 CBBD CNC(=O)CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 226387720 RBUQDCDPYWTVBS-UHFFFAOYSA-N 291.260 -0.242 5 20 CBBD CCCNCCNC(=O)Cn1ccc([N+](=O)[O-])n1 236775342 IUKJOJSSTAJXGD-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H](O)CN1 262471586 ZCNZSNXHUXZASZ-GHMZBOCLSA-N 279.296 -0.024 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](C)O 276235451 NRJKBKBZEPMLLJ-QUBYGPBYSA-N 297.267 -0.171 5 20 CBBD C=CC(=O)NCCNC(=O)c1n[nH]c(CC)c1[N+](=O)[O-] 278447196 GMPMSSPALYLOKZ-UHFFFAOYSA-N 281.272 -0.088 5 20 CBBD C[C@@H](C(=O)N[C@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1F 341732397 PWBOTANCGWDLNE-LHLIQPBNSA-N 299.258 -0.200 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1COC[C@H]1O 342411298 BUZXQWJJYRYMCO-VHSXEESVSA-N 298.299 -0.292 5 20 CBBD Cn1cc([C@@H](CO)NC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 354510400 ZLDCREKDDKBVLV-MRVPVSSYSA-N 280.244 -0.485 5 20 CBBD CC(C)(C(=O)NCCn1ncnn1)n1cc([N+](=O)[O-])cn1 433927991 WBKAMZLMECHSFP-UHFFFAOYSA-N 294.275 -0.671 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@@H](CO)C1 494729092 PPOLZNQUCQBMTG-SNVBAGLBSA-N 295.295 -0.013 5 20 CBBD CCOC(=O)[C@@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 549726004 NDBFMZIHQPLLBG-JTQLQIEISA-N 286.244 -0.638 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C[C@@H]1O 576656624 SVVIZACBMRRLTH-UWVGGRQHSA-N 296.283 -0.558 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC[C@@]1(O)CCCOC1 593884862 YVMWDNWYUCOBKR-LBPRGKRZSA-N 298.299 -0.161 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1cc([N+](=O)[O-])cnc1O 600839839 RLCLXVUBFZJQHE-SECBINFHSA-N 296.283 -0.508 5 20 CBBD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC(=O)O 739934574 XSNODXDQOUUHBX-UHFFFAOYSA-N 297.223 -0.257 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H]1COC(=O)C1 820074873 XMNYWLWOHMLZBQ-ZETCQYMHSA-N 281.224 -0.812 5 20 CBBD O=Cc1cc([N+](=O)[O-])ccc1OCC(=O)NCC(=O)O 821554032 DWSFWSREGXFNGC-UHFFFAOYSA-N 282.208 -0.013 5 20 CBBD Cn1nccc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022063765 LVFASTPXVUTQAU-RBLKWDMZSA-N 293.327 -0.178 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1C[C@@H](O)C1 1329558066 SDAWSIRGPTZGSP-DTORHVGOSA-N 268.273 -0.013 5 20 CBBD C[C@](O)(CNC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 1593400428 CLXGXXNLHZQUDY-JTQLQIEISA-N 286.244 -0.867 5 20 CBBD COC[C@@H](NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)C(=O)O 1606812526 AIDHHKFIWCZKQP-GSVOUGTGSA-N 292.635 -0.199 5 20 CBBD CONC(=O)CNc1ncc(C(=O)O)cc1[N+](=O)[O-] 1606996354 RHYRILUGOPLADA-UHFFFAOYSA-N 270.201 -0.223 5 20 CBBD O=C(O)C[C@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 1610765089 XEGFJWYCFOWIRZ-VIFPVBQESA-N 284.272 -0.033 5 20 CBBD C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])C(N)=O 53393575 VCSXDQHVRMPVMX-ZETCQYMHSA-N 267.241 -0.036 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](C(=O)O)C1CC1 54501682 YWLCQNHZBIFYRP-SECBINFHSA-N 268.229 -0.229 5 20 CBBD CN(CC(=O)N(C)C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 75619332 CBHQIGJJZIUTHK-SNVBAGLBSA-N 285.304 -0.828 5 20 CBBD C[C@@](O)(CO)CNc1nc(C(=O)O)ccc1[N+](=O)[O-] 235376461 ALJRCQBTXCDOQM-JTQLQIEISA-N 271.229 -0.157 5 20 CBBD COCCNCCNC(=O)Cn1ccc([N+](=O)[O-])n1 237288691 OZAWEEGADVAKOU-UHFFFAOYSA-N 271.277 -0.857 5 20 CBBD C[C@@H]1C[C@@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 261924167 ZZKIMBQMYTWOOI-BDAKNGLRSA-N 267.289 -0.013 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@@H](C)O 276027611 TYAJYEZVEONCMM-LDWIPMOCSA-N 298.251 -0.047 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])[nH]n1 285991335 PQIQWQMWPPUWSA-YFKPBYRVSA-N 256.218 -0.049 5 20 CBBD C[C@@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCCOC1 330666622 WISDZALNXBIKCJ-SNVBAGLBSA-N 269.261 -0.128 5 20 CBBD COCC[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 337564142 OZTSFLASIWARAD-SSDOTTSWSA-N 257.250 -0.273 5 20 CBBD COCC[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(N)=O 356775410 KGYPCRGKMQDJQA-SNVBAGLBSA-N 297.267 -0.079 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[C@H](O)CN1 358803707 SUQBVWKZFYILGX-QWRGUYRKSA-N 295.295 -0.058 5 20 CBBD Cn1nccc1S(=O)(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359416773 SUSMKMOOUHNMDL-UHFFFAOYSA-N 283.269 -0.054 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 440964166 NLPBFMHJEJIQKK-WDEREUQCSA-N 297.315 -0.637 5 20 CBBD CN(C)C(=O)NCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548386040 UBEXDARUJOJSGN-UHFFFAOYSA-N 296.287 -0.427 5 20 CBBD Nc1c(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)cccc1[N+](=O)[O-] 557629244 MTRFZZPHFXWLIG-KWQFWETISA-N 295.295 -0.008 5 20 CBBD CC(=O)NCCN(C)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 563197297 GGIUUWPTECXXSA-UHFFFAOYSA-N 269.261 -0.166 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@H](CO)[C@H](O)C1 577014328 ZLMHBHWBBXAVLZ-HTQZYQBOSA-N 256.262 -0.492 5 20 CBBD COCCN(C)CCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 590434144 YAXCZYMJPLMYEZ-UHFFFAOYSA-N 297.315 -0.120 5 20 CBBD O=C1CN(NC(=O)c2cccc([N+](=O)[O-])c2O)C(=O)N1 768924589 CPEHCIHNODBEBK-UHFFFAOYSA-N 280.196 -0.503 5 20 CBBD CN1CCC[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 778777967 DMOKJJVSVZSBIR-QMMMGPOBSA-N 282.256 -0.045 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1CCn1cc([N+](=O)[O-])ccc1=O 782582438 BXIIKJLWSLEKAO-SNVBAGLBSA-N 294.311 -0.081 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)c1cn(CC(=O)N(C)C)nn1 814042841 OTSUXWKIDISRKN-ZETCQYMHSA-N 285.260 -0.812 5 20 CBBD NC(=O)[C@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840378246 CKYXTOAKPWOBBZ-JQCXWYLXSA-N 255.274 -0.188 5 20 CBBD CON1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1 854856848 HALWFHZVHYKHAY-UHFFFAOYSA-N 269.261 -0.353 5 20 CBBD COCC(=O)NCCNc1ccnc(O)c1[N+](=O)[O-] 1093487177 DKWSRQFAMVNAAI-UHFFFAOYSA-N 270.245 -0.130 5 20 CBBD O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 1117102170 CVFLHRDMQKUBRK-LURJTMIESA-N 288.285 -0.518 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1COCO1 1118934441 BXXWTBOLFOPPDW-LURJTMIESA-N 256.218 -0.569 5 20 CBBD Cn1cnnc1Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1581821172 DANDLDJYBBOLGU-UHFFFAOYSA-N 276.220 -0.852 5 20 CBBD CC[C@@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1604912417 GTOBLCPBYVDEOV-GXSJLCMTSA-N 286.288 -0.005 5 20 CBBD COCC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)O 1610254027 RVYGDZLELLPAIR-YFKPBYRVSA-N 272.217 -0.463 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O 120158156 AVGVBRDZGLSIKZ-YFKPBYRVSA-N 253.214 -0.096 5 20 CBBD NC(=O)C1(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 152437683 CYTLQWFGEZXSHK-SNVBAGLBSA-N 295.295 -0.058 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](CO)OC[C@@H]1C 154276432 NGLPJBXLHRZBAA-WCBMZHEXSA-N 298.299 -0.292 5 20 CBBD NCC(=O)NCC(=O)NCCc1ccccc1[N+](=O)[O-] 262343810 CZMXCOMGTVWSMU-UHFFFAOYSA-N 280.284 -0.672 5 20 CBBD Cc1ccnc(N2CCO[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 265150073 BENLIGKKEHWQEV-MRVPVSSYSA-N 266.257 -0.011 5 20 CBBD C[C@]1(NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCS(=O)(=O)C1 285490462 OYCPAHFPMKYNQC-VIFPVBQESA-N 288.285 -0.375 5 20 CBBD CN(Cc1nncn1C)c1ncc([N+](=O)[O-])c(N)n1 292019800 SRFSAFCKPMCTOA-UHFFFAOYSA-N 264.249 -0.268 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CCC[C@H]2CO)c1 300740881 VLYAAMMWKRHEDC-WCQGTBRESA-N 284.316 -0.097 5 20 CBBD COCC(C)(C)NC(=O)Cn1cnc([N+](=O)[O-])n1 330492879 RPLMOLXWJRRVIO-UHFFFAOYSA-N 257.250 -0.273 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NC[C@@H](O)[C@@H]3CCOC3)nn12 347861305 MNASWGARGWMDOF-RKDXNWHRSA-N 293.283 0.447 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 348504216 DKYLIXGJADOTIC-ZCFIWIBFSA-N 267.245 -0.345 5 20 CBBD CNC(=O)CCCNC(=O)c1cc([N+](=O)[O-])cnc1N 353435690 XAHSWRWZSWCNMX-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD CCOC[C@@H](O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357498687 CKSFHDZDPNTKRF-ZETCQYMHSA-N 284.272 -0.102 5 20 CBBD Cc1nc(NCCCN2CCNCC2)ncc1[N+](=O)[O-] 420115426 FKEWGSGQAQCYQR-UHFFFAOYSA-N 280.332 0.400 5 20 CBBD COC(=O)C1(C)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 425158920 GFWLWOXKLCDIDA-UHFFFAOYSA-N 268.229 -0.047 5 20 CBBD CNc1nc(C(=O)N[C@@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 455989643 GQHPRASKQNQCON-LURJTMIESA-N 279.256 -0.350 5 20 CBBD COc1ccnc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)c1 597429054 KRMRBOQHABSZRQ-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC1CC(CO)(CO)C1 599178187 CSDMERPCKCJITQ-UHFFFAOYSA-N 296.283 -0.366 5 20 CBBD C[C@@H](CNS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 600652197 NYUVDOPAGQYTGT-YFKPBYRVSA-N 292.273 -0.673 5 20 CBBD O=C(CN1CCOCC1)OCCn1ccc([N+](=O)[O-])n1 778846127 WIIVSTIRKLRNAI-UHFFFAOYSA-N 284.272 -0.333 5 20 CBBD Cn1ccc(NCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 844144033 OCEILMLXWVZEFD-HTQZYQBOSA-N 253.262 -0.387 5 20 CBBD CCC(=O)N(C)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953449373 NPRUIBFPWVRLCH-RKDXNWHRSA-N 255.274 -0.269 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1ncn(C)n1 1338598644 RRFYFFFIANRIPN-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD CCS(=O)(=O)C[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1341403155 AZLVJLKEPKDLMG-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD O=C1CN(c2ncc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCN1 1593399098 AMLYRUZLBZWGFK-UHFFFAOYSA-N 290.243 -0.894 5 20 CBBD O=C(NCc1cncc(-c2nn[nH]n2)c1)[C@@H]1C[C@H]1[N+](=O)[O-] 1606843077 DBZWQJHUMNQUGY-RKDXNWHRSA-N 289.255 -0.457 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)n1 1608122537 IJEROESLPPXUAK-BDINMYNLSA-N 280.240 -0.269 5 20 CBBD O=C(NC1(CCO)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC1 1756072961 CGALWCFMTJFGKF-NXEZZACHSA-N 297.311 -0.859 5 20 CBBD O=C(COc1cccnc1[N+](=O)[O-])N1CCNC1=O 5970966 PATZZOOWDOBVJI-UHFFFAOYSA-N 266.213 -0.080 5 20 CBBD C[C@@H](OC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 5991097 LZHGRJJPGIKGBJ-SSDOTTSWSA-N 295.251 -0.258 5 20 CBBD O=C1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CCN1 48442616 LEFXOYVFPJJFBF-UHFFFAOYSA-N 279.252 -0.068 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)C1(C)C 110706609 OAIAXPQWAMOJJR-UHFFFAOYSA-N 295.299 -0.163 5 20 CBBD CC(C)(C)N(CC(N)=O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 131147315 FSTVDSIGOJNMFS-JTQLQIEISA-N 299.331 -0.262 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H](CO)OC[C@@H]1C 154276531 NGLPJBXLHRZBAA-WPRPVWTQSA-N 298.299 -0.292 5 20 CBBD CN1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285358268 ZRRMPQQPTNCUQA-ZETCQYMHSA-N 269.261 -0.622 5 20 CBBD O=C(NC[C@@]1(O)CCOC1)c1cc([N+](=O)[O-])[nH]n1 285829519 SEKWEWVUDVJALM-VIFPVBQESA-N 256.218 -0.801 5 20 CBBD COCCOC1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 331397183 LWYZAXFORPZPOL-UHFFFAOYSA-N 284.272 -0.184 5 20 CBBD Cn1c(C(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)ccc1[N+](=O)[O-] 347391913 PWJDXUPDUPUCJR-APPZFPTMSA-N 296.283 -0.304 5 20 CBBD CN(CCCN)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 591678970 LOLXHTCISXPZCF-UHFFFAOYSA-N 268.273 -0.436 5 20 CBBD CNC(=O)NCCNc1ncc([N+](=O)[O-])cc1C(N)=O 596271912 LDVNQMXGPFRFAP-UHFFFAOYSA-N 282.260 -0.570 5 20 CBBD CC[C@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 750587453 XANJGCYVIXATHJ-JTQLQIEISA-N 269.261 -0.439 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1csc([N+](=O)[O-])c1 801704866 FRHWGATVDMIADO-ZCFIWIBFSA-N 296.326 -0.058 5 20 CBBD CC(C)(O)CC(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991293219 AHWSQYUDYMONTF-RKDXNWHRSA-N 285.300 -0.860 5 20 CBBD COCCN1CC(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1031660146 BQZKLNQUJTVKBU-NXEZZACHSA-N 257.290 -0.654 5 20 CBBD C[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1118090535 LQRIYBBHAQYWCF-SCZZXKLOSA-N 295.303 -0.369 5 20 CBBD CCCn1ncnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932279 PWIINGMQSVFDKK-NXEZZACHSA-N 296.331 -0.441 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@](C)(O)C1 1255699994 OKKQERCKAVLZMO-JTQLQIEISA-N 254.246 -0.075 5 20 CBBD Cc1[nH]nc(C(=O)N2CCCO[C@@H](CN)C2)c1[N+](=O)[O-] 1261474420 CWXPLMXIIUPMFW-QMMMGPOBSA-N 283.288 -0.184 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1CCOCC1 1323818513 UCTGIMNVXCWWJL-UHFFFAOYSA-N 267.241 -0.385 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N(C1CCNCC1)C1CC1 1325856420 ZRVNQHPNJDJQIF-UHFFFAOYSA-N 294.315 -0.071 5 20 CBBD COC(=O)N1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1326005960 CBEDRAQQOBUPLR-RKDXNWHRSA-N 271.273 -0.048 5 20 CBBD O=C(CO)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 89549584 RDQSTNRNYRCHFR-UHFFFAOYSA-N 293.279 -0.129 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H](O)C(=O)O 90261124 XWBLFQRCRWVBOR-VIFPVBQESA-N 268.225 -0.301 5 20 CBBD C[C@@H](CCO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 152793815 SJJXSBHJPWLROR-QMMMGPOBSA-N 271.277 -0.139 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@H](C)O[C@H](CO)C2)c1[N+](=O)[O-] 187881386 KECDIBWWQSLZLQ-CBAPKCEASA-N 298.299 -0.141 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)CCO 268880856 VEJMVKXOYLZSBR-ZETCQYMHSA-N 256.262 -0.013 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CCO1 272600250 KTAHZOAZLGNMBM-SNVBAGLBSA-N 295.251 -0.373 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNc2ncc([N+](=O)[O-])cn2)O1 302241167 XUQRBQGBHJZFHL-JGVFFNPUSA-N 267.245 -0.170 5 20 CBBD COC[C@@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 338685799 VBPYQWHHAMRJAY-ZETCQYMHSA-N 269.257 -0.086 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[S@@]1=O 352258657 ZGIMARYTQFPCQY-AHGSNSTDSA-N 271.302 -0.076 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(=O)NCC1CC1 478749100 KHMRYJCRMUNGIV-UHFFFAOYSA-N 295.299 -0.258 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 494649155 QDINYSNUAZLUKT-GXSJLCMTSA-N 298.299 -0.210 5 20 CBBD Cc1nn(C)c(N2CC[C@H](NC(N)=O)C2)c1[N+](=O)[O-] 611193798 YNDTXPDINUHQAW-ZETCQYMHSA-N 268.277 -0.116 5 20 CBBD CN1C[C@@H](N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1=O 848129660 SPDAIKILPVOQMB-DJLDLDEBSA-N 255.274 -0.269 5 20 CBBD CC(C)(CCC(=O)Nn1c(O)nnc1O)[N+](=O)[O-] 854609817 VGDVSFWDKLIKQS-UHFFFAOYSA-N 259.222 -0.405 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCN(CC(N)=O)CC1 1005375708 PKIVQOJCAHNOFK-NXEZZACHSA-N 284.316 -0.940 5 20 CBBD O=C(NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CCC1 1041100004 FUBZRSKLUMGSNX-NXEZZACHSA-N 297.311 -0.859 5 20 CBBD O=C(O)[C@H](C[C@@H]1CCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608534545 ZOIIRBFREXZWET-UYXSQOIJSA-N 272.257 -0.210 5 20 CBBD COCCN(CCOC)C(=O)Cn1cc([N+](=O)[O-])cn1 44668278 ZMFXNZKOEQONNB-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD COCC(=O)N1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1 79934690 JGHMCJRLFOASGC-UHFFFAOYSA-N 297.315 -0.068 5 20 CBBD CCC[C@@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 123230723 RLASPPGEQFGVFJ-SECBINFHSA-N 295.299 -0.082 5 20 CBBD NS(=O)(=O)CCn1cc(Cl)cc([N+](=O)[O-])c1=O 158711122 NRQHLYMPLOJCCG-UHFFFAOYSA-N 281.677 -0.302 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2CNC[C@@H]2C1 195255652 FLGHEGKOBREZBH-AOOOYVTPSA-N 279.300 -0.141 5 20 CBBD CC1(C)[C@H](O)C[C@H]1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228861994 ZFBPEIJYJDYRFR-GMTAPVOTSA-N 284.316 -0.099 5 20 CBBD NC[C@@H]1CCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 237919370 RYCKLWLQTNQDIC-DTWKUNHWSA-N 282.304 -0.180 5 20 CBBD CC(C)c1[nH]nc(C(=O)NC(C)(CO)CO)c1[N+](=O)[O-] 274723735 AQQIRWMGBNMCGC-UHFFFAOYSA-N 286.288 -0.086 5 20 CBBD O=c1nc(CCCNc2ncc([N+](=O)[O-])cn2)[nH][nH]1 302118537 SNWSUBZYUJPYBG-UHFFFAOYSA-N 265.233 -0.159 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC(CO)CC1 330549877 RIEAIRXTUUMQNQ-UHFFFAOYSA-N 295.295 -0.013 5 20 CBBD COC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 357704807 FZQZONSCVNMVBA-ZCFIWIBFSA-N 270.245 -0.691 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 571418663 ZQISDALKPYDYMP-SSDOTTSWSA-N 293.239 -0.941 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 582432707 OMKYRFVPEDSRKR-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD Cc1noc(CN2CCN(C(=O)CO)CC2)c1[N+](=O)[O-] 595393146 MUCQFZZFWWAJHJ-UHFFFAOYSA-N 284.272 -0.472 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N 801910662 OVLSOQKPPWCUMZ-UHFFFAOYSA-N 270.220 -0.079 5 20 CBBD CC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C)C1 839705203 CUPDUTALOIKVFX-FXBDTBDDSA-N 255.274 -0.269 5 20 CBBD CC(=O)N1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891404032 BUMDTCWJLMVRSR-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD Cc1nnc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1020139101 QNBYDDWWJJLBMV-ZYUZMQFOSA-N 295.299 -0.220 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)c1cc([N+](=O)[O-])n[nH]1 1325915344 MXTFRXPJQCPRHU-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD NC(=O)c1ccnc(N2CC[C@H](CO)C2)c1[N+](=O)[O-] 1330037541 ZKYJXOUJAVWRMR-ZETCQYMHSA-N 266.257 -0.093 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@@H](CO)[C@@H](O)C1 1331704526 XORPYKNMBPWODE-UWVGGRQHSA-N 253.258 -0.225 5 20 CBBD C[S@@](=O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 1334370855 KKPHPQSLDDGGAX-GOSISDBHSA-N 274.302 -0.324 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@]12CCC[C@H]1NCC2 1580578798 LNZCPIBSVOVNJR-KCJUWKMLSA-N 280.288 -0.413 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@]12CCC[C@H]1NCC2 1580578800 LNZCPIBSVOVNJR-LDYMZIIASA-N 280.288 -0.413 5 20 CBBD Nc1nc(N2CCOC[C@@H]2CC(=O)O)ncc1[N+](=O)[O-] 1601220537 YVHDFRJOOFTEGF-LURJTMIESA-N 283.244 -0.353 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O 1602190975 UZTYFUPVTWHHDO-APPZFPTMSA-N 296.235 -0.040 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2C[C@@H](O)[C@H](CC(=O)O)C2)n1C 1777526171 JYZSQLVFFQXENL-HTQZYQBOSA-N 284.272 -0.091 5 20 CBBD O=C1CN(C(=O)COc2ccccc2[N+](=O)[O-])CCN1 9653689 SMXGDLRWUNCDSC-UHFFFAOYSA-N 279.252 -0.068 5 20 CBBD N[C@H]1C[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 36263985 SZRJTELTEBDRFJ-IUCAKERBSA-N 257.271 -0.027 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)NOCC(N)=O 164848914 XLOVPAAKNVNSCW-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD CN(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1N 178150638 CFEPIOFUZATSIT-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD COCCNCCNC(=O)c1cc([N+](=O)[O-])cn1C 212705205 WMFMJOIMQYRQBI-UHFFFAOYSA-N 270.289 -0.101 5 20 CBBD O=C(O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 262234147 NRGUXPUDAJMQGY-UHFFFAOYSA-N 269.213 -0.653 5 20 CBBD NS(=O)(=O)c1ccc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 270967466 PMSFWBDDPOFYJV-ZCFIWIBFSA-N 291.285 -0.993 5 20 CBBD CCN1CCN(c2c([N+](=O)[O-])ncn2C)CC1=O 273284804 JNFXGKCXXFCXSS-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN(CCO)CC2CC2)c1 352469827 ZOEQUSXEQDOEGB-LBPRGKRZSA-N 284.316 -0.144 5 20 CBBD NC(=O)c1ccnc(NCCCOCCO)c1[N+](=O)[O-] 357435724 FIVGUIFWJNJESP-UHFFFAOYSA-N 284.272 -0.100 5 20 CBBD CC(C)(C(=O)NC1[C@H]2CNC[C@H]12)n1cc([N+](=O)[O-])cn1 495177377 ZTICZKKPEWMBRF-IUCAKERBSA-N 279.300 -0.140 5 20 CBBD Cc1ccc(C(=O)N[C@H]2CN(C)NC2=O)cc1[N+](=O)[O-] 540874402 UOKFSWJSPRBLIC-VIFPVBQESA-N 278.268 -0.022 5 20 CBBD CCOC[C@H](O)CNCCn1cc([N+](=O)[O-])cn1 563952469 IOJQXEWZPHDFHP-SNVBAGLBSA-N 258.278 -0.222 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](O)[C@@H](N(C)C)C2)n1 571059010 GTZSYUYATHMCPI-WPRPVWTQSA-N 297.315 -0.442 5 20 CBBD COC1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCNCC1 580447077 PYKGGILFLSFDKQ-UHFFFAOYSA-N 297.315 -0.324 5 20 CBBD Nc1nc(N2CC[C@@H]3CCN[C@H]3C2)ncc1[N+](=O)[O-] 591439671 XNYVNPXLMBRSHL-YUMQZZPRSA-N 264.289 0.155 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCn1ccnn1 782492624 KSFJUEYQBMYMJM-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 795301866 LMGSNWFQLMMDSQ-UHFFFAOYSA-N 262.247 -0.908 5 20 CBBD NC(=O)NCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N 801903245 SBPSHTBYONWNEK-UHFFFAOYSA-N 285.235 -0.286 5 20 CBBD C[C@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1=O 813298033 RHSXEGLXKWZUOP-JTQLQIEISA-N 268.229 -0.387 5 20 CBBD NC(=O)CN1CCCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 853214542 JXZHVAHALJJBDY-UHFFFAOYSA-N 294.315 -0.431 5 20 CBBD COC[C@@H]1CCCN1NC(=O)Cn1cc([N+](=O)[O-])cn1 862605705 ZCYMHMTWQWLUPN-VIFPVBQESA-N 283.288 -0.067 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@@H](O)C1 863321518 YINWSPCGXAWFRB-SNVBAGLBSA-N 294.311 -0.027 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1261220132 DTFIKQUONQYIHP-URLYPYJESA-N 295.299 -0.329 5 20 CBBD CCc1[nH]nc(C(=O)NCC[S@](C)=O)c1[N+](=O)[O-] 1324654677 VHXAFOUMWODQAD-SFHVURJKSA-N 274.302 -0.011 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1CN2 1333353928 GRMAKTNCFPFBQB-IUCAKERBSA-N 278.268 -0.671 5 20 CBBD Cc1nnc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1C 1337224508 IDLZIULJUOPPLQ-UHFFFAOYSA-N 279.260 -0.455 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1[C@H]2CNC[C@H]21 1580579106 XFRRLGJBMJLXCP-BRPSZJMVSA-N 265.273 -0.627 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)C(=O)O 1593541672 IXUILLSBHMULEY-RXMQYKEDSA-N 271.185 -0.623 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCO[C@@H](C(N)=O)C2)n1 123556693 JKWORGNYJFWBMX-SECBINFHSA-N 266.257 -0.011 5 20 CBBD COc1cc(C(=O)NOCC(N)=O)c([N+](=O)[O-])cc1OC 157959059 KNAYNCDMZZQRBH-UHFFFAOYSA-N 299.239 -0.241 5 20 CBBD C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C(N)=O 226601041 HHEOXYSAKVVYKK-SCSAIBSYSA-N 270.220 -0.080 5 20 CBBD CC(C)NC(=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228361404 ZFHYEKRBPSIYEQ-LLVKDONJSA-N 299.331 -0.344 5 20 CBBD NC[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 237881721 BHARJEUIYYKVJH-JTQLQIEISA-N 280.284 -0.390 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 275901655 PVVDXOZGGXWWKZ-UHFFFAOYSA-N 277.258 -0.533 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](C)C1 276589097 KGUNEVQMAZJSPD-RKDXNWHRSA-N 297.315 -0.155 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCn1ncnn1 354614593 YXLAPRVAEIKXOW-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 355749718 RAVQFWWTWLFLAO-MRVPVSSYSA-N 297.267 -0.169 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 358388916 NRPOCMBUQSNVOE-LLVKDONJSA-N 285.256 -0.033 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])n1C 362418031 KSSDFPOMPLOBGR-NSHDSACASA-N 285.256 -0.413 5 20 CBBD CCC[C@@H](O)[C@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 413501091 YMFNSVUSKSGDIM-POYBYMJQSA-N 271.277 -0.099 5 20 CBBD Cn1cnc(=O)n1C[C@H](O)COc1cccc([N+](=O)[O-])c1 414161108 ZOCJUABBKREUSB-JTQLQIEISA-N 294.267 -0.070 5 20 CBBD CC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 488338630 YELLKUDAXVBFQF-SSDOTTSWSA-N 255.230 -0.374 5 20 CBBD CNc1nccc(C(=O)NCCCC(N)=O)c1[N+](=O)[O-] 577863104 RJERIUDXFFSSMB-UHFFFAOYSA-N 281.272 0.027 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(c2ncccc2[N+](=O)[O-])C1 609574960 FBCVOHWOGODPQK-SSDOTTSWSA-N 272.286 -0.143 5 20 CBBD Nc1nccc(C(=O)O[C@@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 848787855 TVTCQTVTSJBKMK-ZCFIWIBFSA-N 294.223 -0.466 5 20 CBBD NC(=O)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CC1 1110111918 AQOJFLXVTWHFCL-UHFFFAOYSA-N 293.283 -0.074 5 20 CBBD O=c1ccncn1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1116212994 OFJZKOJIXJQQRW-SECBINFHSA-N 265.229 -0.591 5 20 CBBD Cc1nnc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])n1C 1326063913 JTACXNSLACAUBI-UHFFFAOYSA-N 265.233 -0.315 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCN([C@@H]3CCNC3)CC2)c1 1326692152 DWLZYTKUKGZRGB-GFCCVEGCSA-N 294.359 -0.229 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C1(O)CCOCC1 1342898877 KNLLUPFORSCYHQ-UHFFFAOYSA-N 284.272 -0.551 5 20 CBBD Cn1cc(CN2CCC[C@H](O)[C@H]2C(=O)O)c([N+](=O)[O-])n1 1600952130 UGCMIJBLGGNHNE-IUCAKERBSA-N 284.272 -0.262 5 20 CBBD COC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(=O)O 1610249832 GXJZMJLBISDEMY-SSDOTTSWSA-N 286.244 -0.684 5 20 CBBD C[C@]1(C(=O)O)CN(CCn2cc([N+](=O)[O-])cn2)CCO1 1776507309 UNMVKSOLVXILTN-LLVKDONJSA-N 284.272 -0.033 5 20 CBBD NC(=O)C1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174648948 UWNJQWQWFXDEBJ-LLVKDONJSA-N 297.315 -0.651 5 20 CBBD Cn1nnnc1SC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 174672946 KZNPNLJYMCGUIH-ZETCQYMHSA-N 285.289 -0.532 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 227044263 DCJOTRBQBKILNS-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD C[C@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(=O)O 237621764 CEARMAGQRJEYEL-LURJTMIESA-N 256.218 -0.229 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 246234348 QQBJQCRHYZULCL-GXSJLCMTSA-N 299.331 -0.534 5 20 CBBD CN1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 330458337 YXKHWBLIPDHOOI-VIFPVBQESA-N 268.273 -0.017 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@@H](CO)[C@H](O)C1 565929247 IXYFJRVCZPOZPQ-GXSJLCMTSA-N 298.299 -0.617 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCOC1 569257620 DFBFMDQGTXXPOP-SNVBAGLBSA-N 268.229 -0.703 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](CO)CN(C)C 588864658 LTCFJBHFTYCSHL-JTQLQIEISA-N 299.331 -0.471 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)CCO1 592306046 AETYQTSJRNNJKM-XCBNKYQSSA-N 296.283 -0.116 5 20 CBBD C[C@H](CC(N)=O)NS(=O)(=O)c1ncccc1[N+](=O)[O-] 594756583 BHOSAMUCDKPYET-ZCFIWIBFSA-N 288.285 -0.468 5 20 CBBD CCn1nncc1CN=c1nc(N)c([N+](=O)[O-])c[nH]1 599113672 CKTDMQMWKRLGHS-UHFFFAOYSA-N 264.249 -0.388 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@@H]21 599988777 LXEJZJXXRYEAGQ-MBTKJCJQSA-N 280.288 -0.795 5 20 CBBD Cn1nnnc1CCNc1ccc(C(N)=O)cc1[N+](=O)[O-] 611306671 QPRCLUKRIXCWLI-UHFFFAOYSA-N 291.271 -0.128 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)OCCCS(N)(=O)=O 744605182 POZRGCIKSQCGEL-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 763699499 KBNZZOREHIXJTR-SECBINFHSA-N 283.240 -0.863 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 763699730 LSWXAHVTYMDBFE-VIFPVBQESA-N 267.241 -0.569 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCN1CCOCC1 766972991 PVAZAHPVSJEBHH-UHFFFAOYSA-N 284.272 -0.183 5 20 CBBD CCN1C(=O)[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCN2C1=O 839701390 SMDXNBYRLYRLRM-IWSPIJDZSA-N 296.283 -0.854 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H](OCCO)C1 839730919 KJMLEFWMOLJKDP-IVZWLZJFSA-N 258.274 -0.349 5 20 CBBD CNc1nccc(C(=O)NC[C@H](O)COC)c1[N+](=O)[O-] 848049943 KHOGIHSFYYKDDS-ZETCQYMHSA-N 284.272 -0.231 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCN2C(=O)NC[C@H]2C1 892852103 VBYHAUKZIIXPME-ZETCQYMHSA-N 266.261 -0.458 5 20 CBBD CN1CCC[C@H](N2CCN(CC[N+](=O)[O-])CC2)C1 929982367 SSJMNWUQGNCSCK-LBPRGKRZSA-N 256.350 -0.025 5 20 CBBD Cn1nccc1CCNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767730 SFDZLTBGILUSKK-VXGBXAGGSA-N 295.343 -0.276 5 20 CBBD Nc1nccc(C(=O)N2CCS(=O)CC2)c1[N+](=O)[O-] 1321038111 YOQHKXKOXWOKQV-UHFFFAOYSA-N 284.297 -0.224 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1C[C@@H]2CC[C@H](C1)N2 1331725834 PSEWALJWJYIZOT-AOOOYVTPSA-N 292.295 -0.281 5 20 CBBD CC(C)(C(=O)OCC(=O)C(=O)O)n1cc([N+](=O)[O-])cn1 1602846072 FFDNGPZWGQJLEU-UHFFFAOYSA-N 285.212 -0.277 5 20 CBBD O=C(O)[C@H](CF)NS(=O)(=O)c1ncccc1[N+](=O)[O-] 1608532206 BLRXPFDXFHFLGX-YFKPBYRVSA-N 293.232 -0.309 5 20 CBBD NC(=O)[C@H]1CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])CCO1 1610635069 BKGKWMHBWBPCAR-MRVPVSSYSA-N 296.239 -0.622 5 20 CBBD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC(=O)O 37465220 NBLGLBJZEKVXEZ-UHFFFAOYSA-N 290.253 -0.034 5 20 CBBD CN(C)C(=O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 45651097 APVSVADMRIJMTB-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD C[C@@]1(O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 178013463 JSRDGCSYONGVEG-WDEREUQCSA-N 270.289 -0.391 5 20 CBBD C[C@@]1(O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 225179210 XAFJRIVWLZUHQU-SNVBAGLBSA-N 254.246 -0.225 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1cc([N+](=O)[O-])[nH]n1 285038360 PLQZBZFUGZVQQJ-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD CNC(=O)CN1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 299200186 BIWVMOHQQHURFJ-UHFFFAOYSA-N 296.283 -0.308 5 20 CBBD CC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 357844891 BYGZYDZOQKHHLT-LURJTMIESA-N 255.234 -0.829 5 20 CBBD Nc1nc(Sc2n[nH]c(O)n2)ncc1[N+](=O)[O-] 429305776 GRHUTDRJKLWWBG-UHFFFAOYSA-N 255.219 -0.058 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)NCCO)c1 448267627 NMTVHYITKUNEKY-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD O=C(NCCN1CCOCC1)c1c[nH]nc1[N+](=O)[O-] 547751598 YBOSJGHVZAKRNG-UHFFFAOYSA-N 269.261 -0.620 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCCC1=NNC(=O)C1 588875846 IRTBCRSDQXVHDM-UHFFFAOYSA-N 294.271 -0.436 5 20 CBBD Cc1nn(C)c(NCCc2nc(N)n[nH]2)c1[N+](=O)[O-] 590567590 BONHJJBGWJCKFM-UHFFFAOYSA-N 266.265 -0.008 5 20 CBBD O=C(NCC1(C(=O)O)CCOCC1)c1cc([N+](=O)[O-])n[nH]1 592468496 KYRJEPBTYDPEFW-UHFFFAOYSA-N 298.255 -0.071 5 20 CBBD COC[C@](C)(O)C(=O)NCCn1cc([N+](=O)[O-])cn1 610892232 OZVTXCONDHTFEH-JTQLQIEISA-N 272.261 -0.695 5 20 CBBD CC(C)CS(=O)(=O)NC(=O)Cn1cnc([N+](=O)[O-])n1 749073621 HEBUUWBADLPUFT-UHFFFAOYSA-N 291.289 -0.712 5 20 CBBD CN1C(=O)CN(NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 770454518 QWIDSBDMYLCWNO-UHFFFAOYSA-N 296.243 -0.893 5 20 CBBD CN1CC[C@@H](OC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 781669846 RKUYIOFYTCIBRP-MRVPVSSYSA-N 280.240 -0.041 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 787196960 CBOWOXCFWMHFLK-JTQLQIEISA-N 297.267 -0.169 5 20 CBBD C[C@H](CO[C@H]1CCOC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839701657 YONXEMAVWRAOQB-UTINFBMNSA-N 258.274 -0.038 5 20 CBBD O=C(NCC1CN(C(=O)c2cocn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001797194 WTDWXGMNBVOASY-PSASIEDQSA-N 294.267 -0.472 5 20 CBBD Cn1cnc(C(=O)Nc2c([N+](=O)[O-])cnn2C)n1 1117663198 HJANRXBCIJRWOU-UHFFFAOYSA-N 251.206 -0.291 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H]1CO 1320765250 UTPNCZSQRJOKQM-ZETCQYMHSA-N 254.246 -0.075 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NCCn1cccn1 1322844322 GNYQAHAPFLTFRY-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD Cn1cnc(C(=O)OCCn2cc([N+](=O)[O-])ccc2=O)n1 1323965979 AIIXDOKRJOTVQG-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD O=C(NCc1nnc2n1CCOC2)c1ccc([N+](=O)[O-])[nH]1 1326268511 COXJIQQFTOXFQI-UHFFFAOYSA-N 292.255 -0.025 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@](C)(O)C(=O)O 1574429486 RSHFEIYBWUKPCO-JTQLQIEISA-N 286.244 -0.948 5 20 CBBD O=C(O)Cc1noc(Cn2cc([N+](=O)[O-])ccc2=O)n1 1611519208 DQXVNSGVJSYEQK-UHFFFAOYSA-N 280.196 -0.185 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC2CCOCC2)c1 37893158 OXPCCHFVRGRKMR-LLVKDONJSA-N 270.289 -0.079 5 20 CBBD CC(C)[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 171713774 MQHQBFCFZOSYQV-NSHDSACASA-N 295.299 -0.226 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 227840192 HZUZZZXMOMQAQC-MRVPVSSYSA-N 268.229 -0.438 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 262908560 CFXZDGPPEQPJCQ-VIFPVBQESA-N 298.255 -0.507 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCOC1 266564202 YXLBUENQGHFVFL-ONGXEEELSA-N 270.289 -0.127 5 20 CBBD CCCc1[nH]nc(C(=O)NCc2nnnn2C)c1[N+](=O)[O-] 275257036 QPUKCVCXNNZOML-UHFFFAOYSA-N 294.275 -0.276 5 20 CBBD CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 286297580 GGQMXTGDPOBDAD-RXMQYKEDSA-N 253.218 -0.722 5 20 CBBD CN(CC(=O)N1CCOCC1)C(=O)c1cc([N+](=O)[O-])c[nH]1 330552669 OBAFFBHEZFRJMP-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD COC(=O)[C@@H]1CNC(=O)CN1C(=O)c1ccc([N+](=O)[O-])o1 344912299 LELIXVMNDFVIRC-LURJTMIESA-N 297.223 -0.699 5 20 CBBD NC(=O)c1coc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)c1 354822611 OIIGIFXBNNSPQY-UHFFFAOYSA-N 279.212 -0.060 5 20 CBBD CC[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(N)=O 362254796 WBTTXXZMLQLCHG-RXMQYKEDSA-N 255.234 -0.678 5 20 CBBD C[C@@H](O)CN1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 444655595 WXTKMRKFQBTXFL-SNVBAGLBSA-N 283.332 -0.173 5 20 CBBD C[C@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC(=O)N1 456194713 RIBJVPCWRALEPB-QMMMGPOBSA-N 295.299 -0.127 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 548169270 XGEOLURPKFBDCZ-JTQLQIEISA-N 272.261 -0.545 5 20 CBBD CO[C@]1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CCOC1 549322155 ROOIQGRTBHIABV-JTQLQIEISA-N 270.245 -0.147 5 20 CBBD O=C(O)c1cnc(N2CC[C@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1 592972981 NPXIVZZVZGLDHC-GMSGAONNSA-N 297.267 -0.133 5 20 CBBD NCC[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 723696731 XQCOJDRPINWTSV-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1CN(C(=O)O)C1 740389914 ZSBMDIBQUHRFEH-UHFFFAOYSA-N 269.217 -0.730 5 20 CBBD NS(=O)(=O)CCCOC(=O)Cn1ccc([N+](=O)[O-])n1 744799798 QYMSBFGKFIWXLI-UHFFFAOYSA-N 292.273 -0.987 5 20 CBBD Cc1nc(COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n[nH]1 795371824 BKBLBQHIXSFTBA-UHFFFAOYSA-N 293.239 -0.074 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC[C@H]1CCNC1=O 813921200 AORPZUHBBMQLIH-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)c1cn(C)c(=O)nc1O 814038388 CCWJUCUPBAAFRF-RXMQYKEDSA-N 257.202 -0.692 5 20 CBBD CC(=O)N[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1321769062 FRRZHDYBSDNFJJ-VIFPVBQESA-N 296.287 -0.687 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@]2(C(=O)O)CCOC2)n1 1593666425 WQFWHYCLXZVBGF-LLVKDONJSA-N 298.255 -0.215 5 20 CBBD COC[C@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1609330853 UDEGRMYXRBVXOY-ZCFIWIBFSA-N 295.259 -0.411 5 20 CBBD O=C(O)C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 1610751608 CUYWLZLCCDPKKN-SSDOTTSWSA-N 283.244 -0.444 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@H]1C(=O)O 20215004 JUGDLDOKHXSUNQ-APPZFPTMSA-N 283.240 -0.407 5 20 CBBD COC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 32990635 JIGFNZAVKHZOGF-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228688345 CZUXIJKRFVIWII-LDYMZIIASA-N 284.272 -0.553 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)O1 262186304 HFOYPKKJZBGKSF-APPZFPTMSA-N 298.255 -0.508 5 20 CBBD C[C@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 265523913 UTYXKPIGZOVSKU-QMMMGPOBSA-N 269.257 -0.356 5 20 CBBD CN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 265928427 RGIKXZAEVYENRA-UHFFFAOYSA-N 267.245 -0.908 5 20 CBBD CCN(c1ncc([N+](=O)[O-])c(N)n1)[C@@H]1CCNC1=O 281761703 RUIKALFZCGXVSY-ZCFIWIBFSA-N 266.261 -0.318 5 20 CBBD COC(=O)NCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 308224114 DHGPFEHTIFCALE-VIFPVBQESA-N 287.276 -0.902 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[C@@H](CO)O1 349614903 KJAMVBXRBICCMR-UWVGGRQHSA-N 284.272 -0.553 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[C@H](CO)O1 356521973 SEHUYGYKGAUSNR-GHMZBOCLSA-N 298.299 -0.163 5 20 CBBD Cn1nnnc1CNC(=O)c1cc([N+](=O)[O-])cnc1O 357102655 HRGNWZVUBVNDRU-UHFFFAOYSA-N 279.216 -0.851 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@@H](CO)[C@@H](O)C2)n1 567977732 KIMOUYGKRRSTRI-CBAPKCEASA-N 297.267 -0.214 5 20 CBBD CN(C)C(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])nn1C 570105618 TWHHVMRGNZKMCE-UHFFFAOYSA-N 283.288 -0.075 5 20 CBBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNC(CO)CO 579124272 HYPOWGFLVXHLDS-UHFFFAOYSA-N 299.283 -0.515 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@@H]3[C@@H](CO)[C@@H]3C2)c1 590005471 ZGSLXJNKZGVLBZ-URLYPYJESA-N 252.274 -0.039 5 20 CBBD C[C@H](CO)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 619250464 RZMYEWGSQCXFKB-LURJTMIESA-N 254.246 -0.070 5 20 CBBD O=C(CN1CCN(CC[N+](=O)[O-])CC1)N1CCCC1 791053261 KGDLSYFXWJADFJ-UHFFFAOYSA-N 270.333 -0.497 5 20 CBBD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)[C@@H]1C[C@H]1[N+](=O)[O-] 839605122 JCZRKHNBUPKMLK-LMLFDSFASA-N 269.301 -0.369 5 20 CBBD CC(C)N(C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842302391 LYDPPXKDICOENL-RNFRBKRXSA-N 265.291 -0.647 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 863703505 JIDPNOGLXMPETM-SSDOTTSWSA-N 285.260 -0.684 5 20 CBBD C[C@H]1CN(CC[N+](=O)[O-])CCN1c1nccn2cnnc12 930044554 DUSFULRUQACKGU-JTQLQIEISA-N 291.315 -0.089 5 20 CBBD Cc1nnsc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030293057 FSFQYPBVRBZFOG-RKDXNWHRSA-N 297.340 -0.188 5 20 CBBD Cc1cc(N[C@H]2C[C@@H](NC(=O)C(N)=O)C2)ncc1[N+](=O)[O-] 1059803927 LGBMWSNGZSZREX-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD CCn1ccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936988 ZZCJDTCBJREWKE-GHMZBOCLSA-N 281.316 -0.226 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCN([C@@H]3CCNC3)CC2)n1 1326583648 KJCIVEAJCPAXGQ-GFCCVEGCSA-N 294.359 -0.229 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329087753 PQOUSTVLUBXRBC-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD C[C@@H]1[C@H](C(=O)O)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1609835953 UBQSFYMLSBGUNH-RNFRBKRXSA-N 283.244 -0.492 5 20 CBBD CN(CC(=O)N[C@H](CO)C(=O)O)c1ccccc1[N+](=O)[O-] 1610109110 VILOOPDJFRJYKC-MRVPVSSYSA-N 297.267 -0.407 5 20 CBBD COCCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1N 134873572 QPOURQOVPLWJCT-UHFFFAOYSA-N 296.283 -0.331 5 20 CBBD Cn1c(C(=O)N2CCO[C@@H](CO)C2)ccc1[N+](=O)[O-] 168355704 PYSASPJHBBBSCR-MRVPVSSYSA-N 269.257 -0.233 5 20 CBBD NC(=O)C1(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 183845626 VRJGEKQYLJBPHL-SECBINFHSA-N 295.295 -0.058 5 20 CBBD COC(=O)N1CC(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 269395769 YCEXPNDUJRYITP-UHFFFAOYSA-N 283.244 -0.193 5 20 CBBD COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285727617 GEWMLMCTQVHLPL-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD O=C1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CCN1 301851550 XBGVPZHOUYITNL-UHFFFAOYSA-N 262.229 -0.426 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@](C)(O)CN(C)C 337457353 NQSWPRKNMOUYBC-LBPRGKRZSA-N 299.331 -0.471 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCCNC1 343896010 WFRAYBXOCGDQKK-VIFPVBQESA-N 267.289 -0.093 5 20 CBBD CCOC[C@H](O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 359041447 RVPLQOQIPQCAPS-MRVPVSSYSA-N 284.272 -0.069 5 20 CBBD CC[C@@H](NC(=O)c1ccnc(NC)c1[N+](=O)[O-])C(N)=O 565200123 NHHODUXKIWYMMI-SSDOTTSWSA-N 281.272 0.025 5 20 CBBD NS(=O)(=O)N1CCN(c2ccsc2[N+](=O)[O-])CC1 742174471 CLVXDBXUIJRDLV-UHFFFAOYSA-N 292.342 -0.018 5 20 CBBD CS(=O)(=O)N1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839711815 ADTVWIZLZLHTMN-IWSPIJDZSA-N 291.329 -0.808 5 20 CBBD CC(=O)N[C@H](C)C(=O)OCCn1cc([N+](=O)[O-])ccc1=O 845683008 XOHDLBHFJDLTQI-MRVPVSSYSA-N 297.267 -0.176 5 20 CBBD CC(C)N1CC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CCO2)C1 1053253217 ANOAOXLFLCEHFR-GHMZBOCLSA-N 283.328 -0.027 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC1CCNCC1 1118194392 XWGHVIANFDCREH-UHFFFAOYSA-N 267.289 -0.032 5 20 CBBD NC(=O)CNCC1(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1164491072 ZSRUQDICVIYRBE-RKDXNWHRSA-N 284.316 -0.987 5 20 CBBD CCN(CC(=O)NC)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319592433 XMRAAIVUJOPOJF-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD Cn1cc(CCn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)cn1 1581768871 BNVFLDDGSYAUIV-UHFFFAOYSA-N 289.259 -0.052 5 20 CBBD CONC(=O)CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] 1591466236 CGEHNTJULSGRGF-UHFFFAOYSA-N 293.243 -0.136 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](F)C(=O)O 1600748342 NDLYIZWSPIWNHB-LURJTMIESA-N 274.208 -0.361 5 20 CBBD O=C(O)CC1(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1608684017 ZYTKMXIADXIYAD-UHFFFAOYSA-N 295.251 -0.120 5 20 CBBD CCc1nc(CNCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])no1 1753188052 HFOPUSYRWRCYFF-RKDXNWHRSA-N 297.315 -0.155 5 20 CBBD CC(C)(C(=O)N1CCNC(=O)C1)n1cc([N+](=O)[O-])cn1 102322533 RFLGAWBROWUXOX-UHFFFAOYSA-N 281.272 -0.515 5 20 CBBD O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[C@@H](O)CO 105843476 NPOUCABRUGZBAY-SSDOTTSWSA-N 266.209 -0.456 5 20 CBBD COCCN1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1=O 121497771 IXGMSLIMULSCPY-UHFFFAOYSA-N 297.315 -0.068 5 20 CBBD Cc1nn(C)c(N2CCN3C(=O)NC[C@H]3C2)c1[N+](=O)[O-] 267760827 YVKULNOUFJZTSJ-QMMMGPOBSA-N 280.288 -0.149 5 20 CBBD CCc1[nH]nc(C(=O)NCCN(CC)CCO)c1[N+](=O)[O-] 274505972 GDPSHPDEZYZLJY-UHFFFAOYSA-N 299.331 -0.076 5 20 CBBD C[C@H](O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 275057632 VFXYJINGBLKIFJ-QMMMGPOBSA-N 282.304 -0.530 5 20 CBBD CNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])n1C 344773891 SQBVNKQDGIHLNJ-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@@H](O)C[C@@H]1CO 366693273 FVEXSNBMMKWNDZ-SFYZADRCSA-N 282.252 -0.132 5 20 CBBD O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H](O)C[C@@H]1CO 371521062 YWKVQNKSWNJYEW-NXEZZACHSA-N 296.279 -0.072 5 20 CBBD CC[C@@H](C)N(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 442752732 TYUFAEXQLYBYQP-SSDOTTSWSA-N 285.260 -0.102 5 20 CBBD CN(C(=O)CNC(CO)CO)c1ccc([N+](=O)[O-])cc1 521267632 UTGZCPOEXZIIMQ-UHFFFAOYSA-N 283.284 -0.500 5 20 CBBD CC(=O)NCCN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 578194784 IIRAHQASOPORDW-UHFFFAOYSA-N 296.283 -0.649 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)C1=O 583762832 HNUSORHYPICFGD-ZETCQYMHSA-N 280.240 -0.580 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 586787614 JGIIWXCOHDLMGF-ZCFIWIBFSA-N 267.245 -0.332 5 20 CBBD C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(N)=O 593532282 ZVYUPQYLYWNFSA-RXMQYKEDSA-N 274.258 -0.858 5 20 CBBD NC(=O)C1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1 610976790 XLVWKVDPMKCHQR-UHFFFAOYSA-N 267.245 -0.685 5 20 CBBD O=[N+]([O-])c1ccnn1CN1CCS(=O)(=O)CC1 728711862 ZDUIOSUSZXDPQW-UHFFFAOYSA-N 260.275 -0.521 5 20 CBBD Nc1nc(N2C[C@H]3C[C@@]3(CO)C2)ncc1[N+](=O)[O-] 782407281 PCGKFETZGLKKKE-LDWIPMOCSA-N 251.246 -0.214 5 20 CBBD CCc1[nH]nc(C(=O)OCc2nc(=O)n(C)[nH]2)c1[N+](=O)[O-] 795615899 PEIPHJNDRDPKGC-UHFFFAOYSA-N 296.243 -0.341 5 20 CBBD CC1(C)COC(=O)[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 808104463 YMKLCLHZRINANY-VIFPVBQESA-N 282.256 -0.141 5 20 CBBD CCN(CCC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 829701762 OEAVMCLETNBMCT-JTQLQIEISA-N 286.288 -0.051 5 20 CBBD O=C(NCC1(CO)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1336475029 MQYMBGUPXTURCX-UHFFFAOYSA-N 284.272 -0.163 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1nnc(CCC[N+](=O)[O-])n1C 1338015517 ODHTVWPDJNIMPA-VIFPVBQESA-N 296.331 -0.309 5 20 CBBD NC(=O)[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1344048349 XDNZVFAQNBIWQK-RXMQYKEDSA-N 253.218 -0.735 5 20 CBBD Cc1nc(N2CCOC[C@H]2C(=O)O)ncc1[N+](=O)[O-] 1594456837 PGOSSRUJWVTDJR-QMMMGPOBSA-N 268.229 -0.017 5 20 CBBD CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@H](C(=O)O)C1 1606234534 MYXNCDXEAYVEOR-IWSPIJDZSA-N 271.273 -0.874 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1C[C@H](O)C[C@@H]1C(=O)O 35663847 PIFZEJYMMYYPKR-PHDIDXHHSA-N 256.218 -0.648 5 20 CBBD COCCN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1=O 285848175 PUYWRSDCBSHVDY-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD Nc1nc(N2C[C@@H]3CCS(=O)(=O)[C@H]3C2)ncc1[N+](=O)[O-] 343507908 OIMSUYWIFQLIAN-XPUUQOCRSA-N 299.312 -0.410 5 20 CBBD CCN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CC(=O)NC1=O 355316039 IVMCZCVFMUMBNQ-MRVPVSSYSA-N 294.267 -0.190 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCS(=O)CC1 357627954 AZYNMXSZLSJDKR-UHFFFAOYSA-N 285.281 -0.100 5 20 CBBD COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 360738718 LAMFZQMDXKCTCC-KYXWUPHJSA-N 286.284 -0.169 5 20 CBBD C[C@]1(CO)CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 427079619 YUWBQANRQIBWMA-LDYMZIIASA-N 283.288 -0.146 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CC[C@@H](CO)C2)c1 584530137 MZVPPZVCQAOOML-SCVCMEIPSA-N 284.316 -0.097 5 20 CBBD O=C1CN(c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)CCN1 823535783 HTPPVSFARDJNHI-UHFFFAOYSA-N 289.255 -0.289 5 20 CBBD NC(=O)[C@@H]1CC[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)O1 860413761 NKHHJOVRPYDEPG-JGVFFNPUSA-N 298.255 -0.633 5 20 CBBD O=C(NC1CN(C(=O)Cc2cnoc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991289170 WQPBMVAIOOOZKF-NXEZZACHSA-N 294.267 -0.791 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](NCc2csc([N+](=O)[O-])c2)C1 1020533195 KRFZUCNENFRJQP-ZKCHVHJHSA-N 298.324 -0.122 5 20 CBBD O=C(Cn1ncnn1)NCCNc1ccccc1[N+](=O)[O-] 1093890181 ZJMNZOAIZJUPMT-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD CS(=O)(=O)CCC(=O)NCCn1cc([N+](=O)[O-])cn1 1319453396 CYHRSGJQHSLSOV-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD COCc1nn(CCn2ccc([N+](=O)[O-])n2)c(=O)o1 1320095301 LATGOSJACXNOON-UHFFFAOYSA-N 269.217 -0.212 5 20 CBBD O=C(NCCn1ccnn1)c1c[nH]nc1[N+](=O)[O-] 1331773848 BIPPHRXRRTYZMF-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD NC(=O)[C@@H]1CN(c2cc(C(=O)O)ccc2[N+](=O)[O-])CCO1 1601145258 BIEBLBFIVLFKHA-JTQLQIEISA-N 295.251 -0.017 5 20 CBBD O=C1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2O)CN1 226711463 ZXEXIGMJEFFUGL-LURJTMIESA-N 265.225 -0.081 5 20 CBBD NC(=O)[C@@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247475094 JOPJPZIPFSHDCK-ZJUUUORDSA-N 283.288 -0.898 5 20 CBBD CN1CC[C@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 278034950 BMLHWBVASRPUSM-ZETCQYMHSA-N 280.240 -0.344 5 20 CBBD COC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CCO1 285527157 FFBPJZYRLDQARV-ZETCQYMHSA-N 270.245 -0.195 5 20 CBBD C[C@H](O)CN(CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] 289375898 BUCFEXQGDCWEKL-VIFPVBQESA-N 297.311 -0.131 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCNC1=O 340484686 PEVMUEWAFVULLV-SECBINFHSA-N 295.299 -0.163 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1COC[C@H]1O 342504704 WLNHFBSRQJEJOQ-DTWKUNHWSA-N 282.256 -0.596 5 20 CBBD O=C(NCc1nnc2n1CCC2)c1cc([N+](=O)[O-])n[nH]1 349522525 OEEICZQTRYCRFN-UHFFFAOYSA-N 277.244 -0.214 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354726039 ULNPQLOCBZHEPQ-IYSWYEEDSA-N 284.228 -0.934 5 20 CBBD CN1CC[C@](O)(CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1 357451133 FTMUKDCJFXOPSC-LBPRGKRZSA-N 295.299 -0.433 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 436980308 PDHWQZKVNBABCH-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD CN1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1 450616427 QZSIOEXTTGDBAB-MRVPVSSYSA-N 294.267 -0.565 5 20 CBBD CNc1nccc(C(=O)N2C[C@@H](O)[C@H](OC)C2)c1[N+](=O)[O-] 580464739 VSERGEZPYVEIRN-RKDXNWHRSA-N 296.283 -0.137 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 594335048 JIXOAEQXNVYOAG-ZETCQYMHSA-N 298.255 -0.774 5 20 CBBD CCN1CCN(Cn2cc([N+](=O)[O-])cn2)CC1=O 758275882 IWRVNMLFEOBXDY-UHFFFAOYSA-N 253.262 -0.087 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(N)=O 760075072 FJZJZUWMYOUMOQ-ZCFIWIBFSA-N 256.218 -0.847 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H](CCO)C2CC2)c1 763060454 UMCGJSLDDLGMCE-VXGBXAGGSA-N 284.316 -0.097 5 20 CBBD O=[N+]([O-])CCN(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 791053744 FVMUVZXCMYPBTJ-WDEREUQCSA-N 292.357 -0.069 5 20 CBBD Cc1cc([N+](=O)[O-])cn(C[C@H](O)CC(=O)O)c1=O 832905423 JYPNLRJBHWDVPZ-MRVPVSSYSA-N 256.214 -0.099 5 20 CBBD NC(=O)C(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 1091512431 RZGDUAOCAUXRBV-ZKCHVHJHSA-N 293.283 -0.218 5 20 CBBD CNC(=O)CC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 1126161965 VYYWJZVXJBKZNL-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1322721430 WTOAOADUIAWHKH-VIFPVBQESA-N 258.234 -0.555 5 20 CBBD COC(=O)CC[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)O 1593844081 MAKXTOCHDVYWIX-DSYKOEDSSA-N 274.229 -0.826 5 20 CBBD CCNC(=O)CNC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1 1754980906 VVSGYFNPTPOHIV-NXEZZACHSA-N 298.343 -0.584 5 20 CBBD CN(CC(N)=O)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 52831150 YQXHJHQKJRWAGU-UHFFFAOYSA-N 292.295 -0.099 5 20 CBBD C[C@H](CO)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 86623543 GABAKSCAFCMGER-LURJTMIESA-N 255.230 -0.359 5 20 CBBD NC(=O)CONC(=O)COc1ccc([N+](=O)[O-])cc1 124191325 OGPOZQJFZWYZIY-UHFFFAOYSA-N 269.213 -0.493 5 20 CBBD C[C@H](O)CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)CO 248885720 DXRGRXIZCHQSOF-MNOVXSKESA-N 299.327 -0.180 5 20 CBBD CN1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1=O 278220006 SATCDJNHQMYDOZ-UHFFFAOYSA-N 280.240 -0.390 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@](F)(CO)C2)c1 338597873 YLCSMJFNSZZEPI-WDEREUQCSA-N 288.279 -0.442 5 20 CBBD CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@@H]1COC[C@H]1O 343618329 FIXIXESSEPRKPS-HTQZYQBOSA-N 279.256 -0.167 5 20 CBBD NS(=O)(=O)CCNc1ncnc2cccc([N+](=O)[O-])c12 347400360 OLRXYYNTJOCKLD-UHFFFAOYSA-N 297.296 0.238 5 20 CBBD COC[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)OC 351811582 RZSSTOZZRKYYLB-ZETCQYMHSA-N 271.229 -0.159 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])nn1C)C1CC(O)C1 360676935 TZKSVEQPQMJUCM-UHFFFAOYSA-N 254.246 -0.076 5 20 CBBD Cn1c(C(=O)N2CCN3C(=O)NC[C@@H]3C2)ccc1[N+](=O)[O-] 430761331 LNYCIVPNSHBKDY-MRVPVSSYSA-N 293.283 -0.217 5 20 CBBD COC[C@]1(C(=O)O)CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 565041183 LQQCSADINWETEU-NSHDSACASA-N 297.271 -0.106 5 20 CBBD CCCN1CC[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 598343069 RYZMGYWAGITRNU-VIFPVBQESA-N 282.304 -0.213 5 20 CBBD O=C(NCCn1ccnn1)c1cc([N+](=O)[O-])cnc1O 611909330 KVGRBMFNIUTBIU-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD C[C@@H](OC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 744927461 MFOXVRLAMSWSKI-ZCFIWIBFSA-N 270.245 -0.057 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1SC[C@@H](O)CO 823630070 QNMCOYBQGHKLOG-YFKPBYRVSA-N 298.284 -0.385 5 20 CBBD O=C(NS(=O)(=O)c1ncccc1F)[C@@H]1C[C@H]1[N+](=O)[O-] 842344774 ZTERWGDEULPUTG-IYSWYEEDSA-N 289.244 -0.309 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](O)C[C@H]1CO 1255164799 LUKNSCWCTDDMHB-DTWKUNHWSA-N 284.272 -0.946 5 20 CBBD COCCn1cc(NC(=O)Cn2cnc([N+](=O)[O-])n2)cn1 1321891068 QVZJUNQGYJZPTL-UHFFFAOYSA-N 295.259 -0.332 5 20 CBBD CNC[C@@H](C)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 1332358351 ICMPLYSGXOZVHJ-ZCFIWIBFSA-N 267.249 -0.060 5 20 CBBD C[C@@H](CNC(=O)CNC(=O)CN)c1ccccc1[N+](=O)[O-] 1576015919 NKSWXGZWDDQZGJ-VIFPVBQESA-N 294.311 -0.111 5 20 CBBD COC(=O)C1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 187917202 AEZBZGMPMUKDNU-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD NC(=O)[C@H]1CCN(c2nc(C(=O)O)ccc2[N+](=O)[O-])C1 236285424 HCKNLSQKIODNLS-LURJTMIESA-N 280.240 0.000 5 20 CBBD NC(=O)[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 339022881 UVRFLLOFVMYLAE-YFKPBYRVSA-N 252.234 -0.721 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N(CCO)C1CC1 347467151 REZZTPQRBOCJEY-UHFFFAOYSA-N 254.246 -0.075 5 20 CBBD CC(C)(NC(=O)c1cc([N+](=O)[O-])cnc1N)c1nn[nH]n1 353716015 XVDHBCGXKFPUQV-UHFFFAOYSA-N 292.259 -0.250 5 20 CBBD CN(CCN1CCOCC1)C(=O)c1cc([N+](=O)[O-])nn1C 356418493 ATMVICPLRFVKTJ-UHFFFAOYSA-N 297.315 -0.268 5 20 CBBD O=C1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CN1 436976710 CROPJRUJNMJQMO-LURJTMIESA-N 265.225 -0.081 5 20 CBBD Nc1noc(CCN=c2[nH]cc([N+](=O)[O-])s2)n1 443520204 YXXMFAAGISBDGY-UHFFFAOYSA-N 256.247 0.093 5 20 CBBD O=C(NCCn1ccnc1)c1cc([N+](=O)[O-])n[nH]1 505577144 QVUCLGXSIODMNJ-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD NS(=O)(=O)c1ccc(NC[C@@H](O)CO)cc1[N+](=O)[O-] 596165704 KUXIYVVUIVXVBU-SSDOTTSWSA-N 291.285 -0.993 5 20 CBBD CNc1nccc(C(=O)N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 597654494 RSRKLIURJFFCMU-MRVPVSSYSA-N 297.315 -0.316 5 20 CBBD Cc1cc(OCC(=O)N2C[C@H](O)[C@@H](O)C2)ccc1[N+](=O)[O-] 600216982 KTJAMFZZPMWSIB-RYUDHWBXSA-N 296.279 -0.154 5 20 CBBD CN(C)C(=O)COC1CN(Cn2nccc2[N+](=O)[O-])C1 751944065 RHMZJTMYOCIFDL-UHFFFAOYSA-N 283.288 -0.462 5 20 CBBD NC(=O)CONC(=O)c1ccc(N)c([N+](=O)[O-])c1 772947860 CQPNDGGQIBNHIE-UHFFFAOYSA-N 254.202 -0.676 5 20 CBBD C[C@@H](OC(=O)c1c([N+](=O)[O-])cnn1C)c1nnnn1C 787766489 FGVYPXNWVJELTG-RXMQYKEDSA-N 281.232 -0.230 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](C(=O)O)C1 821314991 GEGNCQVWTRSWJS-LURJTMIESA-N 268.229 -0.125 5 20 CBBD COC[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CCCO1 839747822 FJXZZAGDLDTYBG-ZYUZMQFOSA-N 258.274 -0.038 5 20 CBBD CN(C)CCONC(=O)Cn1cc([N+](=O)[O-])ccc1=O 854945318 GDLGDQROFFPDNE-UHFFFAOYSA-N 284.272 -0.634 5 20 CBBD COC[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 886876611 KGQGZCYXWVMCLR-SNVBAGLBSA-N 284.272 -0.335 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 1252691010 HSZOFFBMNJRQBA-ZCFIWIBFSA-N 269.261 -0.650 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 1324443775 IIFCPRORUONTEQ-ZCFIWIBFSA-N 267.245 -0.745 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@@]2(CCNC2)C1 1327121718 PJDNWJMYFRLUHG-LLVKDONJSA-N 280.288 -0.602 5 20 CBBD O=C(CO)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 89548200 CRICTKDPECFMAQ-UHFFFAOYSA-N 293.279 -0.129 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1c1ncc([N+](=O)[O-])c(N)n1 131862986 MFTYYYZIPPOOFA-NKWVEPMBSA-N 269.261 -0.447 5 20 CBBD C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])N1CCOCC1 159860408 DPYIWSBGTOCRFF-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD CC1(C)C(=O)NCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173753318 NNAZTLVVXOXBOL-JTQLQIEISA-N 297.315 -0.637 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCN2CCCC[C@H]12 331623625 HCOBVCJEAAOKIO-NXEZZACHSA-N 294.315 -0.071 5 20 CBBD COC[C@@H](O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 338485197 QZBRUHLYMFFJBY-ZETCQYMHSA-N 270.245 -0.492 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[C@@H](CO)O1 349614905 KJAMVBXRBICCMR-ZJUUUORDSA-N 284.272 -0.553 5 20 CBBD CN1CCC(O)(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 354717909 VIHXKSXBCPAOJQ-UHFFFAOYSA-N 297.315 -0.636 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](CO)O1 355077738 ZLWHMEMKCGGGQY-RNFRBKRXSA-N 270.245 -0.460 5 20 CBBD O=C(O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 367294261 JEKFAWUTTVNQHK-BWZBUEFSSA-N 258.230 -0.646 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548937400 FDAUURWVFMTCFO-ZETCQYMHSA-N 267.245 -0.379 5 20 CBBD COCCCN(CCO)C(=O)c1c[nH]nc1[N+](=O)[O-] 549337663 UCPBGPMISWQRDC-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD CNC(=O)C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 551368211 FPZQZJWFGMEIDF-UHFFFAOYSA-N 293.283 -0.616 5 20 CBBD C[C@@H]1CN(CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 552066167 LVPPNXJMRYZAAS-MRVPVSSYSA-N 283.288 -0.232 5 20 CBBD C[C@@H](NC(=O)C(=O)NC1CNC1)c1ccccc1[N+](=O)[O-] 565706569 KJBPWBJHZYLPGY-MRVPVSSYSA-N 292.295 -0.140 5 20 CBBD CC(C)Oc1nc(N[C@@H](CO)C(N)=O)ccc1[N+](=O)[O-] 567487405 MUWMIXMMGHRZKV-ZETCQYMHSA-N 284.272 0.035 5 20 CBBD CCN1C[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 576530344 NBUPVJIXQGFYIG-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD CN([C@@H]1CCNC1)S(=O)(=O)c1cccnc1[N+](=O)[O-] 576703372 PXEYQXGNZVOIFP-MRVPVSSYSA-N 286.313 -0.028 5 20 CBBD N[C@H]1C[C@@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 594694786 SZNCBGQSPKCJBP-RQJHMYQMSA-N 283.313 -0.201 5 20 CBBD C[C@@]1(C(=O)O)CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 598659295 UYTMCTYZFQXWNH-JTQLQIEISA-N 283.244 -0.348 5 20 CBBD COC(=O)C1(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 690478628 WWBNBEQQQROUDV-UHFFFAOYSA-N 254.202 -0.291 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H](C(=O)O)C1 821315051 ILCRDCIXTHAMBV-SSDOTTSWSA-N 284.228 -0.746 5 20 CBBD Cc1nc([N+](=O)[O-])cn1Cc1nc(N2CCNCC2)no1 823334161 AXBAAUCSMUBQNV-UHFFFAOYSA-N 293.287 -0.059 5 20 CBBD CN1C[C@@H](N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)CCC1=O 1326767038 HSDMHVJMHMWDFF-QMMMGPOBSA-N 296.287 -0.735 5 20 CBBD C[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 1589045911 PABPJTYPMQJBSP-YFKPBYRVSA-N 257.206 -0.977 5 20 CBBD C[C@@H](O)[C@@H](O)CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1604378854 NYQTZLDMBLLBHC-LDWIPMOCSA-N 298.251 -0.236 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 81580081 QQBJQCRHYZULCL-ONGXEEELSA-N 299.331 -0.534 5 20 CBBD CC(C)[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 107186482 MKILENFBAZSIIB-NSHDSACASA-N 296.283 -0.617 5 20 CBBD CN(C)C1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 135017065 DRGOMPLODFQPNY-UHFFFAOYSA-N 253.262 -0.436 5 20 CBBD C[C@@H](CO)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 282804666 OUMRRMWTKFTDOE-WPRPVWTQSA-N 258.278 -0.535 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCCO)ccc1[N+](=O)[O-] 298248963 ZGZVDBZYCVCKBJ-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)N(C)C 339405376 BLFQXSWYZPQJIS-QMMMGPOBSA-N 296.283 -0.651 5 20 CBBD CCN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)CO 339625928 GDUIZOIPEKVSIF-GXSJLCMTSA-N 272.305 -0.145 5 20 CBBD CCc1[nH]nc(C(=O)N2C[C@H](O)C[C@@H]2CO)c1[N+](=O)[O-] 444313256 GZDFPFCYAHXPCU-RNFRBKRXSA-N 284.272 -0.552 5 20 CBBD Cn1c(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-] 545283567 RGLZVUHYNDUGGL-WPRPVWTQSA-N 283.284 -0.251 5 20 CBBD COC(=O)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cn1 560434181 RRIVMLIXZPWFPV-UHFFFAOYSA-N 296.239 -0.991 5 20 CBBD NC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cn1 762220014 FJOZLXFOCCXILI-UHFFFAOYSA-N 253.218 -0.612 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NN1CCCNC1=O 783602025 YFYBKGZKLSFJKS-UHFFFAOYSA-N 267.245 -0.007 5 20 CBBD O=[N+]([O-])c1cnc(SC[C@@H](O)CO)c(-c2nn[nH]n2)c1 823651994 VHPGDIZYEVLZIM-LURJTMIESA-N 298.284 -0.385 5 20 CBBD CCOC(=O)[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC12COC2 839780838 XFXVABLFOMKOTN-OPRDCNLKSA-N 298.295 -0.310 5 20 CBBD COC[C@H](OC)C(=O)OCCn1cc([N+](=O)[O-])cn1 850202324 ZRRUEXJJVYOYCJ-VIFPVBQESA-N 273.245 -0.004 5 20 CBBD COc1cc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)on1 1030293534 NRGVPRIOJNHAAB-NXEZZACHSA-N 296.283 -0.351 5 20 CBBD CN(CC1(C)COC1)C(=O)Cn1cnc([N+](=O)[O-])n1 1118946551 GIGVXUJVCIHLSX-UHFFFAOYSA-N 269.261 -0.319 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCc3nn[nH]c3C2)c1 1324453718 WXAVRQDVUUNWCA-VIFPVBQESA-N 293.287 -0.671 5 20 CBBD Cc1nn(C)c(C(=O)N2CCc3nn[nH]c3C2)c1[N+](=O)[O-] 1324980350 XPBZLKOQGZODRG-UHFFFAOYSA-N 291.271 -0.047 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CC[C@@H](OC)C1 1341513470 DFJNFGTXSBPQDK-SECBINFHSA-N 285.304 -0.074 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1OC 35162683 KKZUAJOPJSRCEU-VIFPVBQESA-N 298.251 -0.133 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1ccc([N+](=O)[O-])[nH]1 71149490 IWXBPVKZNSITEO-UHFFFAOYSA-N 281.316 -0.100 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(O)CCOCC1 91438712 KJIIBYHGLNIDJV-UHFFFAOYSA-N 284.272 -0.551 5 20 CBBD Cc1ccn(CC(=O)N2CCOCC2)c(=O)c1[N+](=O)[O-] 129580436 VMJCURKATHPHBQ-UHFFFAOYSA-N 281.268 -0.076 5 20 CBBD CC(C)(N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 236610375 YSCBKOCNDJHNIE-UHFFFAOYSA-N 268.273 -0.390 5 20 CBBD C[C@H](O)CN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 274979434 BLFMGZPRJLNRCF-VIFPVBQESA-N 269.305 -0.169 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](O)C(N)=O 289747328 ULFGKMNXUFSJDP-LURJTMIESA-N 257.250 -0.622 5 20 CBBD Cn1nncc1CNC(=O)c1cc([N+](=O)[O-])c[nH]1 342611894 VTBMIQZZDIQMBN-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CCCNC(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 343091106 BKCRVWXNYZBDPZ-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD COCCNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 351707773 CZRKSOUGUMGMQD-UHFFFAOYSA-N 299.287 -0.940 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 354056206 FLGMBFJYABJPJH-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD Nc1nc(N2CCC[C@H]3C(=O)NC[C@H]32)ncc1[N+](=O)[O-] 358687193 TWTVHGDPXLLZBT-RNFRBKRXSA-N 278.272 -0.318 5 20 CBBD CCc1[nH]nc(C(=O)NCCOCCO)c1[N+](=O)[O-] 443943769 DYAMUUXDLMZSAX-UHFFFAOYSA-N 272.261 -0.381 5 20 CBBD C[C@@](NC(=O)Cn1cnc([N+](=O)[O-])n1)(C(=O)O)C1CC1 538503427 PZGOCOINAKXESE-JTQLQIEISA-N 283.244 -0.444 5 20 CBBD COc1cccc(C(=O)NC2=NCC(=O)N2)c1[N+](=O)[O-] 570032732 JOWWQFAPKBXRBF-UHFFFAOYSA-N 278.224 -0.181 5 20 CBBD CO[C@@H]1C[C@H](CC(=O)O)N(c2ncc([N+](=O)[O-])c(N)n2)C1 571288255 VPKFOJXHMZOWCS-RNFRBKRXSA-N 297.271 0.035 5 20 CBBD O=C(COC1CNC1)N1CCc2ncc([N+](=O)[O-])cc2C1 582726851 MVJLESWZFIDYLS-UHFFFAOYSA-N 292.295 -0.137 5 20 CBBD C[C@@H](O)CN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 594361644 IQGDDIGWIOUJJG-ZCFIWIBFSA-N 254.246 0.025 5 20 CBBD NC[C@@H]1OCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 595956596 OFRRDKYSUXMRSQ-UWVGGRQHSA-N 283.288 -0.729 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2C[C@H](C(N)=O)C2)c1[N+](=O)[O-] 600317041 LRWKAVOVKNHIBF-IZLXSQMJSA-N 267.245 -0.380 5 20 CBBD C[C@@H](O)[C@H](O)CNc1nccc(C(=O)O)c1[N+](=O)[O-] 717351920 UCXWMQBIWCDZOF-IYSWYEEDSA-N 271.229 -0.158 5 20 CBBD CNC(=O)CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] 758973561 JIQZDQUAMQEULF-UHFFFAOYSA-N 287.297 -0.240 5 20 CBBD CNc1c(C(=O)N[C@@H](COC)C(N)=O)cccc1[N+](=O)[O-] 765608393 GILUENJVIWMYQY-QMMMGPOBSA-N 296.283 -0.133 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@H](O)CO)c(-c2nn[nH]n2)c1 823639680 FPJCJIHRLRBTDV-ZETCQYMHSA-N 280.244 -0.460 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1COCO1 861969259 OLLFGUVHTWRVMF-SECBINFHSA-N 283.240 -0.754 5 20 CBBD NC(=O)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1034643412 OJAPHIBJMAJIEX-ZYUZMQFOSA-N 284.316 -0.846 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1116345536 ZWPPXQNBHCSFRK-MRVPVSSYSA-N 294.267 -0.897 5 20 CBBD CCc1nc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])no1 1126943509 PQGDWUBAAARZRM-HTQZYQBOSA-N 283.288 -0.497 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2C(=O)OC[C@@H]2C1 1320684752 USCMABCFRSISNZ-ZETCQYMHSA-N 295.255 -0.395 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N(C)CCN1CCOCC1 1342652824 ZOZQOFGVAZVZFD-UHFFFAOYSA-N 298.347 -0.157 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@@]3(CCNC3)C2)c1[N+](=O)[O-] 1579514365 NCDVFIAJBSQYEP-GFCCVEGCSA-N 295.299 -0.169 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@](F)(C(=O)O)C1 1602625013 QJSZJSQFOGCGDA-SECBINFHSA-N 272.192 -0.043 5 20 CBBD C[C@@H](CO)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 86631474 SVJSQCXZWBDCHG-SCZZXKLOSA-N 258.278 -0.630 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cc(F)cc([N+](=O)[O-])c1 165232607 BKFRVDLHQMBFEI-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD CNC(=O)N1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 267242054 QTCNNVNGPNGHHH-UHFFFAOYSA-N 296.287 -0.276 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 299225613 OJEYDDBNAOJAIN-SECBINFHSA-N 295.299 -0.095 5 20 CBBD CCN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CC(=O)NC1=O 355316041 IVMCZCVFMUMBNQ-QMMMGPOBSA-N 294.267 -0.190 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C 355937857 BWKMTKUGYOUCFS-ZCFIWIBFSA-N 254.246 -0.202 5 20 CBBD CCCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])nn1C 356445130 IMWIBMVZNIEZHH-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD Nc1nc(=NC[C@@H]2CN3CCC[C@@H]3CO2)[nH]cc1[N+](=O)[O-] 363571473 NXJCXCVIQKJLHY-RKDXNWHRSA-N 294.315 -0.336 5 20 CBBD CC(C)(NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 561540224 KTYOZVPXZXEKSA-UHFFFAOYSA-N 285.260 -0.046 5 20 CBBD CO[C@H]1C[C@@H](CC(=O)O)N(c2ncc([N+](=O)[O-])c(N)n2)C1 571288253 VPKFOJXHMZOWCS-BQBZGAKWSA-N 297.271 0.035 5 20 CBBD CN1CCOC[C@H]1C(=O)Nc1c([N+](=O)[O-])cnn1C 591715389 HEERTLRZQJBNHM-QMMMGPOBSA-N 269.261 -0.403 5 20 CBBD CN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1 599179335 VZHGQBHLWQBZAC-KNVOCYPGSA-N 293.283 -0.211 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 600459205 PSMCEDNERNFTFI-SSDOTTSWSA-N 297.267 -0.169 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CC(=O)N(C)C1 602799730 FLJONLFEVUDRFE-UHFFFAOYSA-N 253.262 -0.169 5 20 CBBD O=C1CN(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C(=O)N1 731453504 IJYDORMCIDTXMN-UHFFFAOYSA-N 282.187 -0.070 5 20 CBBD NC(=O)CNC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 748638369 BAEKIMFPSXVVJB-UHFFFAOYSA-N 281.224 -0.612 5 20 CBBD CC(=O)N(C)CC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 761383252 ACPSHVCINOBSBX-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD NC(=O)CC(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-] 787946721 WAPQRDLCVQHLJL-UHFFFAOYSA-N 281.224 -0.048 5 20 CBBD CC(C)N1C(=O)C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 839698532 PQFVZCJCZARULR-BWZBUEFSSA-N 269.257 -0.696 5 20 CBBD Cc1nn(C)c(NCCn2cnnn2)c1[N+](=O)[O-] 845573709 GBWHHDKXYMGVJE-UHFFFAOYSA-N 252.238 -0.265 5 20 CBBD CCONC(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 846498886 UJGCYILRBPQMLW-UHFFFAOYSA-N 285.260 -0.716 5 20 CBBD NC[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1328462580 TUDOEIBUACLZRT-VIFPVBQESA-N 267.289 -0.011 5 20 CBBD Cn1cc([C@@H](O)CNC(=O)c2c[nH]nc2[N+](=O)[O-])cn1 1345100329 PEZFARPTXLIWRS-QMMMGPOBSA-N 280.244 -0.485 5 20 CBBD O=C(O)C1(O)CCN(CCn2cc([N+](=O)[O-])cn2)CC1 1610729653 FCIBQCJBEKJMCG-UHFFFAOYSA-N 284.272 -0.297 5 20 CBBD CN1C[C@@H](O)[C@H](Nc2nccc(C(=O)O)c2[N+](=O)[O-])C1 1777093302 MWPRLZCJHPFJNJ-HTQZYQBOSA-N 282.256 -0.225 5 20 CBBD CN(C)C(=O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 48968733 VRRJBUOQCSZGES-UHFFFAOYSA-N 294.267 -0.262 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(O)(C2CC2)C1 89664532 KXUFJTWOHUXYHI-UHFFFAOYSA-N 266.257 -0.225 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 229420265 RABDAXXCJMSRKN-JVXZTZIISA-N 297.267 -0.035 5 20 CBBD Cn1cnc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 236132516 MECWDBMZCMDTIR-VIFPVBQESA-N 281.276 -0.930 5 20 CBBD CC(C)(CN)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 262553275 UJCLBHSOWNJAEM-UHFFFAOYSA-N 268.273 -0.390 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CCO1 272600248 KTAHZOAZLGNMBM-JTQLQIEISA-N 295.251 -0.373 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H](C)O 276029699 UDCMFDHCGGBSSU-LDWIPMOCSA-N 298.251 -0.047 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)CCN1 298454079 IMURKATVRAKFJG-VIFPVBQESA-N 268.248 -0.003 5 20 CBBD CN1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 330403369 VZPXTHYDNPHDOM-SECBINFHSA-N 282.300 -0.006 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCN2CCCC[C@@H]12 331623636 HCOBVCJEAAOKIO-UWVGGRQHSA-N 294.315 -0.071 5 20 CBBD NC(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 343251619 NUCYMNANNRQISZ-LURJTMIESA-N 252.230 -0.130 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)NCC2CC2)c1[N+](=O)[O-] 351537702 MLWCGKPTMDPTMO-UHFFFAOYSA-N 281.272 -0.118 5 20 CBBD CN1CCO[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])nn3C)C[C@H]21 355503119 FIBCMEMENGXPCT-NXEZZACHSA-N 295.299 -0.517 5 20 CBBD COCCOCCNC(=O)c1cc([N+](=O)[O-])nn1C 356453442 CXPYCRWFIQUKMP-UHFFFAOYSA-N 272.261 -0.279 5 20 CBBD COCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1 356461361 OURSMYPOXQCYNR-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD COC[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)OC 358374467 JUONRJRNKJDZEI-SNVBAGLBSA-N 299.283 -0.466 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCc3nn[nH]c3C2)c1 429308300 QLTZOENOUBSYTJ-UHFFFAOYSA-N 263.261 -0.032 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 440361638 YIGHRDRBXNFRFG-UHFFFAOYSA-N 280.240 -0.090 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1c([N+](=O)[O-])c(C)nn1C 518380516 YMVWFMGDKROXMR-HTQZYQBOSA-N 284.272 -0.220 5 20 CBBD O=C1CN(S(=O)(=O)c2cccnc2[N+](=O)[O-])CCN1 525601863 YRURUAIRGUUQMT-UHFFFAOYSA-N 286.269 -0.890 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCc3nc[nH]c3C2)c1 590601341 SSCZECCHRRCAIS-SNVBAGLBSA-N 292.299 -0.066 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCCc2cn[nH]c2)c1 591771755 HPSRATDASSWUHG-LLVKDONJSA-N 280.288 -0.292 5 20 CBBD O=C1C[C@H](C(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)N1 597571690 SHTKKPMYWFJCLA-SECBINFHSA-N 289.251 -0.024 5 20 CBBD O=[N+]([O-])c1cc2c(cc1CN1C[C@H](O)[C@H](O)C1)OCCO2 611272151 DIOSLGJMUFVLIB-PHIMTYICSA-N 296.279 -0.097 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] 763706238 HVDNKNVWHKDGTD-JTQLQIEISA-N 297.267 -0.560 5 20 CBBD NC(=O)CONC(=O)c1cc(O)cc([N+](=O)[O-])c1 780727737 SODYVEUKTBAPKP-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD COC(=O)CCCONC(=O)Cn1ccc([N+](=O)[O-])n1 811562392 PISOMKQBNVUHMD-UHFFFAOYSA-N 286.244 -0.208 5 20 CBBD Cc1nn(CN2CC(=O)N[C@@H](C)C2)cc1[N+](=O)[O-] 840131652 CJBWWAWGNZOQSD-ZETCQYMHSA-N 253.262 -0.122 5 20 CBBD O=C(Cc1cnoc1)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 998065332 VKKBCOLPGIYCRK-NXEZZACHSA-N 294.267 -0.791 5 20 CBBD NC(=O)C(=O)N[C@H]1[C@@H]2CN(c3ccc([N+](=O)[O-])cn3)C[C@@H]21 1060468508 HAJKHMHKPXCLOF-MBTKJCJQSA-N 291.267 -0.974 5 20 CBBD NC(=O)C(=O)N(CCO)CCNc1ccc([N+](=O)[O-])cc1 1111557488 RPOVLUIJEGTFPN-UHFFFAOYSA-N 296.283 -0.687 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1 1251155898 JTKRFBGYTYTFLP-ZETCQYMHSA-N 288.285 -0.905 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC(OCCO)CC1 1321759207 AGGLAKKAXFOHFT-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCS(=O)(=O)CC1 1340013527 OJYKGEYCQPBWKX-UHFFFAOYSA-N 274.258 -0.812 5 20 CBBD Cc1noc(Cn2cc(-c3nn[nH]n3)nn2)c1[N+](=O)[O-] 1592462873 PATYJBHENGKUOA-UHFFFAOYSA-N 277.204 -0.289 5 20 CBBD COc1cccc(C(=O)NC[C@H](O)C(=O)O)c1[N+](=O)[O-] 1599642456 NPMRLMUEBWADRP-ZETCQYMHSA-N 284.224 -0.221 5 20 CBBD COC[C@H](NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)C(=O)O 1606812529 AIDHHKFIWCZKQP-VKHMYHEASA-N 292.635 -0.199 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCCO1 48320894 KJVYPLUCTWUWHB-YUMQZZPRSA-N 269.261 -0.130 5 20 CBBD CCc1nn(C)c(NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-] 91736269 VABPRDLYIPPOFM-UHFFFAOYSA-N 267.249 -0.086 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1N1CC(O)C1 127921787 QJABVNCPEKRBHG-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD COCC1(O)CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 270316417 UHGCYSFBOHBTCU-UHFFFAOYSA-N 283.288 -0.055 5 20 CBBD C[C@@](O)(CO)CNc1cccc(C(N)=O)c1[N+](=O)[O-] 343047083 VOIHGAVHPMXVIQ-NSHDSACASA-N 269.257 -0.151 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356498221 PKHAKKUUTMQJKA-ZCFIWIBFSA-N 269.261 -0.417 5 20 CBBD CN1CC[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1=O 357460497 RCJZEIHHKIZQHI-ZETCQYMHSA-N 279.256 -0.269 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC(O)(C(F)F)C2)n1 425026916 VKJQXPXIFBAERV-UHFFFAOYSA-N 276.199 -0.220 5 20 CBBD Nc1nc(N[C@H](CO)[C@@H]2CCCO2)ncc1[N+](=O)[O-] 447811227 NAJZZKHBUIIWFH-SVRRBLITSA-N 269.261 -0.081 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 554895069 LFMSWZHACXOVNN-JTQLQIEISA-N 271.277 -0.640 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3CC[C@H](CO)[C@H](O)C3)nn12 572419233 FRDZSMRGEXPKHA-RKDXNWHRSA-N 293.283 -0.183 5 20 CBBD O=C(O)c1ccnc(N2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 592978905 JBBVRZAAPNSRNO-NKWVEPMBSA-N 283.240 -0.380 5 20 CBBD C[C@H](CC(N)=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593550958 OSCZOSVFHMITBR-ZCFIWIBFSA-N 288.285 -0.468 5 20 CBBD CNC(=O)CN1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1 596058901 LJVRGORXOAWHLM-UHFFFAOYSA-N 295.299 -0.437 5 20 CBBD CS(=O)(=O)NCCNc1ccnc(O)c1[N+](=O)[O-] 596071874 URSVATWOBDMDNH-UHFFFAOYSA-N 276.274 -0.344 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN(C)[C@H]1CCNC1=O 602797361 VODZYXWRNJLIDI-VIFPVBQESA-N 267.289 -0.080 5 20 CBBD NC(=O)[C@@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCO1 776579081 IWFNZWUDHNKDEC-NEPJUHHUSA-N 295.295 -0.186 5 20 CBBD O=C(O)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 819327438 FQSRDAZXVPBIRJ-MRVPVSSYSA-N 270.245 -0.423 5 20 CBBD O=[N+]([O-])c1cc(N2CC(O)C2)ccc1-c1nn[nH]n1 823635201 SXOBUMDBHADIAC-UHFFFAOYSA-N 262.229 -0.044 5 20 CBBD O=C(NC1CN(C(=O)C2(CF)CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991294324 IUPTVIDBQOTNGI-RKDXNWHRSA-N 285.275 -0.272 5 20 CBBD C[S@@](=O)c1nncn1CCn1ccc([N+](=O)[O-])n1 1318987132 SNDFDCFLFPPSRE-GOSISDBHSA-N 270.274 -0.180 5 20 CBBD Cc1[nH]nc(C(=O)N(C)[C@@H]2CCNC2=O)c1[N+](=O)[O-] 1324502014 JWMFRQBETCNWPP-ZCFIWIBFSA-N 267.245 -0.413 5 20 CBBD COCC[C@H](CO)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1327011923 DKVIWQYTMKKXDI-SSDOTTSWSA-N 272.261 -0.246 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@]1(C(=O)O)C[C@H](O)C1 1600970381 GHMZZCSJKYABOO-DGFRNANFSA-N 283.240 -0.359 5 20 CBBD O=C(O)[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]2C[C@H]21 1602197551 JNNOFMJZFVNDLE-ZYWBIDCJSA-N 254.242 -0.123 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@](O)(C(=O)O)C1 1607967608 SXJCTPHTLCORDZ-LLVKDONJSA-N 298.255 -0.852 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H](O)CN1 50015954 IJQDMLSHAVVODG-NXEZZACHSA-N 265.269 -0.066 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)Cn1ccc([N+](=O)[O-])n1 53231089 XACVTXWOUCMCKU-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD O=C(Cn1cn[nH]c1=O)NCCc1ccc([N+](=O)[O-])cc1 157639483 NRBJUQYXBBJNER-UHFFFAOYSA-N 291.267 -0.162 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CCO1 183520821 BIJGXBLPLVKWMS-MRVPVSSYSA-N 283.240 -0.225 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCO1 246650035 DBILEVYEHUGMJI-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H](O)CO 275772485 WASLQQPUGSZMBI-SECBINFHSA-N 297.267 -0.689 5 20 CBBD O=[N+]([O-])c1cccc([C@H](O)CN2C[C@H](O)[C@H](O)C2)c1 278799879 OOPSMFZSQKKHHL-UTUOFQBUSA-N 268.269 -0.334 5 20 CBBD CNC(=O)NC1CN(c2c([N+](=O)[O-])ncn2C)C1 282256231 NIUCNDMEQIUIFU-UHFFFAOYSA-N 254.250 -0.554 5 20 CBBD CN1CC[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 330868017 SIYVQPPJELIIJB-QMMMGPOBSA-N 267.245 -0.862 5 20 CBBD CCN(CCOCCO)C(=O)c1c([N+](=O)[O-])cnn1C 337600062 RCSLAQOMAXUHLY-UHFFFAOYSA-N 286.288 -0.201 5 20 CBBD O=C(NCCn1cncn1)c1ccc([N+](=O)[O-])[nH]1 337655695 HVWTZBKDDFAVJG-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD NC1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1 342602436 HZTASDAHNKDOLR-UHFFFAOYSA-N 253.262 -0.211 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@]2(CCNC2)C1 343641653 OGKRMVXMQDJLPY-GFCCVEGCSA-N 294.315 -0.212 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H]2CCNC2)c([N+](=O)[O-])n1 353222589 ZWGNXHZGZVEBHJ-SSDOTTSWSA-N 289.317 -0.549 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cn1C 394117803 KZXWTDAHCBARJP-JTQLQIEISA-N 281.316 -0.433 5 20 CBBD O=C(O)[C@@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])s1 547879393 BMGAKDXJXSDROM-SCSAIBSYSA-N 296.282 -0.620 5 20 CBBD Cc1nn(C)c(N[C@@H](CO)CN(C)C)c1[N+](=O)[O-] 589102032 ULOHUNSMKYBAQY-MRVPVSSYSA-N 257.294 -0.029 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C(=O)O1 808207846 KIWMQHJJTQHCJA-IONNQARKSA-N 295.251 -0.423 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NC2(C(=O)O)CC2)n1 1116906671 QIRIRBSFSFZDKP-UHFFFAOYSA-N 254.202 -0.325 5 20 CBBD COCCn1c(CCC[N+](=O)[O-])nnc1N1CCOCC1 1343282238 YJSKUBAGBNIVFO-UHFFFAOYSA-N 299.331 -0.030 5 20 CBBD Nc1c([N+](=O)[O-])ccc(N2CC(O)C2)c1-c1nn[nH]n1 1592757785 RRPBSZWIDPUNIB-UHFFFAOYSA-N 277.244 -0.462 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1610733117 NAXQRHZPLVYDTE-OOJXKGFFSA-N 258.230 -0.912 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCCNC(N)=O)n1 166828992 ZFVUSFNXLIOXNH-UHFFFAOYSA-N 283.244 -0.143 5 20 CBBD CNC(=O)[C@H](C)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 246234360 QQBJQCRHYZULCL-MWLCHTKSSA-N 299.331 -0.534 5 20 CBBD COC[C@@H]1NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 431862209 XKWZJZCVEMELOV-QMMMGPOBSA-N 283.244 -0.642 5 20 CBBD CNc1nc(C(=O)NC(C)(CO)CO)ccc1[N+](=O)[O-] 456007425 NVFPLVPMCIAEGJ-UHFFFAOYSA-N 284.272 -0.495 5 20 CBBD CCCN(CC(N)=O)c1nccc(C(N)=O)c1[N+](=O)[O-] 488754652 VMIDBGFEKNZYBM-UHFFFAOYSA-N 281.272 -0.210 5 20 CBBD CC(=O)NCCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548738337 IVLWSLPYKVESGW-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD CC(C)[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(N)=O 554664761 ZQCLLGIVBDNCKE-ZCFIWIBFSA-N 255.234 -0.442 5 20 CBBD O=C(N[C@H](CO)CN1CCCC1)c1n[nH]cc1[N+](=O)[O-] 590371623 PANIQSLVQVPHBE-QMMMGPOBSA-N 283.288 -0.496 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 592923044 HGRIRGROVHOGDY-NKWVEPMBSA-N 298.255 -0.686 5 20 CBBD COC[C@H]1C[C@@H](O)CN1c1ncc([N+](=O)[O-])c(N)n1 593497545 IIANJIREYWAMTF-RNFRBKRXSA-N 269.261 -0.447 5 20 CBBD COc1cc([N+](=O)[O-])cn(CC(=O)N(C)C)c1=O 603362474 POAFJSXGABJSSM-UHFFFAOYSA-N 255.230 -0.147 5 20 CBBD O=[N+]([O-])c1ccc(-n2cnc(-c3nn[nH]n3)n2)cn1 738359549 JDCPFFKMDYREMO-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD CCNC(=O)CC(=O)OCCn1cc([N+](=O)[O-])cn1 782345632 XITCUGCNFZPBIJ-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CN(C)C(=O)CN1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891551427 GQNPSVKMHPDMOD-UHFFFAOYSA-N 296.331 -0.462 5 20 CBBD CN(C[C@H](O)CN1CCOCC1)c1c([N+](=O)[O-])cnn1C 892856907 PBMOXJXRWDYONT-JTQLQIEISA-N 299.331 -0.542 5 20 CBBD CCN(CC)S(=O)(=O)N1CCN(CC[N+](=O)[O-])CC1 929199755 ZVPPFISIOSDANA-UHFFFAOYSA-N 294.377 -0.533 5 20 CBBD Cn1cnc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1 991280330 PGIUUROHUIFBSF-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD CN(CCN(C)c1ccc([N+](=O)[O-])cn1)C(=O)C(N)=O 1105543194 NJIKEHPJSXTDMN-UHFFFAOYSA-N 281.272 -0.630 5 20 CBBD CO[C@H](CN)Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1 1118102858 LUJDJLXOOSUGBY-LURJTMIESA-N 282.260 -0.106 5 20 CBBD Cn1nccc1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1319799262 SRADMWZRKNSOKD-UHFFFAOYSA-N 277.240 -0.363 5 20 CBBD C[S@@](=O)c1nncn1CCn1cc([N+](=O)[O-])cn1 1334391447 YFTMHJLIHHVTLA-GOSISDBHSA-N 270.274 -0.180 5 20 CBBD O=C(O)c1ncn(CCn2cc([N+](=O)[O-])ccc2=O)n1 1609001372 ONGMYCHZFMSLOH-UHFFFAOYSA-N 279.212 -0.254 5 20 CBBD CN(CCNC(=O)c1c([N+](=O)[O-])cnn1C)CC(=O)O 1610117496 NUTARRFQVQPLLX-UHFFFAOYSA-N 285.260 -0.926 5 20 CBBD Cc1cc(C(=O)NC(CO)CO)ccc1[N+](=O)[O-] 87749810 VEUGZXVXWZHECU-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD CCC[C@H](O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 134409324 ZJAQLZIMRZKXND-QWRGUYRKSA-N 272.305 -0.097 5 20 CBBD COC(=O)C[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 270605635 MVDLPIHQDVKVEC-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD CC(C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nn[nH]n1 354771873 KILIWLOQQWMREW-UHFFFAOYSA-N 280.248 -0.644 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCCn1ccnn1 356744892 NTBIBEWXZFPMOC-UHFFFAOYSA-N 279.260 -0.260 5 20 CBBD O=C1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc([N+](=O)[O-])n1 408360816 ZKNBLNUAFNRIQU-OCAPTIKFSA-N 279.256 -0.091 5 20 CBBD CCCN1C[C@@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 420654641 QBYSMXKPOPULCQ-MRVPVSSYSA-N 294.315 0.059 5 20 CBBD CN1C(=O)CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1=O 425077950 VGTQKABASGPZSK-RXMQYKEDSA-N 281.228 -0.805 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC1=O 518178520 YOCILKLKBQDNGG-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1ccnc(N)c1[N+](=O)[O-] 548417991 LRSYEZKHGNDJLH-UHFFFAOYSA-N 298.299 -0.365 5 20 CBBD O=C(CNC[C@@H]1CCCO1)NCCn1cc([N+](=O)[O-])cn1 576936655 DDFDNZBCZVTUBK-NSHDSACASA-N 297.315 -0.324 5 20 CBBD C[C@@H]1NCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@@H]1C 581370840 DQTYQVICKUMNBV-VHSXEESVSA-N 294.311 -0.035 5 20 CBBD CO[C@@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CCO1 597540263 KRZFJBXEXXUBKX-QMMMGPOBSA-N 282.256 0.017 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCOC[C@H]1CCOC1 609463615 OUJNFXSOKVDLKI-JTQLQIEISA-N 298.299 -0.039 5 20 CBBD CCNC(=O)CNC(=O)c1cc([N+](=O)[O-])cn1C 618608613 ZOARZZWKYSPTQS-UHFFFAOYSA-N 254.246 -0.201 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@H]2C[C@@]2(CO)C1 783790020 VXUBNKDUDVTHRD-KCJUWKMLSA-N 266.257 -0.368 5 20 CBBD O=C(O)[C@@H]1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 819281554 WHAGJLWIFHXFLF-PSASIEDQSA-N 284.272 -0.441 5 20 CBBD CCCN(CC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 829473170 NCLVBYLXBDBVBL-SNVBAGLBSA-N 286.288 -0.051 5 20 CBBD CC(=O)NCC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1 1093455274 DCDLFLUBZRNILF-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD COCC1(O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 1319530874 LMPBEULUFFVZIE-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1339096621 XCLSQCGRRKAAEV-IUCAKERBSA-N 298.299 -0.548 5 20 CBBD CC(=O)NC[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 1341370970 RZWKQDVZZTVFKJ-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1CCNC[C@H]1CO 1580558510 ZUGRUDJGGIQRNK-JTQLQIEISA-N 294.311 -0.201 5 20 CBBD O=C(OCc1ccc(-c2nn[nH]n2)cn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1606977166 IWEHRVMCKBKUPD-RKDXNWHRSA-N 290.239 -0.030 5 20 CBBD CC(C)(N)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 43403905 ZPQQPZHXMBJEKG-UHFFFAOYSA-N 253.222 -0.189 5 20 CBBD CCN(CCS(C)(=O)=O)c1ncc([N+](=O)[O-])c(N)n1 157629058 WYYBECJFMWVPKE-UHFFFAOYSA-N 289.317 -0.162 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228688354 CZUXIJKRFVIWII-KWQFWETISA-N 284.272 -0.553 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 230696030 IFJWMDJBTUIEHJ-VIFPVBQESA-N 293.283 -0.077 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H](O)C1 236364614 XIXGDQWQLBYIPG-ZETCQYMHSA-N 252.230 -0.221 5 20 CBBD CN(CCOCCO)c1ncc([N+](=O)[O-])c(N)n1 283564094 PZBIWKDULVNGLA-UHFFFAOYSA-N 257.250 -0.588 5 20 CBBD CN1CC[C@H]2OCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])[C@@H]2C1 285642834 FLVBLHBFVKPUGN-NXEZZACHSA-N 295.299 -0.137 5 20 CBBD CN1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CCC1=O 330855346 NHEHHESOXCEHRL-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1COCCO1 331134831 CHWUFFSINUORCJ-SECBINFHSA-N 270.245 -0.677 5 20 CBBD COC1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1 331842306 ZTRBFEPQHNJCSU-UHFFFAOYSA-N 254.246 -0.043 5 20 CBBD CC(C)Oc1nc(NC[C@@H](O)C(N)=O)ccc1[N+](=O)[O-] 579140838 SMABHFDKQYSUTL-MRVPVSSYSA-N 284.272 0.035 5 20 CBBD NC(=O)CNC(=S)NNc1cccc([N+](=O)[O-])c1 727064278 ZPBJVOBKFCVFFP-UHFFFAOYSA-N 269.286 -0.129 5 20 CBBD CCN1CCOC[C@@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 775536860 USEHBSGYYDJRNU-SECBINFHSA-N 299.287 -0.550 5 20 CBBD CNC[C@@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 843078593 QUMMENGPWZDQSM-NEPJUHHUSA-N 269.301 -0.202 5 20 CBBD COC(=O)c1cnn(CC(=O)O[C@@H](C)C[N+](=O)[O-])c1 860789119 YXRWGTGFURCJIM-ZETCQYMHSA-N 271.229 -0.122 5 20 CBBD O=C(NCCN1CCC2(C1)OCCO2)[C@@H]1C[C@H]1[N+](=O)[O-] 899064096 RAHFYRNXLUDZTJ-NXEZZACHSA-N 285.300 -0.783 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H](C)CN1 923362402 SMOJBSPALHTUBF-FOGDFJRCSA-N 283.332 -0.166 5 20 CBBD CN1CC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1 928567520 QBBKNRPBJOXJFC-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD CN(CCCNC(=O)C(N)=O)c1ccnc(O)c1[N+](=O)[O-] 1095719014 MCZBONXOLFGGIO-UHFFFAOYSA-N 297.271 -0.877 5 20 CBBD CNC(=O)[C@H](CO)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 1329426496 FCVKEUXMLHPVTD-WDEREUQCSA-N 283.284 -0.675 5 20 CBBD CC(=O)NC[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1339549804 UDUOUAMVYPCBPG-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1339894228 NJGBSXDXZHWCEA-XPUUQOCRSA-N 281.272 -0.417 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NC(=O)NCC(=O)O 1594433428 IEZYXKTUMLJSQE-UHFFFAOYSA-N 254.202 -0.074 5 20 CBBD C[C@H]1OCCN(CCn2ccc([N+](=O)[O-])n2)[C@@H]1C(=O)O 1777411448 NBGUKCVDCHWVAG-SCZZXKLOSA-N 284.272 -0.035 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 49151813 FMEWDSAGCDFEPQ-MRVPVSSYSA-N 269.261 -0.176 5 20 CBBD CNC[C@H](C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 237130666 KAEWILUCKGKMQJ-QMMMGPOBSA-N 255.278 -0.237 5 20 CBBD O=C1NC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3)CCN2C1=O 269018562 DGLSPDURIUWUQC-LLVKDONJSA-N 290.279 -0.258 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 299624656 VFJHROSRSLKGKB-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 344676753 MAFODXNEDIHYRT-JTQLQIEISA-N 271.277 -0.640 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 346343195 FLEAEYCWBSXPRW-NKWVEPMBSA-N 281.272 -0.038 5 20 CBBD COC[C@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 357712627 RJRDABLWYLBARI-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD CCCN(CC(N)=O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 429180426 XZTOQLUODGPZSO-SNVBAGLBSA-N 285.304 -0.651 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)c1c[nH]nc1[N+](=O)[O-] 548081907 OYVQDGAMYBGZKW-UHFFFAOYSA-N 269.261 -0.099 5 20 CBBD CNc1nccc(C(=O)N2CC[C@@H](O)C2)c1[N+](=O)[O-] 557657403 LGSYTTMXCTYEHE-SSDOTTSWSA-N 266.257 0.238 5 20 CBBD Cc1nc(N2CCN3C(=O)[C@H](N)C[C@H]3C2)ncc1[N+](=O)[O-] 581380851 HGWCRSKCBLGCBF-DTWKUNHWSA-N 292.299 -0.559 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(c2ncc([N+](=O)[O-])cn2)C1 592001711 BLNBPLOZHCKBAY-APPZFPTMSA-N 282.256 -0.255 5 20 CBBD C[C@@H]1NCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 592224681 OFGSFAVQKKEIRM-WPRPVWTQSA-N 267.289 -0.095 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CCO1 615927470 JCWIYOHGPDUFNK-LLVKDONJSA-N 284.272 -0.069 5 20 CBBD Cn1ncc(C(=O)OCCn2cc([N+](=O)[O-])ccc2=O)n1 792519971 XOVAAGRBVMULIA-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD C[C@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC[C@H]1CCCO1 840673236 VGKLSBVTIVZAQQ-SGIHWFKDSA-N 286.284 -0.122 5 20 CBBD Nc1nccc(C(=O)OCCOCCO)c1[N+](=O)[O-] 848788240 VXJDILUOMQJZLP-UHFFFAOYSA-N 271.229 -0.262 5 20 CBBD O=C(c1ccc[nH]1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010325191 OWDIPSOZCVPFJO-MWLCHTKSSA-N 292.295 -0.036 5 20 CBBD Cc1ccnc(NCCNC(=O)CC(N)=O)c1[N+](=O)[O-] 1093538619 MLVFDTZFXWTCNA-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD CCc1nncn1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321754186 WACCYTKKPSQNJC-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1324477287 GCPTXLLVJRASDW-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD C[S@](=O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 1334370857 KKPHPQSLDDGGAX-SFHVURJKSA-N 274.302 -0.324 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCCS(=O)(=O)CC1 1340018521 ZMRMNLPQCCYROC-UHFFFAOYSA-N 288.285 -0.421 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)O 1594206648 LSUMRAORQJLMLE-SCSAIBSYSA-N 254.202 -0.225 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCC(=O)C(=O)O 1594460616 HPIAPUXWDPAVLX-UHFFFAOYSA-N 271.185 -0.703 5 20 CBBD CN(C)C(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 49333578 ZRNFOTFBPIYVGI-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD COCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266527522 DNZQKZJHWMTKFK-JTQLQIEISA-N 258.278 -0.270 5 20 CBBD CC(C)N1C(=O)C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 267114163 OBYWILAEUJJHJA-LURJTMIESA-N 294.271 -0.085 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 273514355 UVMPZSSFNXXPAT-ZETCQYMHSA-N 284.224 -0.436 5 20 CBBD CN1CCO[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@@H]21 284646694 FXQDGYNOOVLIOE-UWVGGRQHSA-N 295.299 -0.137 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)N(C)C 340118259 KBTTZDGVJGYZHW-ZETCQYMHSA-N 269.261 -0.616 5 20 CBBD O=C(NC[C@@H](O)C(F)(F)F)c1n[nH]cc1[N+](=O)[O-] 344063770 QPALHYOFSZFJQU-SCSAIBSYSA-N 268.151 -0.029 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 416207667 WPFWSBPEBFMSEM-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD C[C@H]1CNCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 432525460 HUBKPESWBGIUOQ-WPRPVWTQSA-N 267.289 -0.095 5 20 CBBD C[C@@](O)(CO)CNc1cc(N)c([N+](=O)[O-])c(CO)c1 588038214 KGFBECXRLZVNFQ-NSHDSACASA-N 271.273 -0.176 5 20 CBBD O=C(CNC(CO)CO)N1CCc2ccc([N+](=O)[O-])cc21 594002594 RMHGTULFQYBAQD-UHFFFAOYSA-N 295.295 -0.573 5 20 CBBD COC(=O)C[C@@H](O)CNc1ncc([N+](=O)[O-])cn1 599163667 XISNAPCYSWENFH-SSDOTTSWSA-N 256.218 -0.279 5 20 CBBD CNC(=O)[C@@H](O)CNc1cc(C)c([N+](=O)[O-])cn1 757701189 GKLDHKVUAXOPSJ-QMMMGPOBSA-N 254.246 -0.183 5 20 CBBD O=C(Nn1c(O)nnc1O)c1cccc([N+](=O)[O-])c1O 816733552 BSURIGMSWXYTIX-UHFFFAOYSA-N 281.184 -0.313 5 20 CBBD CCOCCN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839674692 FUCFJEMIINDMNJ-GHMZBOCLSA-N 271.317 -0.168 5 20 CBBD C[C@H](OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1 840673235 VGKLSBVTIVZAQQ-AXTSPUMRSA-N 286.284 -0.122 5 20 CBBD CNC(=O)CCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318555662 QRIWCRSTNIQRKN-UHFFFAOYSA-N 283.288 -0.107 5 20 CBBD COC(=O)[C@@H]1CCN(CC[N+](=O)[O-])[C@@H](C(=O)OC)C1 1333921492 WKRNNINEBWALHQ-RKDXNWHRSA-N 274.273 -0.310 5 20 CBBD O=C(O)C[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOC1 1601930865 SQDNGYBZMNRCFC-BRDIYROLSA-N 258.230 -0.598 5 20 CBBD CCN(CC)C(=O)CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 53836011 COZGCSCYTNPNHS-UHFFFAOYSA-N 298.303 -0.487 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCc1ncn[nH]1 80579132 DGSLAZSYPHFMKF-UHFFFAOYSA-N 265.233 -0.732 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CN(C)CCO1 160622118 ZLZBDONREFTLQX-IONNQARKSA-N 283.288 -0.233 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCNC1 179112622 SBMJKEZAXGJUPN-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD Cc1c(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cnn1C 226382647 LEIVTMZGWVGGTD-LBPRGKRZSA-N 294.315 -0.016 5 20 CBBD O=C(CN1CCNCC1=O)NCc1ccc([N+](=O)[O-])cc1 238108999 CDGACZKDBDMFTA-UHFFFAOYSA-N 292.295 -0.357 5 20 CBBD Cc1nc(N2CCO[C@H](C(N)=O)C2)ccc1[N+](=O)[O-] 268450105 FQQPRDLFYKLITO-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD O=C1CNC(=O)N1CCCNc1ncc([N+](=O)[O-])cn1 273587503 GTMCOWSKFSFMKI-UHFFFAOYSA-N 280.244 -0.261 5 20 CBBD CN1CCN(CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 298843174 IXBGWDJJBPZUFO-UHFFFAOYSA-N 281.316 -0.100 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1 299130872 NMOUWJSJDZGVDM-QMMMGPOBSA-N 283.288 -0.178 5 20 CBBD CC(=O)N[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)C(N)=O 353510142 LYHGGFNZLNQPHS-SNVBAGLBSA-N 294.267 -0.087 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 371049167 NOOWAMRTXLPDLS-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD CON1CCC(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 567694597 XXONJSIJAMPANF-LBPRGKRZSA-N 299.331 -0.232 5 20 CBBD COC(=O)[C@H](C)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 583093322 IZKQOHSAZDRBPY-ZCFIWIBFSA-N 282.256 0.111 5 20 CBBD C[C@@H]1[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CCS1(=O)=O 599158321 NJSPFEYHNJQPIY-PHDIDXHHSA-N 287.301 -0.046 5 20 CBBD CCS(=O)(=O)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 732607166 OXLDJTRJEZTRRQ-UHFFFAOYSA-N 290.301 -0.008 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NCCN1CC[C@H](O)C1 894833816 ZRORAGZNRIWIST-QMMMGPOBSA-N 255.278 -0.193 5 20 CBBD NC(=O)C(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 949966966 AWNDIVRKYRIXRA-UHFFFAOYSA-N 292.295 -0.276 5 20 CBBD NC(=O)C(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 1091395716 RZGDUAOCAUXRBV-OCAPTIKFSA-N 293.283 -0.218 5 20 CBBD Cn1cc(NC(=O)Cn2cnc([N+](=O)[O-])n2)ccc1=O 1317999426 CMJLIMGBFWANIA-UHFFFAOYSA-N 278.228 -0.476 5 20 CBBD CNC(=O)CCN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1318286312 MFNCNXWKBYJLGX-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(OCC(N)=O)CC1 1322168825 WXVVHVZAVUQIPJ-UHFFFAOYSA-N 283.288 -0.201 5 20 CBBD C[C@](O)(CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)O 1603256468 QPGYSDWCPIFGKQ-CABZTGNLSA-N 298.251 -0.420 5 20 CBBD COC(=O)CN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 49432183 BAEXCWQXQVSKDM-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD O=C1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)CN1 110910500 QRCMBOPKWCOTTD-ZCFIWIBFSA-N 280.240 -0.296 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC3(C2)OCCO3)c1 173326514 DICZFAGHXNQXRO-LLVKDONJSA-N 298.299 -0.399 5 20 CBBD C[C@H](N)[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])CCO1 231672435 ZHAFFXKQUDKUSG-CBAPKCEASA-N 255.278 -0.119 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1 358080969 QSKLAPISBDDRLF-GFCCVEGCSA-N 295.299 -0.632 5 20 CBBD Cc1cnc(OCc2nc(=N)[nH]c(=N)[nH]2)c([N+](=O)[O-])c1 426586107 JONHARYLROWIKI-UHFFFAOYSA-N 277.244 -0.113 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C)NC1=O 450609812 FHYOIXDMYMDAIA-VIFPVBQESA-N 294.267 -0.322 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400548 NXNGAUOZXKICSI-SVRRBLITSA-N 293.283 -0.174 5 20 CBBD NC(=O)[C@@H]1CC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1 563406011 HANDFSIXVGCMEK-RQJHMYQMSA-N 293.283 -0.044 5 20 CBBD O=C(CNC[C@H]1CCCO1)NCCn1cc([N+](=O)[O-])cn1 576936654 DDFDNZBCZVTUBK-LLVKDONJSA-N 297.315 -0.324 5 20 CBBD O=C(NCCn1ccnn1)c1cc([N+](=O)[O-])n[nH]1 586806234 HNTLHTRKUHDXKI-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD COC(=O)c1ccnc(N2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 598602209 LUCAZOPQTMLHMR-OCAPTIKFSA-N 283.240 -0.682 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NOC[C@H]1CCOC1 788275271 UAFZGVVDVLPSBD-QMMMGPOBSA-N 270.245 -0.124 5 20 CBBD CN(C)C(=O)OCCNC(=O)Cn1cc([N+](=O)[O-])cn1 855652924 YJCYMNPSGQJBAG-UHFFFAOYSA-N 285.260 -0.394 5 20 CBBD O=C(NC1CN(C(=O)c2cncs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991276307 BOKLXZCODLCATF-HTQZYQBOSA-N 296.308 -0.251 5 20 CBBD CSCC(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991279396 LEFFHJRZCYKMAX-HTQZYQBOSA-N 273.314 -0.658 5 20 CBBD CC(=O)N[C@H]1[C@@H]2CN(Cc3c([N+](=O)[O-])ncn3C)C[C@@H]21 1025640952 BHMRUYUGSGCFRQ-JZYVYDRUSA-N 279.300 -0.105 5 20 CBBD Cc1cc(N[C@H]2C[C@H](NC(=O)C(N)=O)C2)ncc1[N+](=O)[O-] 1059393818 LGBMWSNGZSZREX-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-] 1116910295 CIIRYSGSZRZEQJ-XPUUQOCRSA-N 295.299 -0.109 5 20 CBBD C[C@@H]1CN(c2nnc(C[N+](=O)[O-])n2C)C[C@@]2(CCOC2)O1 1121300209 UUVPDJPYHOVAMR-BXKDBHETSA-N 297.315 -0.024 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCc1nc[nH]n1 1320128118 NUVIGGIJOQNJPV-UHFFFAOYSA-N 265.233 -0.384 5 20 CBBD Cn1cc([C@@H](O)CNC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 1340430211 MJNJRFVMQWMBKN-JTQLQIEISA-N 294.271 -0.625 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)O[C@H]1CCOC1=O 1341454984 FKDLNRVGXGEICZ-LURJTMIESA-N 255.186 -0.199 5 20 CBBD C[C@](CO)(NCCn1cc([N+](=O)[O-])ccc1=O)C(=O)O 1592750290 PZURTTQONQZHDA-LLVKDONJSA-N 285.256 -0.818 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@@H](C(=O)O)C1 1604745321 PWNWXALOYKWJQY-HTQZYQBOSA-N 297.271 -0.102 5 20 CBBD CN(CCC(N)=O)c1ncc([N+](=O)[O-])cc1-c1nn[nH]n1 1609274261 GRFUFESOJGGDPW-UHFFFAOYSA-N 292.259 -0.519 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](O)[C@H]2C(=O)O)n1 1610607363 XCUSVXCSFDNDIK-APPZFPTMSA-N 298.255 -0.622 5 20 CBBD CNC(=O)CCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173636137 QSHTUNCFQMOPQU-SNVBAGLBSA-N 285.304 -0.780 5 20 CBBD Cc1cc(C(=O)NC[C@@H](O)C(N)=O)cc([N+](=O)[O-])c1 228486715 LCPXACYMYWIDHX-SECBINFHSA-N 267.241 -0.521 5 20 CBBD COC[C@@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 234884400 KCTJIDKQVMSSLD-MRVPVSSYSA-N 290.297 -0.120 5 20 CBBD NS(=O)(=O)c1cc(N2CC[C@H](O)C2)cc([N+](=O)[O-])c1 265871310 ZIUHBNHOVJQLGE-VIFPVBQESA-N 287.297 -0.187 5 20 CBBD COC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 274565610 ZNNOMZQAOQEPOU-MRVPVSSYSA-N 269.257 -0.086 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 279058550 BIWPTQPWIURNIN-BXKDBHETSA-N 298.299 -0.163 5 20 CBBD O=C(N[C@@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])n[nH]1 353375630 STZZISMMAHJTCS-WXQGDBPDSA-N 258.259 -0.431 5 20 CBBD Cn1c(C(=O)NCCN2C(=O)CCC2=O)ccc1[N+](=O)[O-] 356388474 HSIJZRWHEQLCJA-UHFFFAOYSA-N 294.267 -0.188 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1n[nH]cc1[N+](=O)[O-] 362397046 QMNPXVZYWKVKIO-RKDXNWHRSA-N 295.299 -0.089 5 20 CBBD Cn1nnc(CNC(=O)N=c2cc[nH]cc2[N+](=O)[O-])n1 488557447 FMXUBVQWJYKSKF-UHFFFAOYSA-N 278.232 -0.743 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1OC 490248983 LKEZAVNFXXWXAD-OCAPTIKFSA-N 285.260 -0.942 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](CO)OC[C@H]2C)c1[N+](=O)[O-] 494681760 MILJGHMVXWVYGB-HTRCEHHLSA-N 284.272 -0.152 5 20 CBBD CN(C)C(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 554861575 ZPYJGNDQDRLBBG-UHFFFAOYSA-N 296.287 -0.243 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N1CCCNCC1 578748381 YMYYWOSJRICYLW-UHFFFAOYSA-N 286.313 -0.026 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 592923038 HGRIRGROVHOGDY-BQBZGAKWSA-N 298.255 -0.686 5 20 CBBD CN(C)C[C@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 596244522 RCVPEFQCNHPUNR-ZCFIWIBFSA-N 256.266 -0.699 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1C[C@@H](O)C1 597410259 QLFKZUMDQXADJQ-OCAPTIKFSA-N 254.246 -0.261 5 20 CBBD COC(=O)C[C@@H](O)CNc1c([N+](=O)[O-])ncn1C 599163657 XBUVBERQOCPLEG-ZCFIWIBFSA-N 258.234 -0.336 5 20 CBBD C[C@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1C 743272072 MANSSKMJJGVFOF-JQWIXIFHSA-N 283.332 -0.212 5 20 CBBD NC(=O)CONC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 778960910 KAPOOKPUABGLFN-UHFFFAOYSA-N 283.196 -0.530 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)NCCn1cnnn1 807918706 DCJKQDGEUZBLFR-UHFFFAOYSA-N 292.255 -0.224 5 20 CBBD CON(C)C(=O)CNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 817311228 HKSADXYRGNSQNE-UHFFFAOYSA-N 283.244 -0.447 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nn1c(O)nnc1O 820291809 MBKZOGSWMJDVNM-UHFFFAOYSA-N 297.231 -0.737 5 20 CBBD C/C=C(/C)C(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042976749 RZMBUZFQYGFXTI-HJBJALMNSA-N 297.311 -0.693 5 20 CBBD Cn1cc(CCNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126936281 DVCHJZMDYRSNNQ-GHMZBOCLSA-N 281.316 -0.666 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCn1cncn1 1318531224 KEENRQLOQHYJOH-UHFFFAOYSA-N 279.260 -0.492 5 20 CBBD Cc1nc(N2CCOC[C@@H]2C(=O)O)ncc1[N+](=O)[O-] 1594456835 PGOSSRUJWVTDJR-MRVPVSSYSA-N 268.229 -0.017 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](O)C[C@H](C(=O)O)C2)c1[N+](=O)[O-] 1610404459 UCDJFPGXARPCRH-BQBZGAKWSA-N 298.255 -0.466 5 20 CBBD NS(=O)(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 75499027 MBJFWTZDVSIBDZ-ZETCQYMHSA-N 287.301 -0.321 5 20 CBBD CN(C)c1n[nH]c(NC(=O)Cn2cc([N+](=O)[O-])cn2)n1 286048370 QGENCYCSHGHTQP-UHFFFAOYSA-N 280.248 -0.386 5 20 CBBD COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])nn1C 343932793 AZXLJHIKVCXTNH-SSDOTTSWSA-N 272.261 -0.545 5 20 CBBD O=[N+]([O-])c1cnn(CCN2[C@H](CO)CC[C@H]2CO)c1 347325960 ZWUBESRXISWXRO-UWVGGRQHSA-N 270.289 -0.391 5 20 CBBD Cc1nc(N2CCN(C)C(=O)C2)ncc1[N+](=O)[O-] 515854396 SUTYRQQBHUYHSS-UHFFFAOYSA-N 251.246 -0.028 5 20 CBBD CNC(=O)[C@H](O)CNc1ccc([N+](=O)[O-])c2nonc12 758114623 OKFJZVGCNGUQAT-SSDOTTSWSA-N 281.228 -0.350 5 20 CBBD COC(=O)c1cc(C(=O)NOCC(N)=O)cc([N+](=O)[O-])c1 772940823 VNIIKLGNHMCTCB-UHFFFAOYSA-N 297.223 -0.472 5 20 CBBD CCN(CC(=O)NC)C(=O)c1ccnc(N)c1[N+](=O)[O-] 847488432 GZZXVAUOZKKUAH-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD CCONC(=O)CNC(=O)c1ccnc(NC)c1[N+](=O)[O-] 848243232 VZVMKKMIVBMUGX-UHFFFAOYSA-N 297.271 -0.171 5 20 CBBD CNCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923361958 PEOGTOTXMURPIB-SNVBAGLBSA-N 257.294 -0.697 5 20 CBBD O=C(C(=O)N1CCN(CC[N+](=O)[O-])CC1)N1CCCC1 929283120 NMYUJPABBDRLFA-UHFFFAOYSA-N 284.316 -0.970 5 20 CBBD CN(C)CCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1133294336 DBZBQKSROPCECY-UHFFFAOYSA-N 298.347 -0.514 5 20 CBBD NC(=O)CCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1251406628 NKLREJPYGJORAI-UHFFFAOYSA-N 282.256 -0.862 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCC1(O)CCOCC1 1324121919 STZAYXYKMLCCRK-UHFFFAOYSA-N 298.299 -0.161 5 20 CBBD O=C(NCc1nc([C@H]2CCCO2)n[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 1327653791 JGLANGADBBGSCP-BWZBUEFSSA-N 281.272 -0.062 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCc1nc[nH]n1 1350038974 RFWXACYFQVIMHI-UHFFFAOYSA-N 266.217 -0.039 5 20 CBBD O=C(N[C@H]1C[C@H]2CC[C@@H]1N2)c1cc([N+](=O)[O-])n[nH]1 1580755165 ICHXXIDFDQLCTA-VQVTYTSYSA-N 251.246 -0.059 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCC2(CO)CC2)c1 122404542 VQXZEYAFWXUVIW-SNVBAGLBSA-N 270.289 -0.486 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])s1)NCCO 269475815 AKECLLKHBUAHMZ-UHFFFAOYSA-N 273.270 -0.505 5 20 CBBD CN(CCC(N)=O)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 353257976 KSIYWAZDXRGSKC-UHFFFAOYSA-N 294.267 -0.133 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1N 429158518 OYTMTCAYPFEMLS-SCZZXKLOSA-N 267.289 -0.013 5 20 CBBD O=C(O)[C@H]1COCCN1CCn1ccc([N+](=O)[O-])n1 568772262 PKZKWBBOZACSII-MRVPVSSYSA-N 270.245 -0.423 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 588863762 IXRHRPARYQZABG-QMMMGPOBSA-N 285.304 -0.711 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(c2c([N+](=O)[O-])c(C)nn2C)C1 592003993 JPAHNHZCMUKIIG-BDAKNGLRSA-N 298.299 -0.003 5 20 CBBD CN(C[C@H](O)CO)c1ccc([N+](=O)[O-])c(C(N)=O)c1 596182174 PVPKLUUNKAYQPJ-QMMMGPOBSA-N 269.257 -0.517 5 20 CBBD CO[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 597541553 URSMQXPOBRATHH-ZETCQYMHSA-N 256.218 -0.237 5 20 CBBD CCC(=O)N[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 610874680 MRWUKBMGIZMTNR-QMMMGPOBSA-N 283.288 -0.178 5 20 CBBD Nc1c(C(=O)NC(CO)CO)cc(F)cc1[N+](=O)[O-] 611288150 SBWLUCWBKYVHSJ-UHFFFAOYSA-N 273.220 -0.601 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)O[C@@H]1CCC(=O)NC1=O 798647091 ZUVOYFKJGOFINL-SSDOTTSWSA-N 294.223 -0.466 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2COC(=O)C2)c1[N+](=O)[O-] 816679422 UTLRENGFLVSDHV-YFKPBYRVSA-N 254.202 -0.328 5 20 CBBD CNC(=O)COC(=O)c1ccnc(NC)c1[N+](=O)[O-] 848790441 NOPSTIORFDNTPE-UHFFFAOYSA-N 268.229 -0.066 5 20 CBBD CC(C)(COC(=O)Cn1cnc([N+](=O)[O-])n1)[N+](=O)[O-] 851126536 SDAXJKDIMIFOLX-UHFFFAOYSA-N 273.205 -0.215 5 20 CBBD CN(C[C@@H](O)C1CC1)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319591333 JEQFOFODJUVRNH-GFCCVEGCSA-N 295.295 -0.014 5 20 CBBD COCCCNC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1322838609 SRYDUWIOECGHCF-UHFFFAOYSA-N 299.287 -0.940 5 20 CBBD C[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1O 1324663486 XKHMBRTZHMCQQL-SVRRBLITSA-N 266.257 -0.094 5 20 CBBD Cn1ncnc1COC(=O)c1c([N+](=O)[O-])cnn1C 1325218007 ODYSQXOLPSXKIG-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD NC(=O)[C@@H]1CC[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1329139797 AARRHLPWBOXEPD-YWVKMMECSA-N 297.315 -0.604 5 20 CBBD CC(=O)N1CCN(c2nnc(CCC[N+](=O)[O-])n2C)CC1 1338152908 KWBODOFJLQBLDF-UHFFFAOYSA-N 296.331 -0.307 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CCN(C)C(=O)C1 1339329051 VQPKXUMCBXWFAJ-UHFFFAOYSA-N 268.277 -0.647 5 20 CBBD C[C@@H](C(=O)O)c1noc(Cn2cnc([N+](=O)[O-])n2)n1 1588602601 NXTGVBAXDJHMEQ-SCSAIBSYSA-N 268.189 -0.194 5 20 CBBD CC(C)[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(N)=O 135493060 AGCAREBULBWOGO-SECBINFHSA-N 298.303 -0.400 5 20 CBBD COC(=O)[C@H](C)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 285286086 AWQKUAGQWOQHRG-RXMQYKEDSA-N 256.218 -0.143 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)C1CC1 286129610 NXJMUABGXXZHJZ-QMMMGPOBSA-N 268.229 -0.001 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@]1(CO)CCOC1 330896775 SWKIHFGQYWJRRE-NSHDSACASA-N 284.272 -0.551 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339644502 WMCNYRVPFQGKKB-SSDOTTSWSA-N 271.233 -0.588 5 20 CBBD COC(=O)Cn1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n1 340511861 JEMPOCHAMUINKL-UHFFFAOYSA-N 293.239 0.545 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](C)O[C@@H](CO)C2)c1[N+](=O)[O-] 347508353 AWHOIOOKXPLYIY-HTRCEHHLSA-N 284.272 -0.152 5 20 CBBD CNc1nc(C(=O)N[C@@H]2CC(=O)N(C)C2)ccc1[N+](=O)[O-] 455277468 DQOOZIYBGQFWSV-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD CNc1nc(C(=O)NC[C@H](O)C(=O)OC)ccc1[N+](=O)[O-] 455989215 CDJIBKLTQCZNGL-QMMMGPOBSA-N 298.255 -0.705 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H]1O 563695810 GQIUOBIBEWOHFU-YUMQZZPRSA-N 269.261 -0.935 5 20 CBBD CC(=O)NCCN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 577281881 RKJBGPXBIOTMOX-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD Cc1nc(CCNC(=O)c2ccnc(N)c2[N+](=O)[O-])n[nH]1 582854478 OQRBDNYUBIBAOI-UHFFFAOYSA-N 291.271 -0.029 5 20 CBBD CC[C@@H](O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 594421407 VFLIVYRXJOTRNC-ZCFIWIBFSA-N 254.246 0.073 5 20 CBBD CC(C)(C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 610845379 DICJOFVYJPSWLH-ZETCQYMHSA-N 285.260 -0.198 5 20 CBBD Cn1c(C(=O)N[C@H]2CCO[C@H]2C(=O)O)ccc1[N+](=O)[O-] 702975119 VXDKCECIHGUBPK-IMTBSYHQSA-N 283.240 -0.095 5 20 CBBD COC(=O)C(=O)CCCOC(=O)Cn1cc([N+](=O)[O-])cn1 803272137 PYAPPJGLXZCPEQ-UHFFFAOYSA-N 299.239 -0.143 5 20 CBBD Nc1n[nH]c(CCNC(=O)c2cc([N+](=O)[O-])ccc2N)n1 820019211 SVCCDXMRNZEQSQ-UHFFFAOYSA-N 291.271 -0.150 5 20 CBBD Cc1cc([N+](=O)[O-])cn(CC(=O)NCCC(=O)O)c1=O 832905046 AUUHBPJINOORKJ-UHFFFAOYSA-N 283.240 -0.344 5 20 CBBD CNC(=O)[C@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 843109840 HFVUUXZECYCNJO-WDEREUQCSA-N 283.284 -0.675 5 20 CBBD CON(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 863629933 KSURKNJWLKAFND-LURJTMIESA-N 297.271 -0.290 5 20 CBBD NC(=O)COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 917947967 GRYNPJSNQHAYLU-UHFFFAOYSA-N 291.223 -0.182 5 20 CBBD Cn1ncc(CN[C@H]2C[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1020139378 ZUMBMCCIYLPALD-YJFSRANCSA-N 294.315 -0.783 5 20 CBBD COCCN1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1121391586 HTNNYSKCRKFULH-UHFFFAOYSA-N 284.320 -0.640 5 20 CBBD CC(=O)NC[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 1254794414 SQEXBYVCEGJHSV-SNVBAGLBSA-N 281.272 -0.274 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1CC(=O)N(C)C[C@@H]1C 1263019973 DGXPSJKVDBODSB-QMMMGPOBSA-N 282.304 -0.258 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1OCCCO1 1329264728 ZEQFDUUPZBJNCS-UHFFFAOYSA-N 271.233 -0.935 5 20 CBBD C[C@@H](c1nnc(N2CCN3CCOC[C@@H]3C2)n1C)[N+](=O)[O-] 1338207303 AHTXJCXBPIZFFV-UWVGGRQHSA-N 296.331 -0.326 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN[C@@]1(C(=O)O)CCOC1 1600749538 CKFMRLVRDHAPNK-NSHDSACASA-N 284.272 -0.067 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 35165481 UKAVTBCNUZAKMJ-SSDOTTSWSA-N 257.202 -0.813 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C(=O)O 37434934 GLDWOTUXDWXEFH-BYPYZUCNSA-N 255.186 -0.514 5 20 CBBD COC[C@H](C)S(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152835933 ZDLUOMKJLWBPMI-QMMMGPOBSA-N 292.317 -0.254 5 20 CBBD CN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C(C)(C)C1=O 176078613 ORKLPUBDRGUDJG-UHFFFAOYSA-N 295.299 -0.130 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@]1(CO)CCOC1 182840705 MWIMNBBEOHJPRS-GFCCVEGCSA-N 298.299 -0.243 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cn1C 228748619 BSWHYYOBMLFVTM-LBPRGKRZSA-N 284.316 -0.024 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCc2ccncn2)c1 236553489 HCHLJTXWGDCIRK-LLVKDONJSA-N 278.272 -0.268 5 20 CBBD C[C@@]1(CN)CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 261791478 GNRYRCIEQNPWFK-ZDUSSCGKSA-N 294.311 -0.046 5 20 CBBD O=C(N[C@H]1C[C@@H](O)C1)c1cnc(O)c([N+](=O)[O-])c1 298521507 UUYUGUSYOOGGJK-KNVOCYPGSA-N 253.214 -0.052 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@H](O)C(=O)OC)c1[N+](=O)[O-] 345312381 YUMMPGONKWWLPT-ZCFIWIBFSA-N 286.244 -0.856 5 20 CBBD NC(=O)C[C@@H](N)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 353260078 TUPSHGXPRMCICP-LLVKDONJSA-N 292.295 -0.318 5 20 CBBD C[C@@H](CO)N(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 357467589 ZHLJBNOKBFADGH-LURJTMIESA-N 254.246 -0.094 5 20 CBBD COC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 357704774 FZQZONSCVNMVBA-LURJTMIESA-N 270.245 -0.691 5 20 CBBD CN1CCNC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])n1C 394067536 JPZHSPONKFTMAS-VIFPVBQESA-N 281.316 -0.433 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](O)CO 436437483 YFWNRZNFLROXLQ-ZETCQYMHSA-N 291.285 -0.993 5 20 CBBD Cc1nnc(CCNc2ncc([N+](=O)[O-])cn2)n1C 444835970 HYXORMVVUYXYQZ-UHFFFAOYSA-N 263.261 0.476 5 20 CBBD COCCN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 507562312 CVJMSMCEGMEYNP-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N1C[C@H](O)[C@@H](O)C1 600217444 ZHRTZPBGJIIBDW-UWVGGRQHSA-N 292.251 -0.351 5 20 CBBD CC(C)(CO)N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 609839741 JVTRNOFQRNSZFK-UHFFFAOYSA-N 296.331 -0.140 5 20 CBBD CCN(CC(=O)N(C)C)c1ncc([N+](=O)[O-])c(N)n1 610479330 WFJKURHYQIPZAH-UHFFFAOYSA-N 268.277 -0.119 5 20 CBBD CN1CC[C@@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)C1=O 772525249 YAEKAUBQUOIZOL-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD CC(=O)NCC1=CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1017213775 RFFYNOFCHGEIBZ-GHMZBOCLSA-N 267.285 -0.054 5 20 CBBD Cn1nccc1CCNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936456 IXKOZBSRCRSIDT-GHMZBOCLSA-N 281.316 -0.666 5 20 CBBD CCc1[nH]nc(C(=O)NCCc2nncn2C)c1[N+](=O)[O-] 1322006495 GTKAPEYANZAFSH-UHFFFAOYSA-N 293.287 -0.019 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)N2CCOCC2)c1[N+](=O)[O-] 1324938713 IWXUYBCUTLRDHO-UHFFFAOYSA-N 297.271 -0.785 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[C@H](F)CN1 1329348565 FZXIRNKAVINBSX-BQBZGAKWSA-N 271.252 -0.242 5 20 CBBD C[C@@]1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CNCCO1 1576341934 PCNMAAVKSASNCZ-NSHDSACASA-N 283.288 -0.714 5 20 CBBD NC[C@]12CC[C@@H]1CCN2C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1580253442 MQUFHILZQSEPEJ-RAIGVLPGSA-N 295.343 -0.035 5 20 CBBD C[C@@H](OC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)C(=O)O 1593600976 BXYIWYZCUSNQPZ-SCSAIBSYSA-N 271.185 -0.473 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1CCn1cc([N+](=O)[O-])cn1 174871184 CHYOXCBEYRFMBO-VIFPVBQESA-N 288.329 -0.090 5 20 CBBD NC(=O)[C@@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 228681528 IUXRARSVPVCQJO-UWVGGRQHSA-N 269.257 -0.936 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@]1(C(=O)O)CCOC1 262097861 MKNORFAILQLWMI-LLVKDONJSA-N 298.255 -0.459 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H](C)CO 305273587 UVGHASBNZQKXIN-ZETCQYMHSA-N 256.262 -0.061 5 20 CBBD CCN1CCC[C@@H]1CNC(=O)Cn1cnc([N+](=O)[O-])n1 330574784 LJDXSNVRDKOXAP-SECBINFHSA-N 282.304 -0.213 5 20 CBBD CN(C[C@@H](O)CO)C(=O)Cc1ccc([N+](=O)[O-])cc1 355612471 AONPXBAOKDHPKF-LLVKDONJSA-N 268.269 -0.051 5 20 CBBD CN(C)C(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])n[nH]1 556836763 AWFQCOFGJOJKJQ-UHFFFAOYSA-N 269.261 -0.086 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCC1=NNC(=O)C1 588876135 VXCSAPYRVGXPKH-UHFFFAOYSA-N 294.271 -0.436 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1[C@@H]1CCN(CC(=O)O)C1=O 596014168 RVXSDCXBRDGEST-SECBINFHSA-N 295.251 -0.077 5 20 CBBD COC(=O)c1cnc(N2C[C@@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 598630578 ZPWFRCLWVMZDEF-PSASIEDQSA-N 297.267 -0.434 5 20 CBBD O=C(NS(=O)(=O)[C@@H]1CCOC1)c1ccc([N+](=O)[O-])[nH]1 733721383 QWYNKCQQAMLKEW-ZCFIWIBFSA-N 289.269 -0.229 5 20 CBBD Cc1cc(C(=O)NCCn2ncnn2)c(N)c([N+](=O)[O-])c1 761705388 HREVPDLYQAUROY-UHFFFAOYSA-N 291.271 -0.098 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c([N+](=O)[O-])c1 763696902 MWVCGYNTZSBQMP-JTQLQIEISA-N 281.268 -0.260 5 20 CBBD NC(=O)CONC(=O)c1ccc([N+](=O)[O-])cc1O 773596447 LARAQLSHKYRFKD-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD CC(C)OC(=O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 796150384 KRCPBMJCWXYKAW-UHFFFAOYSA-N 256.218 -0.001 5 20 CBBD O=[N+]([O-])c1ccn(-c2ccnc(-c3nn[nH]n3)n2)n1 1593487436 XRNDLFXPEVLWHU-UHFFFAOYSA-N 259.189 -0.249 5 20 CBBD COCCOCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 47630907 XXRZDYHFPWNEAH-UHFFFAOYSA-N 286.288 -0.039 5 20 CBBD CC[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCO1 49151816 FMEWDSAGCDFEPQ-QMMMGPOBSA-N 269.261 -0.176 5 20 CBBD Cn1cc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 140259401 PRJWZYGYAIJYMS-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 330780382 DPDMONDLHOGRTL-SECBINFHSA-N 282.256 -0.490 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 344254326 KYCOGGIVPDALEP-LURJTMIESA-N 295.255 -0.585 5 20 CBBD Cn1cnc(CNc2ncc([N+](=O)[O-])c(N)n2)n1 351506180 RRAJQCMXQYMADI-UHFFFAOYSA-N 250.222 -0.292 5 20 CBBD COCC[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 436982456 XJVWDTZQXUBRMV-MRVPVSSYSA-N 297.267 -0.079 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCn2nnnc21 568800180 JWWZSCATQZZKRG-UHFFFAOYSA-N 278.232 -0.785 5 20 CBBD CNc1nc(C(=O)N2CC(C)(C(N)=O)C2)ccc1[N+](=O)[O-] 576945241 LKLOEBDPNNCHOL-UHFFFAOYSA-N 293.283 -0.021 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@@H]2C[C@H]1CN2 602588650 NIXIDTNCQYWFOP-IUCAKERBSA-N 265.273 -0.328 5 20 CBBD NS(=O)(=O)[C@H]1CCN(c2ncccc2[N+](=O)[O-])C1 609574961 FBCVOHWOGODPQK-ZETCQYMHSA-N 272.286 -0.143 5 20 CBBD CCS(=O)(=O)CC(=O)OCCn1ccc([N+](=O)[O-])n1 748121691 CBHMWSDEYTZUTR-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD Cc1nn(C)c(C(=O)O[C@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 798604107 PDBMVJAPOVHOBJ-LURJTMIESA-N 296.239 -0.401 5 20 CBBD NC(=O)[C@H](CO)Nc1nc2ccccn2c1[N+](=O)[O-] 804789942 VDSSAFXLDLOLBF-LURJTMIESA-N 265.229 -0.499 5 20 CBBD CN1CC[C@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 847789770 HDMFQHKMCPMWBG-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cc([N+](=O)[O-])ccc2N)CCOC1 848317807 JBWFGGWNPSIPCE-GFCCVEGCSA-N 294.267 -0.449 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccon1 973062314 ZWJAIGNZIYAVBC-FDDDBJFASA-N 294.267 -0.283 5 20 CBBD C/C=C(/C)C(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042430640 CLVIYTIFUSKOLV-HJBJALMNSA-N 297.311 -0.693 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCn2cnnc2C1 1116025116 FGPHOLQVTXXRCF-UHFFFAOYSA-N 291.271 -0.185 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC2(CC1)NC(=O)NC2=O 1248485783 JBBHHWARWJSFGW-UHFFFAOYSA-N 294.271 -0.493 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](OCCO)C1 1320537395 ALQPIXDFQOZYGL-SECBINFHSA-N 298.299 -0.058 5 20 CBBD COC(=O)NC1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1321238926 DSLNYEYFFPSOKQ-SNVBAGLBSA-N 299.287 -0.808 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 1608676140 WCZABKMPRTVJKK-SSDOTTSWSA-N 284.224 -0.134 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CN3CCC2CC3)c1 37883515 RWIPLSSDLAJEDQ-QWHCGFSZSA-N 295.343 -0.164 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCNCC1 43403877 VCDNHGJKOFFDMM-UHFFFAOYSA-N 253.262 -0.387 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1ccc([N+](=O)[O-])o1 44248313 SERPHTQENLPJLJ-UHFFFAOYSA-N 277.258 -0.533 5 20 CBBD O=C1CN(CCn2cc([N+](=O)[O-])ccc2=O)CCN1 159703120 ZOLOCRWAYZKMPH-UHFFFAOYSA-N 266.257 -0.812 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC(F)(F)CO 186083828 QQLNBRXOVUALJS-UHFFFAOYSA-N 276.199 -0.071 5 20 CBBD C[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@@H](C(N)=O)C1 186971037 CGSNJUHBVYALTK-DTWKUNHWSA-N 295.299 -0.096 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCCNC1 237577584 DQDOBIRSUSUHLA-SECBINFHSA-N 267.289 -0.032 5 20 CBBD CCNC(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 263942757 FSDHLAJCBGCUGD-RXMQYKEDSA-N 254.250 -0.097 5 20 CBBD NC(=O)[C@@H]1CSCCN1CCn1ccc([N+](=O)[O-])n1 271542127 KFHWVKSSAGUPBZ-QMMMGPOBSA-N 285.329 -0.306 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1ccccc1=O 353606323 QSALBLASTJMNHV-UHFFFAOYSA-N 291.267 -0.231 5 20 CBBD COC(=O)c1cnc(NC[C@H](O)CO)c([N+](=O)[O-])c1 357700355 SVLYAVGWMXUVKY-ZETCQYMHSA-N 271.229 -0.459 5 20 CBBD COC[C@H](O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 548985521 UZXVKAPFJTYLLU-SSDOTTSWSA-N 291.285 -0.725 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCNC[C@@H]1O 710425561 ZXGXVILSABKBCA-WPRPVWTQSA-N 268.273 -0.614 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)CN1CCCC1 808222796 XXKCYDMJEOVLBG-JTQLQIEISA-N 297.315 -0.636 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccc([N+](=O)[O-])cc1 816733086 IXOWHVRFHNXHNV-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD Cn1ncc(C(=O)NCCNc2ncccc2[N+](=O)[O-])n1 1093726695 YGTCHWOZNGKFPA-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD NC(=O)NCC(=O)NCCCNc1ncccc1[N+](=O)[O-] 1094298240 ZISUTVFWUZHCAY-UHFFFAOYSA-N 296.287 -0.424 5 20 CBBD O=C(NCC1(CO)CCOCC1)c1c[nH]nc1[N+](=O)[O-] 1321242276 BMGQEZUOBTUAON-UHFFFAOYSA-N 284.272 -0.163 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@@]2(CNCCO2)C1 1580008914 GPXRFEXIFRNQMQ-LLVKDONJSA-N 267.289 -0.103 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 1601749048 ABUAMAFAGUKUKU-UWVGGRQHSA-N 284.272 -0.299 5 20 CBBD COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 71336931 CDJFODRACXUUGF-YFKPBYRVSA-N 286.196 -0.066 5 20 CBBD COCCN(CCn1cc([N+](=O)[O-])cn1)CC(=O)N(C)C 174863436 YJNMUKMOJGPBBA-UHFFFAOYSA-N 299.331 -0.172 5 20 CBBD CCc1[nH]nc(C(=O)N2CCNC(=O)[C@@H]2C)c1[N+](=O)[O-] 192500600 ZJDRKCKXCYWYHH-LURJTMIESA-N 281.272 -0.159 5 20 CBBD O=C(O)CNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 262648651 RMOJDOOPGXMEEO-UHFFFAOYSA-N 295.251 -0.085 5 20 CBBD CCOC(=O)CN(C)c1ncc([N+](=O)[O-])c(N)n1 270397032 UNQCGAKWDKZVCA-UHFFFAOYSA-N 255.234 -0.034 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC[C@@H]1CCCNC1 311901285 PXORZQIWOVOGCS-MRVPVSSYSA-N 268.277 -0.698 5 20 CBBD CCn1cc(S(=O)(=O)NCCN(C)C)c([N+](=O)[O-])n1 330461953 XUSBISCQVMLEDU-UHFFFAOYSA-N 291.333 -0.349 5 20 CBBD CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1COC[C@@H]1O 343616902 AUJQWGDKYJKUBR-QWRGUYRKSA-N 281.268 -0.110 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCOC[C@H]1c1ncon1 354417835 XFGTXMFWCXAWKY-ZETCQYMHSA-N 294.227 -0.085 5 20 CBBD CCn1cc(S(=O)(=O)N(C)C[C@H](C)O)c([N+](=O)[O-])n1 360409530 XSTTUWGGAOEIAN-ZETCQYMHSA-N 292.317 -0.188 5 20 CBBD NS(=O)(=O)c1c(NC[C@@H](O)CO)cccc1[N+](=O)[O-] 559626372 NVDAGZNUVJNFQI-ZCFIWIBFSA-N 291.285 -0.993 5 20 CBBD Nc1nccc(C(=O)N2CCc3nn[nH]c3C2)c1[N+](=O)[O-] 581952822 WGHVNDZNQCMUEK-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD C[C@H](N)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 592546921 LMOOXYCHDGUNFF-ZETCQYMHSA-N 254.246 -0.780 5 20 CBBD O=C(NC[C@@H](O)C(F)(F)F)c1c[nH]nc1[N+](=O)[O-] 619839644 NWVXMNALMRELBT-SCSAIBSYSA-N 268.151 -0.029 5 20 CBBD NC(=O)CONC(=O)CNc1ccccc1[N+](=O)[O-] 777823292 IIWQBKMFLFAINN-UHFFFAOYSA-N 268.229 -0.460 5 20 CBBD C[C@@H](COC(=O)CCCN1C(=O)CNC1=O)[N+](=O)[O-] 813107621 PHSFWKDQMZLFGI-ZETCQYMHSA-N 273.245 -0.473 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1C[C@H](O)[C@@H](O)C1 862582122 KHRSHUARJVOQPO-UWVGGRQHSA-N 285.231 -0.506 5 20 CBBD Cc1cc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)no1 990171208 NFIUNRPFFIPCDF-PSASIEDQSA-N 294.267 -0.411 5 20 CBBD CC(=O)N1CCC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1074379184 CAXSDXQPXFWGHQ-NXEZZACHSA-N 285.300 -0.859 5 20 CBBD Cc1cnc(NCCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1094079557 OOICZTFFMSZUSG-UHFFFAOYSA-N 267.245 -0.688 5 20 CBBD Cc1cnc(N(C)CCCNC(=O)C(N)=O)c([N+](=O)[O-])c1 1095719249 XHJMVAIGKCAHRP-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD CNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1325036641 XLQUDYYTFVNMLK-ZETCQYMHSA-N 282.256 -0.993 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CNCCCO2)c1[N+](=O)[O-] 1326170423 VTQZQOWLWZEHEY-MRVPVSSYSA-N 283.288 -0.265 5 20 CBBD CN(C)S(=O)(=O)C[C@H](NCC[N+](=O)[O-])C(F)(F)F 1336819531 NWKKLZCAGWGLCV-LURJTMIESA-N 293.267 -0.325 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN1CCn1cc([N+](=O)[O-])ccc1=O 1601771886 HZWKYPQHUFIMEN-ZJUUUORDSA-N 297.267 -0.724 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 37269335 MNMYLIICNPVFMK-UHFFFAOYSA-N 289.269 -0.594 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CCO1 112669520 HOHCJRFFCRFCNL-JTQLQIEISA-N 297.267 -0.053 5 20 CBBD CC[C@@H]1C(=O)NCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 173777956 CCDKOQRGAVWUJF-WDEREUQCSA-N 297.315 -0.637 5 20 CBBD NC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 238072006 BHARJEUIYYKVJH-SNVBAGLBSA-N 280.284 -0.390 5 20 CBBD CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 265885650 MRCUTRPJDLMFOG-UHFFFAOYSA-N 267.245 -0.908 5 20 CBBD COCCN1CCN(c2ncc([N+](=O)[O-])c(C)n2)CC1=O 297363236 CGWHUIHXJJMZDR-UHFFFAOYSA-N 295.299 -0.012 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(C)(C)C(N)=O 356432443 WFNZDUAOCSYUEG-UHFFFAOYSA-N 269.261 -0.430 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCN1CCNC(=O)C1 541903946 KMBPLNBBHKYXKC-UHFFFAOYSA-N 295.299 -0.905 5 20 CBBD O=C(O)c1ccnc(N2CC[C@@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 569728658 UCIPTXWVNPEVJV-CBAPKCEASA-N 297.267 -0.133 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCN2CC[C@H]1C2 597707531 DLXZNEDTBUMJFS-ZETCQYMHSA-N 251.246 -0.152 5 20 CBBD CN(CCO)c1ncnc(N2CCOCC2)c1[N+](=O)[O-] 598585336 ZWZDUGWPZFFJFO-UHFFFAOYSA-N 283.288 -0.350 5 20 CBBD COC(=O)COCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 600394119 KEGISMDQQZMUAD-UHFFFAOYSA-N 299.239 -0.385 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCCn1cncn1 604437891 PPIGIOANXMSJEW-UHFFFAOYSA-N 293.287 -0.021 5 20 CBBD CN1CC[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 734894466 DSCDIXBITTYFLH-SECBINFHSA-N 282.256 -0.045 5 20 CBBD C[C@H]1[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)CC(=O)N1C 806071948 CLZUEGCPGJTRDX-IONNQARKSA-N 282.256 -0.046 5 20 CBBD O=CN1CCC(OC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1342578915 BYASXIQESIDCGS-UHFFFAOYSA-N 282.256 -0.045 5 20 CBBD CC(C)CONC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1343184486 NBVPRNPQCNYJTF-UHFFFAOYSA-N 299.287 -0.389 5 20 CBBD CN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])cnc1N 1593721025 FJZDOKPYYIQINF-UHFFFAOYSA-N 254.202 -0.271 5 20 CBBD Cn1nncc1Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1601044647 JKZIPZQDAQPINJ-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1F 38102933 BKANZPJCZMQQOZ-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD NS(=O)(=O)c1ccc(N2CC(O)C2)c([N+](=O)[O-])c1 57839080 FZXLXVPFSPIYBH-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCn2ccnn2)c1 126822134 UJKMAVRUKMNPKW-JTQLQIEISA-N 281.276 -0.967 5 20 CBBD O=C(O)CNC(=O)CNC(=O)Cc1cccc([N+](=O)[O-])c1 228391338 OXCXTRFIZBZRDG-UHFFFAOYSA-N 295.251 -0.546 5 20 CBBD N[C@@H]1CCC[C@H]2CN(C(=O)Cn3cnc([N+](=O)[O-])n3)C[C@H]12 342763781 YVOSJJLIJYIDJQ-LPEHRKFASA-N 294.315 -0.228 5 20 CBBD CO[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361371678 IKCQFSKWNDMRBJ-WDEREUQCSA-N 270.289 -0.127 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1C[C@@H](O)C[C@@H]1CO 371525405 MNNGAMLPEFDMCR-ZJUUUORDSA-N 295.295 -0.039 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 436992383 VFOHJGSPJWKJQX-VIFPVBQESA-N 298.251 -0.046 5 20 CBBD C[C@@H](O)[C@@H](CO)Nc1nccc(C(=O)O)c1[N+](=O)[O-] 564732760 PIAXCQYQGRGUSL-IYSWYEEDSA-N 271.229 -0.158 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@@H](C(=O)O)C1CC1 574282104 YQXDZSFNLKQOAX-SECBINFHSA-N 297.271 -0.046 5 20 CBBD Nc1ccc(N[C@@H]2CCCN(CCO)C2=O)nc1[N+](=O)[O-] 596197121 UGDXZDBNSQKLMT-SECBINFHSA-N 295.299 -0.033 5 20 CBBD CS(=O)(=O)NC1CN(c2cccnc2[N+](=O)[O-])C1 599149728 VAEZGUITNWMDQF-UHFFFAOYSA-N 272.286 -0.272 5 20 CBBD C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 599532779 YDMLIWIKDNHGFH-UWJYBYFXSA-N 295.295 -0.041 5 20 CBBD CC(C)(C(=O)OCC(=O)NC(N)=O)n1cc([N+](=O)[O-])cn1 726662059 XRMDNTLYEPGOTA-UHFFFAOYSA-N 299.243 -0.736 5 20 CBBD C[C@](O)(CO)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 798264704 SPPQBRQAJKGNRR-LLVKDONJSA-N 299.239 -0.024 5 20 CBBD C[C@@H](CC(=O)O)C(=O)OCCn1cnc([N+](=O)[O-])n1 827342643 XIAMSFRNISOWLD-LURJTMIESA-N 272.217 -0.160 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCCN1CCOCC1 919678437 UGRNXWAKCXRUBE-UHFFFAOYSA-N 285.260 -0.938 5 20 CBBD NC(=O)CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 1096997946 OPPWWAHEGRUQMA-ZKCHVHJHSA-N 293.283 -0.076 5 20 CBBD COCC1(O)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1319761430 AEICMTNQOXMUKZ-UHFFFAOYSA-N 298.299 -0.209 5 20 CBBD Cn1cnnc1CCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1344026991 BEBVURLSQTZHAD-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD CNc1nccc(C(=O)NCCNCCOC)c1[N+](=O)[O-] 1578763838 QADUSJDYCXBSKN-UHFFFAOYSA-N 297.315 -0.003 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCOC1 48978543 CJCQTCOGHBDTPG-MRVPVSSYSA-N 254.246 -0.056 5 20 CBBD C[C@H]1[C@@H](C)NCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262704942 BJMCSOPRDMHVDQ-ZJUUUORDSA-N 294.311 -0.035 5 20 CBBD C[C@@H](CC(=O)O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 263016593 RYTVHPFIWWKZAT-ZETCQYMHSA-N 283.240 -0.264 5 20 CBBD CC(CO)(CO)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 273128372 BDPUZJCKBPTSLA-UHFFFAOYSA-N 299.239 -0.024 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] 345205761 VTFRGUUWMYEIKH-JTQLQIEISA-N 298.251 -0.133 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[C@@H]1O 352661011 QEMYBLCNIUGYTB-TUAOUCFPSA-N 284.316 -0.003 5 20 CBBD COC(=O)c1n[nH]cc1NC(=O)Cn1ccc([N+](=O)[O-])n1 357196201 GKTSMYCWFNWAJM-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD CCN(CC(=O)O)C(=O)c1c([N+](=O)[O-])cnn1C 431450314 QAFUVWGBJOHILY-UHFFFAOYSA-N 256.218 -0.125 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC[C@]1(O)CCCOC1 593884859 YVMWDNWYUCOBKR-GFCCVEGCSA-N 298.299 -0.161 5 20 CBBD COCC1(O)CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 596250634 JLUANMHEXXORQZ-UHFFFAOYSA-N 281.268 -0.109 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)Nn1c(O)nnc1O 816732930 BYVRQIRXMKEKBE-UHFFFAOYSA-N 295.211 -0.253 5 20 CBBD CN1CC[C@H](OC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 848786324 GAZLOTNVWVHNFP-ZETCQYMHSA-N 280.240 -0.041 5 20 CBBD Nc1nc(N2CCn3cnnc3C2)ncc1[N+](=O)[O-] 1318303421 BPXPOGBJUOUNBQ-UHFFFAOYSA-N 262.233 -0.421 5 20 CBBD CS(=O)(=O)CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321460673 CSUBDTVOFYOCJC-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD C[C@@H](CCO)N(C)C(=O)Cn1cnc([N+](=O)[O-])n1 1328832940 SYTHLCOZDMPDOC-ZETCQYMHSA-N 257.250 -0.584 5 20 CBBD Cn1ncnc1COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1339999938 XVJNXRBJORRKBI-UHFFFAOYSA-N 293.239 -0.372 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC(O)(C(=O)O)CC2)c1[N+](=O)[O-] 1599968076 JUENJAPQYDQPKR-UHFFFAOYSA-N 298.255 -0.322 5 20 CBBD C[C@@H](O)[C@H](O)CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1603694016 NAVLGOHTNLWCCH-IYSWYEEDSA-N 295.259 -0.677 5 20 CBBD CN(CC(N)=O)c1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 1604716358 AYJJERDAGRDTOT-UHFFFAOYSA-N 277.244 -0.304 5 20 CBBD C[C@@H](CCCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 94943785 BGOOTWCJJHRNEH-GXSJLCMTSA-N 272.305 -0.097 5 20 CBBD CN1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1=O 119374596 BRNVZXUNYVJTLX-UHFFFAOYSA-N 292.295 -0.032 5 20 CBBD O=C(O)c1cnc(N2CCN(CCO)CC2)c([N+](=O)[O-])c1 162366389 POWUMADVWHEWSL-UHFFFAOYSA-N 296.283 -0.198 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H](O)C1 210191454 SCUYPMLUYCSDLF-QMMMGPOBSA-N 287.297 -0.187 5 20 CBBD CNC(=O)c1ccc(NC[C@@H](O)CO)c([N+](=O)[O-])c1 211243358 ZMEVVKVYKNQVLL-MRVPVSSYSA-N 269.257 -0.281 5 20 CBBD O=C(O)c1cnc(N2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 236617717 OUVNNMAMBHDMFI-OCAPTIKFSA-N 269.213 -0.770 5 20 CBBD CC1(C)C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285338559 OOFBORMDYXXGJP-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD CCNC(=O)NCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 294088760 QIDYJJYJMPHDBO-UHFFFAOYSA-N 297.271 -0.256 5 20 CBBD CN(c1ncc([N+](=O)[O-])c(N)n1)[C@H]1CCNC1=O 340081084 NBJHSMFFIOQHPQ-YFKPBYRVSA-N 252.234 -0.708 5 20 CBBD Cc1nc(=NC(=O)Cn2cc([N+](=O)[O-])nc2C)n(C)[nH]1 348266709 JQIZZVRVWASJHT-UHFFFAOYSA-N 279.260 -0.403 5 20 CBBD NC(=O)[C@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1F 357267615 JRFXTNOGWQWYCA-MRVPVSSYSA-N 286.219 -0.298 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@]2(O)CCN(C)C2)c1[N+](=O)[O-] 358428515 WRLBPSWOQCUIKK-GFCCVEGCSA-N 297.315 -0.323 5 20 CBBD CNC[C@@H]1C[C@H](F)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 366935525 SWRQYZBCIQJSNS-IUCAKERBSA-N 285.279 -0.050 5 20 CBBD CN1CCC(N2CC[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 369276899 JBKFULFDPMWCHH-CYZMBNFOSA-N 296.371 -0.064 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CCNCC1 428648427 LLXJLLDEMSYVQM-UHFFFAOYSA-N 296.331 -0.879 5 20 CBBD NC(=O)[C@H]1CC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 580568796 PQRVMRUKYJWNPK-DTWKUNHWSA-N 281.272 -0.581 5 20 CBBD Cc1c(CNC(=O)C2(O)CNC2)cccc1[N+](=O)[O-] 595952890 BYXGYXOLJIZEIW-UHFFFAOYSA-N 265.269 -0.146 5 20 CBBD Nc1ccc(NCCCN2CCNC(=O)C2)nc1[N+](=O)[O-] 596173137 QVCJBQUVOCMNDS-UHFFFAOYSA-N 294.315 -0.194 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1 609531299 NJQSGJQSFRSCAK-NSHDSACASA-N 295.343 -0.091 5 20 CBBD CN1CC[C@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 734890180 JPOORBQIHLDVBB-ZETCQYMHSA-N 268.229 -0.435 5 20 CBBD O=C(OCCO)c1ccc(C(=O)OCCO)c([N+](=O)[O-])c1 785309801 GKXYCCIYNRGWLX-UHFFFAOYSA-N 299.235 -0.107 5 20 CBBD C[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnnn1C 787650766 RBTOAIQVRJYXAT-ZCFIWIBFSA-N 281.232 -0.381 5 20 CBBD Nc1nccc(C(=O)NN2CCOCC2)c1[N+](=O)[O-] 848371498 XDWXFSCVKHQUAL-UHFFFAOYSA-N 267.245 -0.451 5 20 CBBD CN(C)C(=O)OCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 855648572 VOJJSDUOTLTIEO-UHFFFAOYSA-N 271.233 -0.254 5 20 CBBD CC(C)=CC(=O)N(CCO)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1056870372 CMDHMMUOTBZMGM-GHMZBOCLSA-N 299.327 -0.445 5 20 CBBD CN(CCN(C)c1ccc([N+](=O)[O-])cc1)C(=O)C(N)=O 1105543411 ZUADLHXWTQXOBI-UHFFFAOYSA-N 280.284 -0.025 5 20 CBBD CN1CCN(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 1139589492 FTCWTGUCHNTKOU-GHMZBOCLSA-N 268.317 -0.890 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1322159762 ZTSZHHBNXZTTAU-NSHDSACASA-N 286.288 -0.236 5 20 CBBD Nc1nccc(C(=O)N2CCCN(C=O)CC2)c1[N+](=O)[O-] 1327608381 QLEHLSVOCWFQLD-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD CCOC(=O)[C@@H]1CNCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1329490505 LUDCUJVNCZJIRF-QMMMGPOBSA-N 297.271 -0.705 5 20 CBBD C[C@@]1(CO)CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@]1(C)CO 1331710974 IQGWWWGIWIVMMW-TXEJJXNPSA-N 298.299 -0.229 5 20 CBBD Cc1nn(C)c(C(=O)NCC(C)(CO)CO)c1[N+](=O)[O-] 1344029962 BBYBEYNXRGTKSS-UHFFFAOYSA-N 286.288 -0.643 5 20 CBBD O=C(O)[C@@H]1CNCCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 1601850291 LGYAPGXHDKBURI-VIFPVBQESA-N 297.271 -0.934 5 20 CBBD O=C(O)c1ccc([N+](=O)[O-])c(NCCn2cnnn2)n1 1777680555 LMFAZDSFLFRVAT-UHFFFAOYSA-N 279.216 -0.213 5 20 CBBD Nc1c(C(=O)NCCN2CCNCC2)cccc1[N+](=O)[O-] 125712731 SXVVXSWZRZWDTM-UHFFFAOYSA-N 293.327 -0.188 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCC(=O)NC1CC1 192572609 VOTWOLSZYGSOAV-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 272726178 ACXCDOJZXITLAW-MRVPVSSYSA-N 282.256 -0.490 5 20 CBBD O=C1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CN1C1CC1 279198499 USZMIFIVHSVIAP-NSHDSACASA-N 295.299 -0.584 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 298715140 OCCDPVVFGYXMLZ-QMMMGPOBSA-N 281.272 -0.342 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)C[C@H](CO)O1 299962557 LESXYHMDAANYGA-VXNVDRBHSA-N 254.246 -0.029 5 20 CBBD CN(CCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 343173105 ZDFJKJUOLMSQAS-UHFFFAOYSA-N 255.230 -0.793 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCS(=O)(=O)CC1 354887646 HHFLFELYHUBVNZ-UHFFFAOYSA-N 273.270 -0.207 5 20 CBBD NC(=O)NC(=O)CCCn1cc([N+](=O)[O-])ccc1=O 357025148 CEMHDELDQRYQNH-UHFFFAOYSA-N 268.229 -0.268 5 20 CBBD C[C@@H]1CCN[C@H](C)[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 357295160 JTWOCKPBKPGEJD-NQMVMOMDSA-N 282.304 -0.311 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 361027914 BSGZGZBJSOFSHL-ZETCQYMHSA-N 269.261 -0.439 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H](CO)O1 408281700 WGDHVAQWTADZNC-HTQZYQBOSA-N 284.272 -0.450 5 20 CBBD O=C(NCCn1ncnn1)c1ccc([N+](=O)[O-])[nH]1 433927029 PBCNIUBVNYDZSZ-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD CC1=NNC(=O)[C@H]1CCNC(=O)c1cc([N+](=O)[O-])n[nH]1 552011146 YZQQWRRRKRDKFW-LURJTMIESA-N 280.244 -0.440 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCN(C)C[C@@H]1CN 563101638 KEQTVOSKDVQDGS-JTQLQIEISA-N 296.331 -0.799 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CC[C@@H](CO)C2)c1 584530136 MZVPPZVCQAOOML-JFGNBEQYSA-N 284.316 -0.097 5 20 CBBD CNc1nccc(C(=O)NCC2(CO)CC2)c1[N+](=O)[O-] 594312524 LNZJUDPSOJRZTD-UHFFFAOYSA-N 280.284 0.534 5 20 CBBD Nc1ccc(N2CC[C@H](S(N)(=O)=O)C2)nc1[N+](=O)[O-] 596122666 ALVCJOSGVZRGCC-LURJTMIESA-N 287.301 -0.561 5 20 CBBD COC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1OC)C(N)=O 793736674 AOIWXNIYAZMFPT-MRVPVSSYSA-N 297.267 -0.167 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1 798248028 MBEDYZMKGHRZNG-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD Cn1ncc(CCCNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 817973597 LELXMNTVZCIMLK-UHFFFAOYSA-N 293.287 -0.331 5 20 CBBD NC(=O)CCn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 833081556 FZNPXASLRWMIEB-UHFFFAOYSA-N 255.186 -0.670 5 20 CBBD O=C(O)[C@@H](O)C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 833771271 ZGZUTGAWQNLRAC-NSHDSACASA-N 298.299 -0.051 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@](C)(C(N)=O)C1 1116872051 WXWMHFCTWABSFM-LLVKDONJSA-N 281.272 -0.334 5 20 CBBD CC(=O)N1CC[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1261773133 UALLZNZJFXKREK-PWSUYJOCSA-N 297.315 -0.637 5 20 CBBD C[C@H](N)C[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 1329518838 CMJGZYGSHIBLSG-BQBZGAKWSA-N 256.266 -0.572 5 20 CBBD Nc1nccc(C(=O)NC[C@H](F)C(=O)O)c1[N+](=O)[O-] 1601221726 NTVPUBYIRZNQQT-YFKPBYRVSA-N 272.192 -0.276 5 20 CBBD COCCOCCNC(=O)Cn1cc([N+](=O)[O-])cn1 42780081 NSZXTTXPMRDXPY-UHFFFAOYSA-N 272.261 -0.430 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)CCS(C)(=O)=O 176228332 CIHDXLRXSHZJHO-UHFFFAOYSA-N 276.318 -0.232 5 20 CBBD C[C@@H](O)CN(CCO)CCn1cc([N+](=O)[O-])ccc1=O 289738514 JKPINJNVOOHFKC-SNVBAGLBSA-N 285.300 -0.568 5 20 CBBD Cn1cnc(CNC(=O)c2ccc([N+](=O)[O-])n2C)n1 351532016 IEQSULUXLHAUAJ-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD O=C1NC(=O)N2CCN(c3ccc([N+](=O)[O-])cn3)C[C@H]12 351902567 ZYOUQBQGCSPHAP-MRVPVSSYSA-N 277.240 -0.270 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[S@]1=O 352258658 ZGIMARYTQFPCQY-DMWPKQFHSA-N 271.302 -0.076 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN1CCOCC1 356478892 MNONPSWHVFCASZ-UHFFFAOYSA-N 283.288 -0.610 5 20 CBBD NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 362476697 MFAUVDZCPNHTJX-SFYZADRCSA-N 296.287 -0.653 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@](O)(C3CC3)C2)c1 365851938 XQDDKFZPPAVKDZ-CHWSQXEVSA-N 296.327 -0.001 5 20 CBBD NCC1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC1 428122255 SEYIPAMGQICWNL-UHFFFAOYSA-N 294.311 -0.046 5 20 CBBD CCOC[C@@H](O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 433357382 XHKIRBLYCYNSNP-JTQLQIEISA-N 286.288 -0.305 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCC(N)=O)c1[N+](=O)[O-] 433684020 GYMGHSTWASFRGN-UHFFFAOYSA-N 255.234 -0.344 5 20 CBBD COC(=O)[C@H](C)N(C)C(=O)c1c([N+](=O)[O-])cnn1C 435957054 UJGQIPADDRXLQD-LURJTMIESA-N 270.245 -0.038 5 20 CBBD O=C(N[C@H]1CC[S@](=O)C1)c1cnc(O)c([N+](=O)[O-])c1 445009640 MZNAQXRUBJJKHQ-IIYDVTGLSA-N 285.281 -0.054 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 517391490 LNPLGRJUZLEXQQ-LURJTMIESA-N 266.213 -0.590 5 20 CBBD CCN(CC(N)=O)S(=O)(=O)c1cccnc1[N+](=O)[O-] 530388686 FNZSMZZRKODTKU-UHFFFAOYSA-N 288.285 -0.514 5 20 CBBD CNc1nccc(C(=O)N2CCOC[C@H](O)C2)c1[N+](=O)[O-] 594366774 JNKDXTNDUJUAQP-MRVPVSSYSA-N 296.283 -0.135 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1[C@H]2CNC[C@H]12 598917033 QIAGGXCLKFAEAU-UWVGGRQHSA-N 290.279 -0.133 5 20 CBBD COC[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C(N)=O 760081243 HGHHFRCCMFQZLZ-SECBINFHSA-N 296.283 -0.377 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C(N)=O 791399933 VBNLAKHVKKOYLU-BYPYZUCNSA-N 270.220 -0.080 5 20 CBBD O=C(O)[C@H]1CCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 821512009 VHIRXIYNDMGAHL-MRVPVSSYSA-N 295.251 -0.168 5 20 CBBD CC(=O)NCC1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCOCC1 1070114107 BKTMBGRNTNVSFO-NXEZZACHSA-N 285.300 -0.547 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC1CCNCC1 1118194387 NSNNQFVYHMXPIR-UHFFFAOYSA-N 268.277 -0.698 5 20 CBBD Cc1ccc(S(=O)(=O)NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1348609046 SDLDLQPBUZBGQV-RKDXNWHRSA-N 285.281 -0.140 5 20 CBBD COC[C@H]1CNCCN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1578993148 ADMBTNGSFFNHSJ-MRVPVSSYSA-N 283.288 -0.313 5 20 CBBD C[C@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 42696055 WVKYCSQYQSVGGZ-SSDOTTSWSA-N 270.245 -0.030 5 20 CBBD O=C(O)[C@H]1COCCN1c1ncc([N+](=O)[O-])cn1 88377537 GFKOVKCUZBVIOS-SSDOTTSWSA-N 254.202 -0.325 5 20 CBBD NC(=O)N1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 171495754 ORVGCFMHTQOEMR-UHFFFAOYSA-N 296.287 -0.596 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C 264484325 JCNOESKHYGUMSZ-MRVPVSSYSA-N 295.299 -0.013 5 20 CBBD COC(=O)[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCOC1 268093246 UWXVHDHZKUQWMX-LLVKDONJSA-N 298.255 -0.760 5 20 CBBD COC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])c(C)cc1=O 268449691 ABAIQFYYPZPZIA-UHFFFAOYSA-N 297.267 -0.256 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC(=O)N2CCC2)c1=O 345286153 OMAWEMARGAXGJF-UHFFFAOYSA-N 295.251 -0.225 5 20 CBBD COc1ccc(=O)n(Cc2c([N+](=O)[O-])ncn2C)n1 355974267 ZEZSZJGRAXYBMD-UHFFFAOYSA-N 265.229 -0.058 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CSc1nc(=N)[nH]c(=N)[nH]1 356551423 AVQXIOHTIWXDNH-UHFFFAOYSA-N 282.289 -0.369 5 20 CBBD CN1CC[C@](O)(CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1 358043427 HOEPZCGMFVLZGN-LBPRGKRZSA-N 297.315 -0.636 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC(CC(N)=O)C1 358102307 ZCSQVEAVULROBZ-UHFFFAOYSA-N 295.299 -0.176 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 445194520 OQIBOONJTMBQAX-ZCFIWIBFSA-N 280.240 -0.344 5 20 CBBD CC(C)N(CC(N)=O)C(=O)c1ccnc(N)c1[N+](=O)[O-] 555306480 JSRPJMRBQFMVCA-UHFFFAOYSA-N 281.272 -0.092 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 593813506 GNKKQBPGVXAIKV-OLQVQODUSA-N 281.272 -0.126 5 20 CBBD C=CC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 732098624 XHEVFQHVTUHOOV-UHFFFAOYSA-N 281.272 -0.482 5 20 CBBD CNC(=O)c1ccc(NC[C@@H](O)C(=O)NC)c([N+](=O)[O-])c1 757702141 JTCSACZUTJOKBC-SNVBAGLBSA-N 296.283 -0.527 5 20 CBBD C[C@@H](COC(=O)Cn1nnc2ccccc2c1=O)[N+](=O)[O-] 813113588 GRUHQXQYZWGAHR-QMMMGPOBSA-N 292.251 0.000 5 20 CBBD CCn1nncc1C(=O)OCCn1cnc([N+](=O)[O-])n1 815972728 OVMQNGRFSJOYAM-UHFFFAOYSA-N 281.232 -0.345 5 20 CBBD O=C(O)[C@@H]1C[C@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 833181571 PZLMAMXJCPFQPM-PHDIDXHHSA-N 270.201 -0.550 5 20 CBBD Cc1nccnc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292894 AMKOUPMVFXVTKE-ZYHUDNBSSA-N 291.311 -0.249 5 20 CBBD CN1C[C@@H](NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1=O 1116345283 OAJLXVZSDNHXTD-QMMMGPOBSA-N 294.267 -0.897 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@H]([C@@H](C)N)C2)c1[N+](=O)[O-] 1118139944 DBUAKYRRZQNGHY-APPZFPTMSA-N 297.315 -0.175 5 20 CBBD CN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@H]1CCNC1 1326274938 DVRRVWOIEQQPQG-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD C[C@@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1 1334336436 BOMYZADHLUSODA-MWLCHTKSSA-N 269.305 -0.554 5 20 CBBD CC[C@H](C(=O)O)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1350847552 PUOGBBVGWHOIDP-NXEZZACHSA-N 286.288 -0.053 5 20 CBBD O=C(Cc1cccc(F)c1[N+](=O)[O-])NCC1(O)CNC1 1580573550 BIRZBIHZMUBYFT-UHFFFAOYSA-N 283.259 -0.273 5 20 CBBD O=[N+]([O-])c1cn(C[C@H]2COCCO2)nc1-c1nn[nH]n1 1593486611 CJJUNCUCPRUWJY-LURJTMIESA-N 281.232 -0.613 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C(=O)O 37434935 GLDWOTUXDWXEFH-SCSAIBSYSA-N 255.186 -0.514 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H](O)CN1 37668500 POHDPCZDTWUIJU-WDEREUQCSA-N 265.269 -0.066 5 20 CBBD COC[C@@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 262282692 UVBZWXFFCVOQDY-SNVBAGLBSA-N 286.244 -0.603 5 20 CBBD O=C(CNC(=O)c1csc([N+](=O)[O-])c1)NCCO 269501890 VFANJUCUHZJUHT-UHFFFAOYSA-N 273.270 -0.505 5 20 CBBD O=C1CN(CCNc2ccc([N+](=O)[O-])cn2)CCN1 272737285 CHIUUOGZHUTCCR-UHFFFAOYSA-N 265.273 -0.167 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1COC[C@H]1O 287258531 KQDNFAAQRDEURT-HTQZYQBOSA-N 255.230 -0.245 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@@H]2CCN(C)C2=O)c1[N+](=O)[O-] 341733954 SUOOVFVLVUYDQX-MRVPVSSYSA-N 295.299 -0.061 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 443037011 NATAQSVIVWLPNO-IYSWYEEDSA-N 267.245 -0.428 5 20 CBBD CN1C[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 576987684 VUTHGNBXGSOXRQ-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD CN1CCNC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1 591684178 CDYMBOVICPTXIH-JTQLQIEISA-N 296.331 -0.799 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])nc1C 593816955 UUFVKVUDBNSJBZ-NXEZZACHSA-N 298.299 -0.292 5 20 CBBD CN(C)[C@@H]1CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 597534334 WRWHAFRHXVJTQX-RKDXNWHRSA-N 282.304 -0.215 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N(CCO)CCOCCO 600123773 JFKAOCOALZDWAG-UHFFFAOYSA-N 288.256 -0.369 5 20 CBBD NC(=O)NCCCOC(=O)Cn1cc([N+](=O)[O-])cn1 735898073 VRZZVVVAJCXLPA-UHFFFAOYSA-N 271.233 -0.607 5 20 CBBD O=C(O)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 821525635 ZDEXAOGOGMYYHP-UHFFFAOYSA-N 269.213 -0.653 5 20 CBBD C[C@H]1COC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 928893091 KIZUOEDDEOCMOD-JGVFFNPUSA-N 254.246 -0.058 5 20 CBBD O=C(N[C@H]1C[C@H](NCC(=O)N2CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020138997 LWCOKHFKGWGFLQ-GWOFURMSSA-N 296.327 -0.879 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 1116902480 NREJPQQBNDTWEB-QMMMGPOBSA-N 293.287 -0.160 5 20 CBBD C[S@](=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 1251903206 XEBMGVVQAQGMTH-KRWDZBQOSA-N 260.275 -0.714 5 20 CBBD CCc1[nH]nc(C(=O)NCC(=O)NC)c1[N+](=O)[O-] 1321174115 HJZRWMMJRVWELW-UHFFFAOYSA-N 255.234 -0.644 5 20 CBBD Nc1nc(N2CCC3(CC2)CC(=O)N3)ncc1[N+](=O)[O-] 1344028544 ALVWWLFIRUTUIN-UHFFFAOYSA-N 278.272 -0.174 5 20 CBBD O=C(c1[nH]nc([N+](=O)[O-])c1Cl)N1CCOC12CNC2 1580808598 JBNODZUTTBHTQX-UHFFFAOYSA-N 287.663 -0.257 5 20 CBBD C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C(=O)O 54310789 KAIMDYZQOUYTHZ-RXMQYKEDSA-N 269.213 -0.266 5 20 CBBD CN(CC(=O)O)C(=O)CCn1cc([N+](=O)[O-])cn1 237139927 SZTJXKWOWOZKPJ-UHFFFAOYSA-N 256.218 -0.276 5 20 CBBD COC(=O)CNC(=O)COc1ncc(C)cc1[N+](=O)[O-] 267427861 VXQZQMMQSPSCNZ-UHFFFAOYSA-N 283.240 -0.034 5 20 CBBD COCCN(CCN(C)C)C(=O)c1n[nH]cc1[N+](=O)[O-] 270804976 OKVXLTDMMSKDRG-UHFFFAOYSA-N 285.304 -0.032 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1OC 277860520 NZICFHWMYUSYJW-AOOOYVTPSA-N 284.272 -0.337 5 20 CBBD O=C(NC[C@@H](O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 354059143 PBAVCJXOEQUMMZ-HTRCEHHLSA-N 270.245 -0.555 5 20 CBBD CN(C)S(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]1 357430367 ALQISCGSJCFHGE-UHFFFAOYSA-N 290.301 -0.456 5 20 CBBD CN1CCC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1=O 359022043 WFINENSJIOZWHK-ZCFIWIBFSA-N 266.261 0.000 5 20 CBBD Cn1cnnc1CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 444861301 SJPBSMMTJVXDOA-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD C[C@@H](CO)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 533187244 IOSQKJQBKMWCBE-LURJTMIESA-N 261.259 -0.351 5 20 CBBD CC(=O)NCCN(C)CCn1ccc([N+](=O)[O-])n1 583498102 YIOSGBSMEUGQGS-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCCCN1 588848105 OZSGDSXRQHHEMT-UHFFFAOYSA-N 266.257 -0.117 5 20 CBBD Nc1nccc(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 594336877 OKGBDADPWSNDLN-RXMQYKEDSA-N 265.229 -0.810 5 20 CBBD Nc1ccc(N2CC[C@H](CO)[C@@H](O)C2)nc1[N+](=O)[O-] 596207973 UDFSAPXFGRWXCG-APPZFPTMSA-N 268.273 -0.249 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCN2C(=O)NC[C@@H]2C1 602777229 CHJLWLGTYHWLCO-SNVBAGLBSA-N 294.315 -0.191 5 20 CBBD O=C(NCc1nn[nH]n1)c1cc([N+](=O)[O-])ccc1O 611534913 ZLSAIIGCBBFLQV-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(NCCO)CC1 686269991 HLILAPYDWPSXIC-UHFFFAOYSA-N 269.305 -0.121 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 819253195 PDSHBOGIZKHRQI-LURJTMIESA-N 269.217 -0.881 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@H]1O 824999986 LYXYBFKZBCJCDO-IMTBSYHQSA-N 291.271 -0.013 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1ccc([N+](=O)[O-])[nH]1 862737253 PZWDYYLSMKONFV-UHFFFAOYSA-N 288.285 -0.702 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCO)C1 950055625 HLAMKLHNJQHANT-NXEZZACHSA-N 257.290 -0.823 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC1(C(N)=O)CCOCC1 1261779443 MMNIBTBUZWBRTB-UHFFFAOYSA-N 296.283 -0.302 5 20 CBBD CCN(CC)C(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1332382976 BXDHGNFZKIISFG-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD C[C@@H](c1nnc(N(C)CCN2CCOCC2)n1C)[N+](=O)[O-] 1339666748 IHZWRSZSRWCNTK-JTQLQIEISA-N 298.347 -0.079 5 20 CBBD CCOC(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1525342776 SVZRCMPMFFDYRR-UHFFFAOYSA-N 298.303 -0.130 5 20 CBBD CN(CCNC(=O)c1ccc([N+](=O)[O-])o1)CC(=O)O 1598493360 YMFAKIKMTKCTIG-UHFFFAOYSA-N 271.229 -0.066 5 20 CBBD CC[C@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 1604912423 GTOBLCPBYVDEOV-KOLCDFICSA-N 286.288 -0.005 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 7020477 VNZFXJNXBNBKMN-QMMMGPOBSA-N 296.283 -0.603 5 20 CBBD N[C@H]1C[C@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 36263980 XLALOFDZCLCXBP-NKWVEPMBSA-N 257.271 -0.027 5 20 CBBD NC(=O)c1ccc(CN2C[C@@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 186519776 PGCQDIKYMJFMTI-QWRGUYRKSA-N 295.295 -0.379 5 20 CBBD CNC(=O)c1ccc(N2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 234341279 XECGIVBYYORXPN-QWRGUYRKSA-N 281.268 -0.504 5 20 CBBD NC(=O)COCCNC(=O)COc1ccccc1[N+](=O)[O-] 269551459 UHDMNASINJWVAH-UHFFFAOYSA-N 297.267 -0.408 5 20 CBBD COC[C@H](CO)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 280288177 AAMMSRXJFDDYOD-VIFPVBQESA-N 297.267 -0.343 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CN(C)NC2=O)c1 349672510 VXYWMDRVAWBEDM-VIFPVBQESA-N 294.267 -0.322 5 20 CBBD O=C(CNC(=O)c1n[nH]cc1[N+](=O)[O-])NCC1CC1 351512716 OXTMXDUYZUGPIR-UHFFFAOYSA-N 267.245 -0.426 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)CCC1=O 357043186 HAUZAUNJWWLCNE-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN2C(=O)OC[C@@H]2C1 371992108 NSHUTKWPZINBOU-XLPZGREQSA-N 255.230 -0.685 5 20 CBBD COC(=O)[C@H]1CN(C)CCN(c2c([N+](=O)[O-])ncn2C)C1 413505580 VBGIFJXAPMVXQJ-VIFPVBQESA-N 297.315 -0.131 5 20 CBBD CC[C@]1(O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 495194067 NNGSRXUOCYYIJJ-NEPJUHHUSA-N 284.316 -0.001 5 20 CBBD O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[C@H](O)CO 516569505 RHRVPWMIZOEPCZ-ZETCQYMHSA-N 281.224 -0.235 5 20 CBBD COC(=O)c1cnc(N2C[C@@H](O)[C@H](OC)C2)c([N+](=O)[O-])c1 598633054 JDRHREIISWSKTN-NXEZZACHSA-N 297.267 -0.028 5 20 CBBD O=C(O)c1nn(C[C@H]2COCCO2)cc1[N+](=O)[O-] 690803896 YDMBTRTUQVXUHE-LURJTMIESA-N 257.202 -0.095 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1csc([N+](=O)[O-])c1 768806028 SXXAOIDAUIRKAF-UHFFFAOYSA-N 279.299 -0.238 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCOC(=O)C1CC1 773453162 FXLXILMGTGZBHU-UHFFFAOYSA-N 282.256 -0.139 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)C1 1020533157 JEOJUJXFCSXLKW-MGCOHNPYSA-N 292.295 -0.183 5 20 CBBD O=C1[C@@H](NCC[N+](=O)[O-])CCN1C1CCOCC1 1336134721 CMLATWIODMEJAC-JTQLQIEISA-N 257.290 -0.367 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC(CO)CC1 1339664187 DXHHWEWHLCNPOE-UHFFFAOYSA-N 255.278 -0.200 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCNC1=O 1341406302 YBMDSXGJLBTADD-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD CC(C)CNC(=O)CNC(=O)c1cc([N+](=O)[O-])n[nH]1 1342284142 WEIPKJZKYKNRAE-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD CN1CCN(C2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)CC1 1344028384 UKOUYAULGOIMNF-UHFFFAOYSA-N 294.315 -0.610 5 20 CBBD CN1CC[C@@H](Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1 1591179332 JOSHKUBJBSCQAB-SSDOTTSWSA-N 278.276 -0.077 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCNC1 126846357 QOOWJTQBPSZHCH-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CC(=O)NC1=O 299537297 PRBDBBLHONXZKT-MRVPVSSYSA-N 295.255 -0.945 5 20 CBBD C[C@H](O)C[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 330386747 BGPUXRLZEFKYFV-DTWKUNHWSA-N 283.288 -0.052 5 20 CBBD C[C@@H]1CN(C)CCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 331256446 WKMZPVSXSYSIOG-ZYHUDNBSSA-N 283.332 -0.212 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1O 351853079 BLSYFAJBKPIBEK-JGVFFNPUSA-N 254.246 -0.370 5 20 CBBD C[C@H](CC(N)=O)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 359719070 WMPDWABHRRYUDL-SSDOTTSWSA-N 283.288 -0.094 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 359719072 WMPDWABHRRYUDL-ZETCQYMHSA-N 283.288 -0.094 5 20 CBBD O=C(O)[C@@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 401912711 MOLCGTMVKWYEOU-SVRRBLITSA-N 283.240 -0.170 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 416207670 WPFWSBPEBFMSEM-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD CN(CC(C)(C)CN)C(=O)Cn1cnc([N+](=O)[O-])n1 429506857 XRGUXBPSSMBVJC-UHFFFAOYSA-N 270.293 -0.370 5 20 CBBD Cc1ncc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c(N)n1 565267568 PQOLSMDIMSAFMJ-UHFFFAOYSA-N 291.271 -0.212 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@@H]([C@H](C)N)C1 592308960 PHBNDTVNNFTAOA-WCBMZHEXSA-N 297.315 -0.326 5 20 CBBD COC(=O)[C@@H]1CNCCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 592549919 PTVKUHSMENWCLY-JTQLQIEISA-N 296.283 -0.100 5 20 CBBD Cc1[nH]nc(C(=O)NCc2nnnn2C2CC2)c1[N+](=O)[O-] 610303602 WCCZILKACIYDPG-UHFFFAOYSA-N 292.259 -0.122 5 20 CBBD O=C1[C@H]2C[C@H]2C(=O)N1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 611165799 QHUZKJPNXXPYFM-XHNCKOQMSA-N 280.240 -0.843 5 20 CBBD O=C(NCc1nn[nH]n1)c1ccc(O)c([N+](=O)[O-])c1 612544489 METQEUGGRXVPRG-UHFFFAOYSA-N 264.201 -0.257 5 20 CBBD CCNS(=O)(=O)CCNc1ncc([N+](=O)[O-])c(N)n1 731662928 JOUPBKMSGMJHEH-UHFFFAOYSA-N 290.305 -0.682 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1C[C@H]2C[C@]2(CO)C1 782977333 NMXQJXIGOJTWRS-BXKDBHETSA-N 295.299 -0.185 5 20 CBBD O=C(N[C@@H]1CC(=O)N(C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 839699397 WTNKQQNICAVETE-FTLITQJKSA-N 253.258 -0.469 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](N2CCOC2=O)C1 855501031 RZCSYRNETICIIN-ZETCQYMHSA-N 295.255 -0.015 5 20 CBBD CN[C@@H]1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923284985 YNKQMICAKXOZRF-ZYHUDNBSSA-N 283.332 -0.164 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCCO)C1 950055572 DDGYPJOSHIZOSA-GHMZBOCLSA-N 271.317 -0.433 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ncc[nH]1 973241792 GGSPMAMWOBQKQT-FNCVBFRFSA-N 293.283 -0.548 5 20 CBBD Cn1nnc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)n1 1094043038 UCRDWKYFNXIDFO-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD Cc1nn(C)c(C(=O)N[C@@]2(CO)CCOC2)c1[N+](=O)[O-] 1116584100 AGWKYISEYJBUHO-LLVKDONJSA-N 284.272 -0.482 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOCCN1 1118768671 DJCOIGHOHDLBNO-UHFFFAOYSA-N 255.234 -0.695 5 20 CBBD Cn1cnnc1CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1141343742 ZEBMQHHVKCKSBE-HTQZYQBOSA-N 253.262 -0.471 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1nnn(C)n1 1320903488 MBHXVKSNCWBIJC-UHFFFAOYSA-N 294.275 -0.670 5 20 CBBD COCC[C@H](CO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1321164215 CZIGPWYYPYWKMQ-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD Cc1[nH]nc(C(=O)NCC(=O)NCC(F)F)c1[N+](=O)[O-] 1326893846 GHKHGBAWCXJYOZ-UHFFFAOYSA-N 291.214 -0.263 5 20 CBBD N#CN1CCC(OC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1344812734 KUAWRFHEPWXNSA-UHFFFAOYSA-N 280.244 -0.325 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)CCC(C)(C)[N+](=O)[O-] 1606464803 NYIOTBKSXVFSEC-UHFFFAOYSA-N 290.272 -0.092 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1CCn1cc([N+](=O)[O-])ccc1=O 90552533 JEQRKJGWIKTBNR-CMPLNLGQSA-N 297.311 -0.162 5 20 CBBD C[C@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 132961183 OZFZTGIYSMVMKZ-SCZZXKLOSA-N 258.278 -0.487 5 20 CBBD CC[C@](C)(NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 133429072 SYSNYXRTHUZPPT-KOLCDFICSA-N 285.304 -0.604 5 20 CBBD C[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](CO)O1 248961604 GPCDSDBSJPYTOJ-ONGXEEELSA-N 270.289 -0.127 5 20 CBBD CN[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 261689397 IFJCSOHYHHCKTK-QMMMGPOBSA-N 268.277 -0.603 5 20 CBBD C[C@H]1OCC[C@]1(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 279058557 BIWPTQPWIURNIN-SKDRFNHKSA-N 298.299 -0.163 5 20 CBBD CN1CC[C@H]2OCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1 285642838 FLVBLHBFVKPUGN-VHSXEESVSA-N 295.299 -0.137 5 20 CBBD O=[N+]([O-])c1cccc2ncnc(NC[C@@H](O)CO)c12 347411772 RVPSLJPDAFQXGJ-SSDOTTSWSA-N 264.241 0.303 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 351853792 MPSNWCXLUFCQAY-SCZZXKLOSA-N 281.268 -0.404 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1[C@@H]2CNC[C@@H]21 366599685 OFEZKWGBFROZDT-MBTKJCJQSA-N 251.246 -0.875 5 20 CBBD CN1CCC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 548955860 QUERUQVPWJAXHN-SSDOTTSWSA-N 267.245 -0.332 5 20 CBBD NS(=O)(=O)c1ccc(NC(CO)CO)cc1[N+](=O)[O-] 596137212 JEFGSGJUMPKHPD-UHFFFAOYSA-N 291.285 -0.993 5 20 CBBD COCC[C@@H](NC(=O)N=c1cc[nH]cc1[N+](=O)[O-])C(N)=O 611599044 JQCFLIMXBXPJFG-MRVPVSSYSA-N 297.271 -0.576 5 20 CBBD Cc1nnc(S)n1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 764347176 IQTUHOIKXVIQJK-UHFFFAOYSA-N 297.300 -0.063 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2C[C@@]2(CO)C1 783816900 ZORPWDWROORMQV-ZANVPECISA-N 293.279 -0.403 5 20 CBBD O=C(NOCCO)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 787294988 RYDXFUHICVMYPM-UHFFFAOYSA-N 293.239 -0.171 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)[C@@H]1CCCN(C(N)=O)C1 814042190 HVCIVECMHVIVRE-HTQZYQBOSA-N 259.262 -0.015 5 20 CBBD O=C1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CCN1 823535877 KVBIIQGPTCDQRL-UHFFFAOYSA-N 290.243 -0.894 5 20 CBBD O=C(O)NCCC(=O)OCCn1cc([N+](=O)[O-])cn1 832605264 OACJWABCMWCAEZ-UHFFFAOYSA-N 272.217 -0.008 5 20 CBBD CO[C@@H]1COCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783669 JZDXGELBDKKLQV-ZYUZMQFOSA-N 258.274 -0.181 5 20 CBBD O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H](O)CO)c1 843064567 ZIBTVPFIKWJUDG-QWRGUYRKSA-N 256.258 -0.429 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 863704200 DHJWVEIXQMAKJP-SSDOTTSWSA-N 299.287 -0.376 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(N2CCOCC2)C1 911653697 DGJDWMWSAWCZNG-UHFFFAOYSA-N 295.299 -0.666 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1(CO)CCC1 1118742281 MMYVUJLODOUAGL-UHFFFAOYSA-N 254.246 -0.027 5 20 CBBD O=C(NCCNCc1ccon1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932269 PJRLIGGGPHKXOL-RKDXNWHRSA-N 254.246 -0.454 5 20 CBBD Cc1nc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n[nH]1 1157767577 RCMPYCTZPDOQTM-RKDXNWHRSA-N 282.304 -0.626 5 20 CBBD CCCNC(=O)COC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253428717 VXECXSZPDFGHQH-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD CN1CC[C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1=O 1329965824 ISLMOCRUNQJQFR-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD CN(CC(=O)NC1CC1)c1nccc(C(N)=O)c1[N+](=O)[O-] 1330029984 QBJVUAHRLGDHLD-UHFFFAOYSA-N 293.283 -0.197 5 20 CBBD Cc1nn(C)c(N2CCC(N)(CO)CC2)c1[N+](=O)[O-] 1330999264 YZNMOOMMLQKWAY-UHFFFAOYSA-N 269.305 -0.073 5 20 CBBD N[C@H](CC(F)F)C(=O)NCCn1cc([N+](=O)[O-])cn1 1332151331 BABXBZDWBJLWCI-SSDOTTSWSA-N 277.231 -0.110 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)[C@@H]2CCOC2)c1=O 1342569916 LRGWGULNIZYLDW-SSDOTTSWSA-N 295.251 -0.539 5 20 CBBD C[C@H]1CCCN1C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1347107106 ZGNGQNJTIWAEOW-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CN(CCn1cccn1)c1nnc(C[N+](=O)[O-])n1C 1350599935 WLHPWNYSVAQKKK-UHFFFAOYSA-N 265.277 -0.075 5 20 CBBD C[C@H](NC(=O)c1c([N+](=O)[O-])cnn1C)c1nnnn1C 1514769376 ONNKORKHEJDQDC-YFKPBYRVSA-N 280.248 -0.657 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1C[C@@H](C(=O)O)C1 1594713774 DDMXLWZAKRIBEI-OCAPTIKFSA-N 295.251 -0.264 5 20 CBBD Nc1ccc(C(=O)N2C[C@H](O)C[C@@H]2C(=O)O)cc1[N+](=O)[O-] 1601213971 APHKXJBVTYPONM-GMSGAONNSA-N 295.251 -0.163 5 20 CBBD O=C(O)c1ccnc(N2CC(CO)(CO)C2)c1[N+](=O)[O-] 1602480395 AMRWOLGJYPEFAE-UHFFFAOYSA-N 283.240 -0.521 5 20 CBBD NC(=O)c1ccc(N2CCO[C@@H](C(=O)O)C2)c([N+](=O)[O-])c1 43703174 CWFXPDMNBCISAE-SNVBAGLBSA-N 295.251 -0.017 5 20 CBBD COc1ccc(C(=O)N2C[C@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 234917936 PMWDBJNUMFKLMO-UWVGGRQHSA-N 282.252 -0.219 5 20 CBBD Cc1nn(CCC(=O)Nc2nn[nH]n2)c(C)c1[N+](=O)[O-] 342861657 UMWZLRFCKLUFIP-UHFFFAOYSA-N 280.248 -0.050 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 343174035 FZYUKYRDFKYMRJ-YFKPBYRVSA-N 253.218 -0.592 5 20 CBBD O=C(NCCn1ncnn1)c1cc([N+](=O)[O-])ccc1O 436966623 NZDVOUAMKBBJLB-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD CCS(=O)(=O)CC(=O)NCCn1cc([N+](=O)[O-])cn1 493054368 NTXDGSPNMBWJCB-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 549760944 MFKMCTJHXUJQEC-MRVPVSSYSA-N 295.255 -0.945 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3CC[C@@H](CO)[C@H](O)C3)nn12 572419231 FRDZSMRGEXPKHA-DTWKUNHWSA-N 293.283 -0.183 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H](CCO)C(F)F)c1 578651922 PSGNGLYKWNIPGG-DTWKUNHWSA-N 294.258 -0.242 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)OCCN1CCOCC1 747694342 NZVACIUJTGWXSE-UHFFFAOYSA-N 298.299 -0.025 5 20 CBBD CCN1C(=O)[C@H]2CN(CC[N+](=O)[O-])CCN2C1=O 929809477 KSZWMAABWJTQFU-MRVPVSSYSA-N 256.262 -0.769 5 20 CBBD Cc1nc(NC/C=C\CNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1107480705 RIMRQYSSQAQLSR-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(O)(C2CC2)C1 1116942232 MEJYVQALUHLMKW-UHFFFAOYSA-N 252.230 -0.085 5 20 CBBD Cc1c[nH]cc([N+](=O)[O-])c1=NCC(=O)N1CCN(C)CC1 1120809451 JWYJQUVWTVSZLI-UHFFFAOYSA-N 293.327 -0.094 5 20 CBBD NC(=O)CN1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 1318765448 FQFLWOHUSVNPKA-MRVPVSSYSA-N 295.299 -0.398 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1320414057 YYPDNUJMFNZGTG-RKDXNWHRSA-N 298.299 -0.060 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 1339096615 XCLSQCGRRKAAEV-BDAKNGLRSA-N 298.299 -0.548 5 20 CBBD C[C@@](CO)(NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)O 1592745415 ULDRWEOHMZMDPF-NSHDSACASA-N 284.224 -0.134 5 20 CBBD O=C(O)C[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCOC1 1601930720 NZTXLNUAKZJRHT-XLDPMVHQSA-N 272.257 -0.208 5 20 CBBD O=C(O)COCCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl 1602081008 ZEPJQPUTRXPUGH-UHFFFAOYSA-N 292.635 -0.198 5 20 CBBD O=C(NC[C@@H](C(=O)O)[C@@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1608418832 TWENINXTICDJBE-RNFRBKRXSA-N 298.255 -0.215 5 20 CBBD COC[C@](C)(NCCn1cc([N+](=O)[O-])ccc1=O)C(=O)O 1610244979 XASLHXSLFJAGQO-LBPRGKRZSA-N 299.283 -0.164 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1csc([N+](=O)[O-])c1 37563273 YXNHIJQTZFETGO-LURJTMIESA-N 274.254 -0.080 5 20 CBBD COCCN(CC(=O)O)C(=O)Cn1ccc([N+](=O)[O-])n1 50162278 BBWHDJKWBXBSKU-UHFFFAOYSA-N 286.244 -0.649 5 20 CBBD COC(=O)C1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 120008655 OQAOKPBKQMBQCX-UHFFFAOYSA-N 268.229 -0.387 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C(=O)O 237648211 WLAFJLIYFNZTDY-RXMQYKEDSA-N 256.218 -0.311 5 20 CBBD CC(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 284962592 LAEMOAOXVPNYMT-UHFFFAOYSA-N 255.234 -0.428 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](CO)[C@H]2CCCO2)c1[N+](=O)[O-] 344922542 PGKBTSYTKMGWKK-JGVFFNPUSA-N 284.272 -0.104 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)OC 347846797 CMVKJURQZIYINI-MRVPVSSYSA-N 285.256 -0.149 5 20 CBBD CNC(=O)c1ccc(N2C[C@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 355549360 VSLFCWCPFBKVSV-VHSXEESVSA-N 295.295 -0.114 5 20 CBBD CNC(=O)[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 408167458 AIHWIPANUYCOHB-SSDOTTSWSA-N 269.261 -0.721 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@]2(O)CCO[C@H]2C)c1[N+](=O)[O-] 447741436 KYVMXOGLZMJCTR-CPCISQLKSA-N 284.272 -0.104 5 20 CBBD Cn1nnc(CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)n1 490575947 BOERKEMRCCJPHE-UHFFFAOYSA-N 294.275 -0.634 5 20 CBBD Nc1nccc(C(=O)NC[C@@H](O)C(F)F)c1[N+](=O)[O-] 515354739 HHYYEENAJQAUTP-RXMQYKEDSA-N 276.199 -0.072 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@H](CO)[C@H](O)C1 545282203 OZBAJGLZFCTLRJ-IONNQARKSA-N 269.257 -0.262 5 20 CBBD CNc1nccc(C(=O)NC[C@H](O)C2CC2)c1[N+](=O)[O-] 553199072 MZLOVXRQOAQDIA-VIFPVBQESA-N 280.284 0.532 5 20 CBBD C[C@@H](Sc1ncc([N+](=O)[O-])c(N)n1)C(=O)NC(N)=O 564587444 XGZSIAZXTVBBJJ-GSVOUGTGSA-N 286.273 -0.358 5 20 CBBD O=C(O)c1cnc(N2CC[C@@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1 592972984 NPXIVZZVZGLDHC-OIBJUYFYSA-N 297.267 -0.133 5 20 CBBD CN(C(=O)c1ccnc(N)c1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1 600580876 NWOFNBCHDVSKRV-LJGSYFOKSA-N 293.283 -0.092 5 20 CBBD COC[C@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1N)C(N)=O 760081116 FSQBMLSJUBGCEE-QMMMGPOBSA-N 296.283 -0.284 5 20 CBBD C[C@H]1CN(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C)CO1 855405959 BFKGWKHOGUUEHD-LMLFDSFASA-N 271.317 -0.123 5 20 CBBD O=C1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@H]2N1 855676975 MQPQOIZAKIGRHC-ZYUZMQFOSA-N 267.285 -0.221 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCO[C@@H]2COCC[C@@H]21 888784456 TXKLQYAXWBTYCT-UTINFBMNSA-N 256.258 -0.332 5 20 CBBD CC1(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 993612413 KKJYBKSYCDALRT-RKDXNWHRSA-N 267.285 -0.221 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CO)C(N)=O)c1 1117247297 PRNBSLOPUXMEPM-QMMMGPOBSA-N 267.241 -0.521 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1251261021 VAJSEGMEMWXZTI-LURJTMIESA-N 270.245 -0.072 5 20 CBBD C[C@H]1C[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CO1 1349444893 YCHBWEUTLOVERP-NKWVEPMBSA-N 255.234 -0.520 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ncn(CC(=O)O)n1 1594547961 DSNUWYHFQFJGSA-UHFFFAOYSA-N 294.227 -0.138 5 20 CBBD COC[C@@]1(C(=O)O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1599189825 AERFYCJGVHPXCZ-SOCHQFKDSA-N 272.257 -0.256 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@](C)(CO)C(=O)O 1607985607 YVEBXVOXDRQBKW-LLVKDONJSA-N 283.240 -0.136 5 20 CBBD O=C(O)[C@@H](CO)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 22222457 MUBAAHWCWSQLES-ZCFIWIBFSA-N 290.253 -0.681 5 20 CBBD O=[N+]([O-])c1cnc(N[C@H]2CCS(=O)(=O)C2)nc1 40454414 WCWALNFVMSZBOG-LURJTMIESA-N 258.259 -0.016 5 20 CBBD CNC(=O)C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 44686877 YVKPXUXEOJSYSD-UHFFFAOYSA-N 295.299 -0.224 5 20 CBBD C[C@]1(O)CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 124082434 ICPORKCTRWXGMI-RYUDHWBXSA-N 284.316 -0.001 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CCN1 140020526 WGMICMDCLGDYEV-MRVPVSSYSA-N 251.246 -0.747 5 20 CBBD N[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 157741629 SWIXFCVWTUMONO-MRVPVSSYSA-N 253.262 -0.259 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCNCC1 159355342 NOUPRQFXUSDTNO-UHFFFAOYSA-N 267.289 -0.078 5 20 CBBD COCCOCCNC(=O)c1cc([N+](=O)[O-])cnc1N 227885392 LPIBSTANNGOEPU-UHFFFAOYSA-N 284.272 -0.035 5 20 CBBD COC(=O)c1cnc(N2C[C@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 277519024 UYWKJUZVRSSMCP-DTORHVGOSA-N 283.240 -0.682 5 20 CBBD CC[C@@H](CO)NS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 343015631 RMDUQWSAZQAGML-ZETCQYMHSA-N 292.317 -0.140 5 20 CBBD Cn1c(C(=O)NCc2nc(O)n[nH]2)ccc1[N+](=O)[O-] 359273294 OGTYMZZGZWFCSO-UHFFFAOYSA-N 266.217 -0.313 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CN1 443037661 MBODOAQUZRXGKS-SSDOTTSWSA-N 285.281 -0.238 5 20 CBBD CN(Cc1nnnn1C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 444993787 BJFXOPVAIRDDMI-UHFFFAOYSA-N 293.243 -0.509 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cnc(O)c([N+](=O)[O-])c1 447636387 IXHFNSKHNBTQJL-UHFFFAOYSA-N 295.211 -0.656 5 20 CBBD CCN1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 452998998 UOVWMTRDGGGROX-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OC[C@H]1CNC(=O)O1 495714459 AZULBHJPYFBOJE-RXMQYKEDSA-N 270.201 -0.407 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NCCN1CCC1 533555574 HDIJMKQCQIBGSG-UHFFFAOYSA-N 286.313 -0.026 5 20 CBBD COCCn1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])n1 547757601 SBOXOCGETZVHHD-UHFFFAOYSA-N 280.244 0.413 5 20 CBBD O=C(C[C@H]1CNCCO1)NCCn1cc([N+](=O)[O-])cn1 572400801 AYENEJGIHAMQCF-JTQLQIEISA-N 283.288 -0.714 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)[C@H](N)C[C@@H]2C1 584124283 ABXSSGFWJGGGDF-HTQZYQBOSA-N 280.288 -0.924 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1ccc([N+](=O)[O-])o1 600808736 QLCLHRHPZPZAJV-QMMMGPOBSA-N 269.257 -0.016 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NCCOCCO 611018637 WEDPEQYMKDURLU-UHFFFAOYSA-N 291.285 -0.723 5 20 CBBD C[C@H]1CN(CC[N+](=O)[O-])C[C@@H](C)N1CC[N+](=O)[O-] 787740924 XLTHKDNDRQXBDM-AOOOYVTPSA-N 260.294 -0.066 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1ccccc1[N+](=O)[O-] 862738233 ZMWRVOZXQPBQGV-UHFFFAOYSA-N 299.308 -0.030 5 20 CBBD NC(=O)C(=O)NCCN(c1ncccc1[N+](=O)[O-])C1CC1 1101443472 HUQAICDYTMBGTK-UHFFFAOYSA-N 293.283 -0.440 5 20 CBBD Cc1nnsc1CNC(=O)Cn1cnc([N+](=O)[O-])n1 1117767388 LVSWGYDCIWTASL-UHFFFAOYSA-N 283.273 -0.337 5 20 CBBD CCn1nnc(C)c1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936492 LLKOKPCKPFCUKG-NXEZZACHSA-N 296.331 -0.523 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC1(CO)CC1 1319757105 VPHICQZTEDEROS-UHFFFAOYSA-N 254.246 -0.169 5 20 CBBD C[C@@H](O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1319949211 HHSWVWKPTPWNLJ-ZJUUUORDSA-N 295.295 -0.014 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1[C@@H]2CNC[C@@H]12 1580579107 XFRRLGJBMJLXCP-HTQZYQBOSA-N 265.273 -0.627 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1NCc1nc[nH]n1 1593469967 ALKHAIYMGVLRET-UHFFFAOYSA-N 288.231 -0.100 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N1CCN(CCO)CC1 33380389 RWWFESSQZGVXDH-UHFFFAOYSA-N 269.257 -0.062 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)NCc1nnn[nH]1 134752654 XFTSNQDDSSWNNT-UHFFFAOYSA-N 262.229 -0.033 5 20 CBBD COC(=O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173500526 PERDDESQEKOUHH-SECBINFHSA-N 272.261 -0.743 5 20 CBBD CNC(=O)[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 247226932 CZVQRAWAACHZFR-GHMZBOCLSA-N 297.315 -0.637 5 20 CBBD O=C1NC[C@H]2CN(c3ccc([N+](=O)[O-])cc3)CCN2C1=O 269018564 DGLSPDURIUWUQC-NSHDSACASA-N 290.279 -0.258 5 20 CBBD C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@H]1CO 276024988 SXXGIMLHFJSWIL-ONGXEEELSA-N 295.295 -0.014 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285182271 NZJQKOBFEPZDGU-ZETCQYMHSA-N 267.245 -0.202 5 20 CBBD O=C(NCC(=O)N1CCOCC1)c1ccc([N+](=O)[O-])o1 298787830 KJTUFZASHMLANN-UHFFFAOYSA-N 283.240 -0.224 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCCS1(=O)=O 330516857 FGUSJSODHVTRNF-UHFFFAOYSA-N 287.297 -0.208 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 347221584 CTLMVIXNQQPDTK-ZETCQYMHSA-N 281.272 -0.321 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(CCO)CC1 349259785 YRPDQWGJOUSLIW-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD C[C@@H]1COCCN1CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 352641808 YIFROSWEPFHUAG-MRVPVSSYSA-N 282.304 -0.479 5 20 CBBD O=C(Cc1ccccc1[N+](=O)[O-])NCCn1ncnn1 353022061 UKWPUBXPQDULNS-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD O=C1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CN1 353905792 DENGUZZNDSMZGX-QMMMGPOBSA-N 279.252 -0.022 5 20 CBBD NC(=O)C1(NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 354879843 RRVFLXLPGIEGBV-UHFFFAOYSA-N 292.251 -0.333 5 20 CBBD COCC(COC)NC(=O)c1cc([N+](=O)[O-])cnc1N 388504058 KDRJYGCJMNNUKR-UHFFFAOYSA-N 284.272 -0.037 5 20 CBBD CN1C(=O)CC[C@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1=O 425070998 JFHTYODNKANUME-LURJTMIESA-N 295.255 -0.795 5 20 CBBD CC(C)[C@@H](N)CNC(=O)Cn1cnc([N+](=O)[O-])n1 429178997 FWAPAEHCACAUPY-ZETCQYMHSA-N 256.266 -0.714 5 20 CBBD COc1c(C(=O)NC2=NCC(=O)N2)cccc1[N+](=O)[O-] 530527879 OWOXPNFPEAEYJW-UHFFFAOYSA-N 278.224 -0.181 5 20 CBBD Cc1ncc(CNC(=O)c2cc([N+](=O)[O-])nn2C)c(N)n1 581945717 MEWIOUCWQYODKJ-UHFFFAOYSA-N 291.271 -0.061 5 20 CBBD CN1CCN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC1 736866059 CEOHDXBXTWPZTH-UHFFFAOYSA-N 290.287 -0.078 5 20 CBBD CC(C)(C(=O)NCCn1ccnn1)n1cc([N+](=O)[O-])cn1 782492068 IUIKYSXRSLUGSW-UHFFFAOYSA-N 293.287 -0.066 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 803155273 NQALBIBHKOFKSU-ZCFIWIBFSA-N 267.245 -0.379 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)NCC(=O)O 827862148 VZRDUGOEMZWUAN-LURJTMIESA-N 297.223 -0.264 5 20 CBBD CCONC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 846496076 ISDDDSMQBKDZDG-UHFFFAOYSA-N 285.260 -0.635 5 20 CBBD Cn1cc(N2CC[C@H](NCC[N+](=O)[O-])C2=O)cn1 905122830 DPTZNGYAPGBOHD-VIFPVBQESA-N 253.262 -0.608 5 20 CBBD Cc1cnc(N2CCN(C(=O)C(N)=O)CC2)c([N+](=O)[O-])c1 1055999459 OJJQQJYYKGLSKZ-UHFFFAOYSA-N 293.283 -0.568 5 20 CBBD O=C(NCC1=CCNCC1)c1n[nH]cc1[N+](=O)[O-] 1328505365 ZUEKWUXYKGFRGX-UHFFFAOYSA-N 251.246 -0.033 5 20 CBBD NS(=O)(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 42632786 LLDAVNLVZNSXTE-UHFFFAOYSA-N 286.313 -0.080 5 20 CBBD Cn1cnn(CC(=O)NCc2ccc([N+](=O)[O-])cc2)c1=O 179441794 XYUHDANFKBYKHP-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD NC(=O)COCCNC(=O)c1cc([N+](=O)[O-])ccc1N 230413525 KGYRORYNPZCLSY-UHFFFAOYSA-N 282.256 -0.591 5 20 CBBD CCOC[C@H](O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 311743973 SGTQRRWGTUSXON-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD CC(=O)N[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])c2)C1 339651079 VLURFNHQKOPSHL-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CCNC1=O 340453184 BYCBRBKSARUSTB-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1cccc([N+](=O)[O-])c1N 355630656 MXRAJTFYWVJCHW-SSDOTTSWSA-N 269.257 -0.398 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NCC(=O)NCCO)c1 356526909 FFMGJKSCTNUAFN-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD Cn1ccc(CNC(=O)c2cc([N+](=O)[O-])nn2C)n1 356725756 FUPZBIPFGOCWGZ-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 438995854 DTFDIUIURFDOQP-UHFFFAOYSA-N 254.202 -0.699 5 20 CBBD C[C@@H](O)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](C)CO 442696082 SJYXYQAAMVGHPM-RNFRBKRXSA-N 272.261 -0.478 5 20 CBBD CN1CCC[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 519596159 KIBXWNZSBZUUKB-MNOVXSKESA-N 297.315 -0.637 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1cc[nH]n1 522783086 ISERFGVEDMRPDW-UHFFFAOYSA-N 277.240 -0.204 5 20 CBBD COC[C@@H](NC(=O)c1cc(C)cc([N+](=O)[O-])c1N)C(N)=O 760081109 FSQBMLSJUBGCEE-MRVPVSSYSA-N 296.283 -0.284 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NOC[C@H]1CCOC1 788116466 AAASAWQUSXIAFZ-VIFPVBQESA-N 297.267 -0.159 5 20 CBBD Cn1cc(N2C[C@H](C(=O)OCCC[N+](=O)[O-])CC2=O)cn1 860922782 XQEIUJWYDBJXAM-SECBINFHSA-N 296.283 -0.017 5 20 CBBD CN(C)C(=O)[C@@H]1CCCN1CCCNCC[N+](=O)[O-] 905088716 KJSPOPYOVWJQSP-NSHDSACASA-N 272.349 -0.205 5 20 CBBD CCN(CC(=O)NC)C(=O)Cn1ccc([N+](=O)[O-])n1 917123534 KGTHAFLJMBCDAQ-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 1116910484 HVQWCGSPGUXCBT-JTQLQIEISA-N 270.245 -0.492 5 20 CBBD COC1(CO)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 1118377580 CNEWYYWVCCGING-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD O=[N+]([O-])c1cccnc1N1CCN2CCOC[C@]2(CO)C1 1120876478 BVQPTXZVSBXLEV-CYBMUJFWSA-N 294.311 -0.127 5 20 CBBD C[C@@H](N)[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1261492166 SQKJFHHVHARPKG-RKDXNWHRSA-N 282.304 -0.228 5 20 CBBD CCn1ncnc1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1321312555 WQBMHUZRGQPJDL-UHFFFAOYSA-N 292.255 -0.485 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1599967320 JLWCZGFQLHBUSY-NSHDSACASA-N 298.255 -0.153 5 20 CBBD COC[C@H](C)NC(=O)NC(=O)Cn1cnc([N+](=O)[O-])c1 26980569 AZWMGXCMCGITNK-ZETCQYMHSA-N 285.260 -0.348 5 20 CBBD O=C(CNC1CC1)NCCn1cc([N+](=O)[O-])cn1 238166012 CROMFZBBTIPHRA-UHFFFAOYSA-N 253.262 -0.341 5 20 CBBD O=C(O)CSCCNC(=O)Cn1cc([N+](=O)[O-])cn1 262074799 JJOZRVHISMTFQX-UHFFFAOYSA-N 288.285 -0.275 5 20 CBBD Nc1ccc(C(=O)NCC(=O)NCCO)cc1[N+](=O)[O-] 268679336 TYVXZJCQTLNJDV-UHFFFAOYSA-N 282.256 -0.985 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@H]3[C@H](O)CC[C@H]3C2)c1 344067566 PVEHDEWHQRQEBL-WKSBVSIWSA-N 296.327 -0.145 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](CO)[C@@H](O)C1 564402039 SVHDYGUAUWNNAC-KCJUWKMLSA-N 295.295 -0.008 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCOCCF 598562346 VHBGNXIOCCLAIW-UHFFFAOYSA-N 287.247 -0.141 5 20 CBBD CON1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 854860951 TYGBGUDYZMNRDD-UHFFFAOYSA-N 269.261 -0.054 5 20 CBBD CN(CCNc1ncc([N+](=O)[O-])cc1F)C(=O)CC(N)=O 1101536829 CFYDNEVNEBIXHZ-UHFFFAOYSA-N 299.262 -0.125 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@]2(CCOC2=O)C1 1135068769 QPXSKEDMHAKDKW-XLDPMVHQSA-N 254.242 -0.183 5 20 CBBD COC[C@H]1CN(c2nnc(CCC[N+](=O)[O-])n2C)CCO1 1262859802 AVPALYAMXQAAMS-SNVBAGLBSA-N 299.331 -0.124 5 20 CBBD COCC[C@@H](CO)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1321326233 VLVVIIJADPVRJT-LURJTMIESA-N 258.234 -0.555 5 20 CBBD CCOC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1339257319 LRKPXXLHYQJIGT-QMMMGPOBSA-N 285.256 -0.747 5 20 CBBD O=C(O)C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 1601960202 XNZZRCFDJLCBRC-ZCFIWIBFSA-N 284.228 -0.366 5 20 CBBD O=C(O)[C@@H]1[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@H]21 1610803736 YIMUYGRVINVNDN-KCQQBQQISA-N 266.213 -0.280 5 20 CBBD CC[C@@](C)(NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 133428861 SYSNYXRTHUZPPT-GXSJLCMTSA-N 285.304 -0.604 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CCNC(=O)C1 272432711 LPKFJRYZNUVNAD-UHFFFAOYSA-N 264.241 -0.251 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 285303440 MGOIBRCFYJGANI-YFKPBYRVSA-N 253.218 -0.722 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H]2CNC[C@H]2C1 290073551 IJYSUAOJNZQNQO-UWVGGRQHSA-N 279.300 -0.141 5 20 CBBD CC(=O)NCCCNc1ncc([N+](=O)[O-])c(N)n1 298725058 PQEXUFMEGBAWCS-UHFFFAOYSA-N 254.250 -0.095 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN2C(=O)NC[C@H]2C1 353996474 DSVUQEPTNIGFJK-LURJTMIESA-N 280.244 -0.833 5 20 CBBD NCC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(F)F 581885038 BQXLPUCCIXZUKV-ZCFIWIBFSA-N 277.231 -0.110 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)CCOc1ccccc1[N+](=O)[O-] 597587603 ZNLPNSLHVDMGKP-VIFPVBQESA-N 297.267 -0.674 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)c1c[nH]nc1[N+](=O)[O-] 619788658 JFFWMXACEXCQFV-RQJHMYQMSA-N 279.256 -0.189 5 20 CBBD CNC(=O)CCOC(=O)Cn1ccc([N+](=O)[O-])n1 749046683 RDRSNUXJJCBLBN-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD CCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])cnc1N 757854023 UVWAHDWZHLQKPZ-UHFFFAOYSA-N 281.272 -0.220 5 20 CBBD Cn1cc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 991281250 RGLBVCADMDSNLW-NXEZZACHSA-N 293.283 -0.974 5 20 CBBD CCN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])c(C)n1 1100706182 RWVXGROQTYQVGY-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD CO[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCO1 1116895689 IITNWOOJOIDGRY-LBPRGKRZSA-N 297.267 -0.412 5 20 CBBD CN1CC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1322133534 MTUAEHUBCOQUKM-QMMMGPOBSA-N 283.244 -0.954 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1CCNC[C@H]1F 1580579150 ZFSMHYAVJVHNMJ-BDAKNGLRSA-N 298.274 -0.427 5 20 CBBD O=[N+]([O-])c1cnc(N2CCOCN2)c(-c2nn[nH]n2)c1 1593485533 CNNFYCATAXMDNM-UHFFFAOYSA-N 278.232 -0.531 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2C[C@H]3COC[C@@]3(C(=O)O)C2)n1 1594548846 WMGDLDXWPYVIJL-CPCISQLKSA-N 282.256 -0.134 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H](CF)C(=O)O)n1 1600969257 DHVMWGHKPJJCLS-SCSAIBSYSA-N 260.181 -0.519 5 20 CBBD CNC(=O)[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 48812612 GEGODZZOCQZWRB-LURJTMIESA-N 255.234 -0.958 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CCO1 50858671 BKYMDTLXUNBBJP-NSHDSACASA-N 293.279 -0.150 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCCS(N)(=O)=O 56850215 FOXWDROZPFAXLE-UHFFFAOYSA-N 288.285 -0.683 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](O)C(N)=O)n1 228771791 PRUYVIFGFFTNGN-SSDOTTSWSA-N 284.228 -0.966 5 20 CBBD COC(=O)c1cn(CCNc2c([N+](=O)[O-])ncn2C)nn1 286428806 LOVKUKHOGVCVMO-UHFFFAOYSA-N 295.259 -0.182 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCO[C@H](CO)C1 331187247 JFSCXSZSJKVZJN-JTQLQIEISA-N 284.272 -0.599 5 20 CBBD CCc1[nH]nc(C(=O)N(C)CC(N)=O)c1[N+](=O)[O-] 345632055 UEXSVUDWESQUJT-UHFFFAOYSA-N 255.234 -0.562 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1(c2nn[nH]n2)CC1 348294958 UPLAGBJJZUPIOP-UHFFFAOYSA-N 292.259 -0.500 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1)c1nn[nH]n1 358413581 NTMGVEAPJYEFQF-ZETCQYMHSA-N 294.275 -0.434 5 20 CBBD Cc1nn(C)c(N2CCCN(CC(N)=O)CC2)c1[N+](=O)[O-] 369385720 MEFYIPXBRXZMGL-UHFFFAOYSA-N 296.331 -0.366 5 20 CBBD NS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](O)CO 436436647 TYWAOLFCTPJNMD-ZETCQYMHSA-N 291.285 -0.993 5 20 CBBD Cc1nc(N2CCN3C(=O)[C@H](N)C[C@@H]3C2)ncc1[N+](=O)[O-] 581380853 HGWCRSKCBLGCBF-RKDXNWHRSA-N 292.299 -0.559 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@H]([C@@H](C)N)C1 592308958 PHBNDTVNNFTAOA-SCZZXKLOSA-N 297.315 -0.326 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H]1C(=O)O 595973400 LHKMYQHYNHNBJC-PHDIDXHHSA-N 267.245 0.124 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@@]2(O)CCS(=O)(=O)C2)nc1 599083954 RTMGXPTXMOHJFN-JTQLQIEISA-N 287.297 -0.049 5 20 CBBD CCc1[nH]nc(C(=O)OCc2nnn(C)n2)c1[N+](=O)[O-] 799509412 AGQICIRWBDVBNK-UHFFFAOYSA-N 281.232 -0.239 5 20 CBBD O=C(O)CCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 821517487 XTKCUVMCRPCIJR-UHFFFAOYSA-N 271.233 -0.443 5 20 CBBD O=C(O)CNC(=O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O 821533290 CWVWFBXIDXRXEK-UHFFFAOYSA-N 289.631 -0.389 5 20 CBBD CCS(=O)(=O)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1251559014 QDFIBBBOPPDRIQ-UHFFFAOYSA-N 290.301 -0.209 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCCNC1 1327074502 XCTGDKODOLVVBF-ZETCQYMHSA-N 254.250 -0.946 5 20 CBBD C[C@H]1NCC[C@@H]1NC(=O)c1nn(C)cc1[N+](=O)[O-] 1579505009 DRWYQCASERAOHX-RQJHMYQMSA-N 253.262 -0.192 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 1608602134 QAGSTWVTQDXFDJ-CBAPKCEASA-N 295.251 -0.103 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CCO1 50955621 BCSHJEMFGABQBO-QMMMGPOBSA-N 252.230 -0.320 5 20 CBBD NC(=O)c1ccc(CN2C[C@@H](O)C[C@@H]2CO)c([N+](=O)[O-])c1 179171312 PGCQDIKYMJFMTI-MNOVXSKESA-N 295.295 -0.379 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 228753589 HICGFYPSQHVDQW-LLVKDONJSA-N 270.289 -0.035 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](O)CO)n1 234552138 PSFQNOSGYOYBLI-LURJTMIESA-N 271.229 -0.459 5 20 CBBD COCCN(CC(=O)OC)C(=O)c1n[nH]cc1[N+](=O)[O-] 271210271 YINGAKHGBIKVON-UHFFFAOYSA-N 286.244 -0.421 5 20 CBBD Nc1nc(Nc2cnn(CCO)c2)ncc1[N+](=O)[O-] 301143104 DFQVXTIWVFJXNH-UHFFFAOYSA-N 265.233 -0.101 5 20 CBBD O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])[nH]1 340456575 VIZKODIDOCQNMD-ZCFIWIBFSA-N 273.270 -0.160 5 20 CBBD CN(C)C(=O)COC1CN(c2ncc([N+](=O)[O-])cn2)C1 354585999 JMWMSTPLYVLCPM-UHFFFAOYSA-N 281.272 -0.322 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NC[C@@H]1COCCO1 359023376 YCLOBLUNHKGKIF-MRVPVSSYSA-N 282.256 -0.051 5 20 CBBD CNC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 702047372 YUANCOKQNLMROK-SECBINFHSA-N 267.289 -0.141 5 20 CBBD O=C(N[C@H]1CCNC[C@@H]1O)c1cc([N+](=O)[O-])c[nH]1 710372246 BMDDVJIVKYZFLU-CBAPKCEASA-N 254.246 -0.625 5 20 CBBD Nc1nc(NC2CN(C(=O)O)C2)ncc1[N+](=O)[O-] 740339921 AQWFGLCZVAFFOC-UHFFFAOYSA-N 254.206 -0.259 5 20 CBBD O=C(O)[C@@H](O)C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 833770433 GFDOIXWCYKQCHG-NSHDSACASA-N 298.299 -0.051 5 20 CBBD CCN(CCNC(=O)COC)c1ncc([N+](=O)[O-])c(N)n1 1100435581 QFRBJOLXYABLEK-UHFFFAOYSA-N 298.303 -0.444 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CC[C@H]2CCN[C@H]1C2 1580578236 CBIGLAZLAOKPLE-AEJSXWLSSA-N 294.315 -0.167 5 20 CBBD Cc1noc(CNCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1753188414 SVLIRJJCVBJSNV-RKDXNWHRSA-N 283.288 -0.409 5 20 CBBD NC(=O)NC(=O)COc1ccc([N+](=O)[O-])cc1C=O 27390852 GDZXPLGHIYDALE-UHFFFAOYSA-N 267.197 -0.019 5 20 CBBD COCCN(C)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 171127102 GCULOLAKMGCCBY-UHFFFAOYSA-N 299.331 -0.124 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NCCn1cc([N+](=O)[O-])cn1 193570211 PIXGFPIMSZSDMY-WPRPVWTQSA-N 267.289 -0.095 5 20 CBBD Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](O)C(N)=O)c1 228486435 ACVLSBCLIASVAS-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD COC[C@@H](CCO)NC(=O)Cn1cc([N+](=O)[O-])cn1 229795099 POJFMNRZTPJCFX-MRVPVSSYSA-N 272.261 -0.695 5 20 CBBD CNc1ccc(C(=O)N2C[C@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 234530725 VIBFISFHBVHYEA-QWRGUYRKSA-N 281.268 -0.186 5 20 CBBD NC[C@@H]1CCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 237881361 RYCKLWLQTNQDIC-IUCAKERBSA-N 282.304 -0.180 5 20 CBBD C[C@H](CO)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 268841929 MRSYVIGSSBJQTK-QMMMGPOBSA-N 269.257 -0.499 5 20 CBBD NC(=O)[C@H]1CSCCN1CCn1ccc([N+](=O)[O-])n1 271542125 KFHWVKSSAGUPBZ-MRVPVSSYSA-N 285.329 -0.306 5 20 CBBD C[C@](CO)(NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 313502351 QLYOJGLRMMCPIU-SECBINFHSA-N 258.186 -0.247 5 20 CBBD CO[C@@]1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1 330883434 BIGYUDZHNOZZES-SNVBAGLBSA-N 270.245 -0.147 5 20 CBBD Cn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])[nH]1 340699484 SJTUCYWSOFUVDX-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@H](CO)O1 349577254 RUJWDSSWQHASSL-JGVFFNPUSA-N 284.272 -0.402 5 20 CBBD C[C@H]1C(=O)NCCCN1C(=O)c1cc([N+](=O)[O-])cnc1N 351766954 SQJKYSHLGSTJBZ-ZETCQYMHSA-N 293.283 -0.077 5 20 CBBD CNC(=O)[C@@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 354422524 DXZHMLFVETZWHW-RNFRBKRXSA-N 281.272 -0.038 5 20 CBBD CCNC(=O)CNC(=O)c1cc([N+](=O)[O-])nn1C 356094400 LHUHUVHDNAAUQW-UHFFFAOYSA-N 255.234 -0.806 5 20 CBBD CC[C@H](N)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 517029518 RUPHGODXODZIOM-QMMMGPOBSA-N 255.278 -0.047 5 20 CBBD CN(CC(N)=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 590573486 YZKWDTKASIQFED-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD CCN(CCN)S(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 599098614 NNGYVHFAXCESMK-UHFFFAOYSA-N 291.333 -0.220 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCC(=O)[C@H]1CCOC1 762862787 XIMRPUWPGDWSSF-QMMMGPOBSA-N 283.240 -0.060 5 20 CBBD CON(C)C(=O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 817659575 HTBDSIROUCQJLZ-UHFFFAOYSA-N 282.256 -0.073 5 20 CBBD CC[C@@H](OC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 833644518 BGVZIAGCVMPZMG-RXMQYKEDSA-N 258.190 -0.407 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc2c(c([N+](=O)[O-])c1)OCO2 833767589 ITVSAQNREWZWIL-LURJTMIESA-N 298.207 -0.501 5 20 CBBD CNC(=O)CN1CCC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1005379331 RVZSBHRCWAASOC-GHMZBOCLSA-N 298.343 -0.680 5 20 CBBD O=C(NC1CN(Cc2nncs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293464 KVTDQAOBRNLLDF-HTQZYQBOSA-N 283.313 -0.496 5 20 CBBD CSC[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1117394460 BCNQDBUQFUXHHB-YFKPBYRVSA-N 260.275 -0.386 5 20 CBBD O=C(NC[C@@H]1CNCCCO1)c1n[nH]cc1[N+](=O)[O-] 1261473173 DPUJXJPJJJDUNM-ZETCQYMHSA-N 269.261 -0.574 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)[C@H]1CCS(=O)(=O)C1 1324085160 LDIGUDKXXXSRGI-LURJTMIESA-N 288.285 -0.299 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2C[C@H](O)C2)c1[N+](=O)[O-] 1329605192 BHWVFEBPJJGFBD-LJGSYFOKSA-N 254.246 -0.110 5 20 CBBD O=C(CNc1ccccc1[N+](=O)[O-])N1CCNC[C@@H]1CO 1580558511 ZUGRUDJGGIQRNK-SNVBAGLBSA-N 294.311 -0.201 5 20 CBBD O=C(N[C@H](CCF)C(=O)O)c1n[nH]cc1[N+](=O)[O-] 1601416790 FLBPZRJZMRSPKQ-SCSAIBSYSA-N 260.181 -0.140 5 20 CBBD Cc1nn(C)c(NC[C@@H](O)CC(=O)O)c1[N+](=O)[O-] 1607999209 LQQXBDMPYLQOME-LURJTMIESA-N 258.234 -0.116 5 20 CBBD O=C1NC(=O)C([C@H](C[N+](=O)[O-])c2ccc(O)cc2)C(=O)N1 1463321 BGKLNNAPAOTASE-MRVPVSSYSA-N 293.235 -0.265 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC(O)CC1 35200756 OEVMJYTXLUGZJU-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCCO1 48320901 KJVYPLUCTWUWHB-JGVFFNPUSA-N 269.261 -0.130 5 20 CBBD NCC(F)(F)CNC(=O)Cn1cc([N+](=O)[O-])cn1 190216531 DKODFPFSTGTACS-UHFFFAOYSA-N 263.204 -0.499 5 20 CBBD O=C(CN1C[C@H](O)[C@@H](O)C1)Nc1ccccc1[N+](=O)[O-] 236581685 ZMDPBWIKYNVJNG-QWRGUYRKSA-N 281.268 -0.429 5 20 CBBD NC(=O)[C@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)O1 268543789 SIDBWJSEHKAXLD-NKWVEPMBSA-N 283.240 -0.050 5 20 CBBD CC(C)(C)OC(=O)CNC(=O)Cn1ncc([N+](=O)[O-])c1N 272925784 HCCRZEQXNWPLDF-UHFFFAOYSA-N 299.287 -0.169 5 20 CBBD NC(=O)Cn1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 339826835 AYLQOGDWEIDYOB-UHFFFAOYSA-N 278.228 -0.143 5 20 CBBD CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)NCC(N)=O 345792576 VBPRXQZXIPSUHZ-SSDOTTSWSA-N 298.303 -0.571 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1 351736248 KWSIRDBNRGFBBP-MRVPVSSYSA-N 293.283 -0.077 5 20 CBBD O=C(C[C@H]1NC(=O)NC1=O)Nc1ccc(O)c([N+](=O)[O-])c1 361657018 VFFTVJWBRBMJDH-ZCFIWIBFSA-N 294.223 -0.163 5 20 CBBD CNc1nccc(C(=O)NC2CN(C(C)=O)C2)c1[N+](=O)[O-] 574171307 SACFDVIARUSPHG-UHFFFAOYSA-N 293.283 -0.008 5 20 CBBD CC[C@@H](NC)C(=O)NCCn1cc([N+](=O)[O-])cn1 595925614 ADLBFJGQMHMIOA-SECBINFHSA-N 255.278 -0.095 5 20 CBBD COc1cc(C(=O)NC(CO)CO)c([N+](=O)[O-])cc1F 598900786 VJDBZXINCGKGOO-UHFFFAOYSA-N 288.231 -0.175 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 763235795 YCOQLSAXOCDOGV-GFCCVEGCSA-N 297.267 -0.169 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCO[C@H](C(=O)O)C2)n1 821297724 FVGICEYNIWQEBZ-ZETCQYMHSA-N 284.228 -0.746 5 20 CBBD O=C(O)C[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 833207279 CPFGGNIYGFYZTD-SSDOTTSWSA-N 283.244 -0.348 5 20 CBBD NC(=O)C(=O)NCCNc1ncc([N+](=O)[O-])cc1F 1094081826 XMNVTMXXEUHRFV-UHFFFAOYSA-N 271.208 -0.858 5 20 CBBD Cn1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1 1126932030 FTFLOTZXDOQJMJ-NXEZZACHSA-N 267.289 -0.709 5 20 CBBD CNC[C@@H](C)CNC(=O)c1c([N+](=O)[O-])cnn1C 1326073024 ABQASNDWDBXKFV-SSDOTTSWSA-N 255.278 -0.086 5 20 CBBD COCC1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350697236 LUVYIMNDAUWCPK-LLVKDONJSA-N 270.289 -0.270 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(C(=O)O)C1 1594460745 NXWGWBLJLDUSGE-UHFFFAOYSA-N 268.229 -0.357 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](CO)C(=O)O 37451189 IVAVUYYUYAMHCU-MRVPVSSYSA-N 284.224 -0.221 5 20 CBBD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCO 170396026 PZCLTWVCYVZNKT-UHFFFAOYSA-N 283.240 -0.350 5 20 CBBD O=C1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1 182173041 GMBXPBUPMXYORU-SNVBAGLBSA-N 295.295 -0.234 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 228755693 FYLYVYJHJJQSJA-LLVKDONJSA-N 285.304 -0.780 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 271247369 GLNHYCDMLMUZQS-QMMMGPOBSA-N 294.267 -0.104 5 20 CBBD C[C@@H](CO)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 282804663 OUMRRMWTKFTDOE-WCBMZHEXSA-N 258.278 -0.535 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])[nH]n1)NCC(F)F 286124738 XZIQINQOJXZVKR-UHFFFAOYSA-N 277.187 -0.571 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 339891759 LXXXHZZECZLPBP-VIFPVBQESA-N 294.267 -0.767 5 20 CBBD NC(=O)N[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 342772657 YQPNPUTTXVICCC-RXMQYKEDSA-N 267.249 -0.786 5 20 CBBD Nc1nnc(CNC(=O)c2cccc([N+](=O)[O-])c2N)o1 356581716 VVSPONQBJLSMCF-UHFFFAOYSA-N 278.228 0.072 5 20 CBBD Cn1c(C(=O)N[C@@H]2CCN(C(N)=O)C2)ccc1[N+](=O)[O-] 358035594 BCZOXRLGTJUXNU-SSDOTTSWSA-N 281.272 -0.184 5 20 CBBD N[C@H]1CCC[C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 446400408 JXPVBOZMARJSMW-JGVFFNPUSA-N 268.277 -0.428 5 20 CBBD COC(=O)[C@@](C)(CO)NCCn1cc([N+](=O)[O-])ccc1=O 595532526 SVJDWYJQRYHLFA-GFCCVEGCSA-N 299.283 -0.730 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1N[C@H]2CC[C@H]1C2 600380820 HAIQHVFJOYNZPO-BQBZGAKWSA-N 252.234 -0.546 5 20 CBBD CN1CC2(CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 619251675 LLSILVPMNRVHAL-UHFFFAOYSA-N 279.300 -0.045 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@H](C)C(=O)NC(N)=O 744661371 HFKDEIABZWLVPU-RXMQYKEDSA-N 299.243 -0.774 5 20 CBBD NC(=O)NCCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 755349318 UJQVWCLPJMEDEM-UHFFFAOYSA-N 268.229 -0.302 5 20 CBBD Cc1cc(C(=O)NCc2nnn(C)n2)c(N)c([N+](=O)[O-])c1 787853579 BWBYFTZXXLJGCQ-UHFFFAOYSA-N 291.271 -0.061 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@H]1C(=O)O 828349912 VLUGYAZGBAPHDR-NKWVEPMBSA-N 283.244 -0.635 5 20 CBBD O=C(O[C@@H]1COC[C@H]1n1ccnn1)[C@@H]1C[C@H]1[N+](=O)[O-] 847991036 WBTUOYZCRYERKL-FNCVBFRFSA-N 268.229 -0.574 5 20 CBBD NC(=O)c1ccc(N2C[C@@H](CO)[C@H](CO)C2)c([N+](=O)[O-])c1 1328804771 UVBDOJWBRNWZFX-UWVGGRQHSA-N 295.295 -0.269 5 20 CBBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@@](O)(C(=O)O)C1 1602622934 QRPXCYYSZOXGHH-LBPRGKRZSA-N 296.235 -0.038 5 20 CBBD C[C@](O)(CO)CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] 1603690476 KJJPISSBAOMVNQ-LLVKDONJSA-N 294.271 -0.070 5 20 CBBD CN(CCC(=O)O)c1ncc([N+](=O)[O-])cc1C(N)=O 50442160 CKNPJBYFFIOGEA-UHFFFAOYSA-N 268.229 0.000 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N[C@]1(C(=O)O)CCOC1 85853868 HTJHSJMGGPSYOS-LLVKDONJSA-N 283.240 -0.093 5 20 CBBD CCOC(=O)[C@@H]1CNCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 88659993 JQDYJULHLLOKGB-VIFPVBQESA-N 296.283 -0.100 5 20 CBBD CN(C)c1nc(N)nc(Cn2cc([N+](=O)[O-])cn2)n1 97336706 QAPMDFRFOOTQRA-UHFFFAOYSA-N 264.249 -0.327 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(N(C)C)C1 134975079 RGSGZVLDOHDYID-UHFFFAOYSA-N 267.289 -0.128 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](O)CN1 150755185 OUBWGIAFGWRTPN-VXGBXAGGSA-N 294.311 -0.154 5 20 CBBD CN(C)CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 188041997 UNFSNWNTBPWKQB-UHFFFAOYSA-N 254.246 -0.013 5 20 CBBD Nc1c(C(=O)N[C@@H]2CNC(=O)C2)cc(F)cc1[N+](=O)[O-] 226799372 OYOTYOSIQZFQQZ-LURJTMIESA-N 282.231 -0.066 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC(=O)C1CC1 271359957 YFTFEMDFSHZVEQ-UHFFFAOYSA-N 279.252 -0.148 5 20 CBBD CC(C)N1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 272635669 XQJXHKSWDQNKFC-UHFFFAOYSA-N 295.299 -0.130 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H](C)O 354698608 TYFSVQDKGMGFBS-QUBYGPBYSA-N 298.251 -0.047 5 20 CBBD C[C@@H]1c2nncn2CCN1c1ncc([N+](=O)[O-])c(N)n1 357744344 HRZPZGLWFATRRS-ZCFIWIBFSA-N 276.260 0.140 5 20 CBBD CN1CC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 553222917 OCZDFPGWMUSXAT-SSDOTTSWSA-N 279.256 -0.468 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(NC[C@H](O)CO)n1 565038715 VGUXOWRKOPGQND-LURJTMIESA-N 271.229 -0.238 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)C1(O)CNC1 595924980 LSQXNIXVXBIAOW-UHFFFAOYSA-N 251.242 -0.455 5 20 CBBD NC[C@H]1OCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 595956597 OFRRDKYSUXMRSQ-VHSXEESVSA-N 283.288 -0.729 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@@H]2C(=O)O)n1 595985414 JIJKKBNSUFZBEA-MRVPVSSYSA-N 298.255 -0.263 5 20 CBBD CCOc1ccc(C(=O)NC[C@H](O)C(N)=O)cc1[N+](=O)[O-] 597586011 JQFNUYVTAKQLKP-VIFPVBQESA-N 297.267 -0.431 5 20 CBBD C=CC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])n1C 732100637 WGRZSXRXRVNJMQ-UHFFFAOYSA-N 266.257 -0.035 5 20 CBBD O=C(N[C@@H](CO)CN1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 840452967 MBCZRMRJPVWNGZ-GMTAPVOTSA-N 271.317 -0.385 5 20 CBBD CN(C)C(=O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1116427979 TZIMPKBJITUAGJ-UHFFFAOYSA-N 255.234 -0.854 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)S(C)(=O)=O 1320158764 YYONIUMBSHHCSY-ZETCQYMHSA-N 290.301 -0.659 5 20 CBBD Cn1cc(Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cn1 1322132161 FUCIWTOBDRCBLG-UHFFFAOYSA-N 277.240 -0.363 5 20 CBBD Cn1nncc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 1327228101 WBHCTKSUBXHWGE-UHFFFAOYSA-N 265.233 -0.764 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CC[C@@H](O)C1 1329111509 RORDOGYCJGSCEH-MRVPVSSYSA-N 283.288 -0.875 5 20 CBBD CNC(=O)[C@@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1329426494 FCVKEUXMLHPVTD-MNOVXSKESA-N 283.284 -0.675 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC2CCNCC2)c1=O 1345781274 OIMGOVXSHKYBEX-UHFFFAOYSA-N 280.284 -0.145 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1F 43571256 CXIHXOOJGODFPL-VIFPVBQESA-N 286.215 -0.002 5 20 CBBD CC[C@H](C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 53835766 PWBHSKBPZPBHCG-CBAPKCEASA-N 299.287 -0.110 5 20 CBBD CC(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 157323858 WEKMGWMQEANOPI-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD COC(=O)[C@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 217708281 GWJNJYNZBFFHQQ-SNVBAGLBSA-N 298.251 -0.376 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(N)=O 230682109 CZYRVIBTKDKISC-BYPYZUCNSA-N 253.218 -0.824 5 20 CBBD NC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C1CC1 238072121 CDLIOIJIXLDQJC-MRVPVSSYSA-N 253.262 -0.355 5 20 CBBD COC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 268442228 KSCOUJNDLOKAIC-SSDOTTSWSA-N 283.240 -0.566 5 20 CBBD CN1C[C@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 269019736 DPPNKDPCBSGEOW-MRVPVSSYSA-N 296.287 -0.679 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)N1CCCC1 281127754 SZCLXKLLZSWXMI-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD COC(=O)CCCONC(=O)c1n[nH]cc1[N+](=O)[O-] 290806654 YPZPYOHAIISBBI-UHFFFAOYSA-N 272.217 -0.068 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)CO)c([N+](=O)[O-])n1 339038962 DNPNJLSINLIDKF-ZCFIWIBFSA-N 278.290 -0.530 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1C=C[C@H](CO)C1 341729724 HALIMWFYWYQZFB-DTWKUNHWSA-N 266.257 -0.156 5 20 CBBD O=C(Cc1cc[nH]n1)NCCn1cc([N+](=O)[O-])cn1 427583117 LSLXOZWODCURGJ-UHFFFAOYSA-N 264.245 -0.127 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@@H]1COCCO1 489907514 CZFZLWBDDPXCOU-SNVBAGLBSA-N 299.287 -0.494 5 20 CBBD C[C@H](N)C[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 573923425 QTGILBJZQRWBFZ-IUCAKERBSA-N 282.300 -0.002 5 20 CBBD CN1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 595784366 TUXYYUXVZZEBSL-LLVKDONJSA-N 297.315 -0.684 5 20 CBBD NCCN(Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CO 595900403 FLTNDESSFKHUPE-GFCCVEGCSA-N 269.301 -0.291 5 20 CBBD NC(=O)NCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 778757059 IXJAHWXGXACQRU-UHFFFAOYSA-N 296.239 -0.278 5 20 CBBD C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840424861 FGGHTEINJIJZNI-LNFKQOIKSA-N 271.317 -0.435 5 20 CBBD CCOCC(=O)N(C)CCNc1ncc([N+](=O)[O-])c(N)n1 1101487426 DMKHTNROZDGGTJ-UHFFFAOYSA-N 298.303 -0.126 5 20 CBBD CCN(CCNc1ncc([N+](=O)[O-])cc1F)C(=O)C(N)=O 1106943431 JBFMYCGIZFHMAU-UHFFFAOYSA-N 299.262 -0.125 5 20 CBBD O=C(c1cc([N+](=O)[O-])cnc1O)N1CCn2cnnc2C1 1318327578 NZNKRQHVFPYZOZ-UHFFFAOYSA-N 290.239 -0.057 5 20 CBBD CNC(=O)Cc1noc(Cn2cc([N+](=O)[O-])cn2)n1 1319623358 ROHPVMQIRWILLU-UHFFFAOYSA-N 266.217 -0.489 5 20 CBBD COC[C@H](CCO)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1319716495 GWXWKVZLIKTFTR-LURJTMIESA-N 258.234 -0.555 5 20 CBBD CN1CC[C@@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)C1=O 1516781195 KNBXZQJVYZFKIN-SSDOTTSWSA-N 283.244 -0.792 5 20 CBBD O=C(O)CCCONC(=O)Cn1cc([N+](=O)[O-])cn1 1608716483 PGJCTVACFJNJLN-UHFFFAOYSA-N 272.217 -0.296 5 20 CBBD O=C1NC[C@@H]2CN(c3ncc([N+](=O)[O-])s3)CCN2C1=O 190334127 VPUXFEAGXKUVQL-ZCFIWIBFSA-N 297.296 -0.802 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)COc1ccc([N+](=O)[O-])cc1 217708194 GWJNJYNZBFFHQQ-JTQLQIEISA-N 298.251 -0.376 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(N)=O 227871559 NTXAHOGHFOJABM-VIFPVBQESA-N 267.241 -0.521 5 20 CBBD NC(=O)c1ccc(CN2C[C@@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 236255813 KEEWOZSFFLVXNR-GHMZBOCLSA-N 281.268 -0.769 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(C)(C)O 331081870 MBMVAYCKDKKEKU-UHFFFAOYSA-N 256.262 -0.013 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[C@@H](CO)O1 349577256 RUJWDSSWQHASSL-YUMQZZPRSA-N 284.272 -0.402 5 20 CBBD CCC[C@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1O 412529948 WQJVVUCSYOXEFR-ZJUUUORDSA-N 299.283 -0.053 5 20 CBBD NC[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 428519728 CXUMCCMHAVHINQ-QMMMGPOBSA-N 268.277 -0.474 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C(=O)N1 450619349 WOWNPSGNHGJMJW-ZCFIWIBFSA-N 267.245 -0.992 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC(CO)CO 490187359 LVSSXOLMMCQJOW-UHFFFAOYSA-N 283.240 -0.997 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)OC 538706169 LONALWFRNQNQNG-MRVPVSSYSA-N 285.256 -0.149 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@H](CO)[C@H](O)C2)c1 554744085 WBDPDCHIKUVTOO-MWLCHTKSSA-N 270.289 -0.534 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1ccnc(N)c1[N+](=O)[O-] 566686921 GZDORAWAFXCCNJ-JGVFFNPUSA-N 296.283 -0.206 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CNCCO1 581879276 AXDYNGMHVZPOJS-SNVBAGLBSA-N 297.315 -0.406 5 20 CBBD CN(C)S(=O)(=O)NCCNc1cccnc1[N+](=O)[O-] 590702986 PHDYJTNFEIVOHY-UHFFFAOYSA-N 289.317 -0.202 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@@H]2COC[C@]2(C(=O)O)C1 595282348 QCUGTSKQWFTLLF-KSBSHMNSSA-N 296.239 -0.509 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCc3c[nH]nc3C2)c1 611008718 HVDPGCFPDHQASA-NSHDSACASA-N 292.299 -0.066 5 20 CBBD C[C@@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 748115538 FJUABRULJFPPGV-ZETCQYMHSA-N 291.285 -0.232 5 20 CBBD C[C@H](CN1CCOCC1)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839747857 UVGXXFIPJWFNIE-GMTAPVOTSA-N 271.317 -0.169 5 20 CBBD CN(CC(=O)OCCC[N+](=O)[O-])S(C)(=O)=O 860914237 RFYYAIGRYVHYEH-UHFFFAOYSA-N 254.264 -0.912 5 20 CBBD NC(=O)NCC(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093500792 MEFYZDSTZCIRRH-UHFFFAOYSA-N 282.260 -0.814 5 20 CBBD CN(C)C(=O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 1117647952 XBOLGEKFOSHNFE-UHFFFAOYSA-N 267.245 -0.411 5 20 CBBD Cc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ncn1 1126936876 VNVVDGSGRWPZDM-GHMZBOCLSA-N 279.300 -0.344 5 20 CBBD CC(=O)NCCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318075882 PFAIIGXDHASWJA-UHFFFAOYSA-N 283.288 -0.107 5 20 CBBD CNC(=O)C1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1 1323999869 CZIXVDZIMXWHQZ-UHFFFAOYSA-N 279.256 -0.729 5 20 CBBD CN(C)CC[C@@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1331470767 TWUWDLKGZSHMDG-GFCCVEGCSA-N 299.331 -0.239 5 20 CBBD O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@H](O)CO 1607083249 CLABNDYHSAQHCB-LURJTMIESA-N 280.244 -0.460 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 1608675966 SLRSJKHGEBSWIY-LURJTMIESA-N 284.224 -0.134 5 20 CBBD CNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 5220975 KYDQCGKYDOWZKL-UHFFFAOYSA-N 263.209 -0.063 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)N(C)C 46271861 FJCWXKNYBXIPBW-MRVPVSSYSA-N 255.278 -0.142 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NCC(N)=O 49932414 YJOOATQEZPWIBH-UHFFFAOYSA-N 252.230 -0.148 5 20 CBBD NC(=O)c1ccc(CN(CCO)CCO)c([N+](=O)[O-])c1 50103370 IMNUZZQENAUGPU-UHFFFAOYSA-N 283.284 -0.520 5 20 CBBD Cc1ccc(NC(=O)C(=O)NCCO)cc1[N+](=O)[O-] 128155210 LIRDOIZJOPJZRL-UHFFFAOYSA-N 267.241 -0.050 5 20 CBBD C[C@H]1CO[C@H](CO)CN1CCn1ccc([N+](=O)[O-])n1 153386287 SKGPHBLIEQZDKZ-UWVGGRQHSA-N 270.289 -0.127 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCn1ccnn1 230725420 CNLANUXNPIEWPS-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@@H](C)O 275999287 OJVZZFNWVKSXSK-XRGYYRRGSA-N 299.239 -0.652 5 20 CBBD O=C1CCC(=O)N1CCn1cccc([N+](=O)[O-])c1=O 338630718 ASHPYEJFROYEHB-UHFFFAOYSA-N 265.225 -0.095 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N[C@H](CO)C(N)=O 340887511 WPBZGLGDDXPMIN-ZCFIWIBFSA-N 257.250 -0.622 5 20 CBBD C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])C(N)=O 354347428 DZQKJIHGUCCVGM-RXMQYKEDSA-N 252.230 -0.219 5 20 CBBD O=C(NC[C@@H]1CC[C@@H](CO)O1)c1cnc(O)c([N+](=O)[O-])c1 356529428 URGNMPQQRULKNJ-IUCAKERBSA-N 297.267 -0.035 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCCOCCO 357055246 UHECFEWNZUJWJO-UHFFFAOYSA-N 286.288 -0.303 5 20 CBBD CC(C)[C@H](O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 357239119 KRYFGCIBFOMZSQ-MRVPVSSYSA-N 271.277 -0.291 5 20 CBBD CN1CCNC[C@H]1CNc1ncc([N+](=O)[O-])s1 394830681 ULYIHYRNCLKPKX-ZETCQYMHSA-N 257.319 0.367 5 20 CBBD CN1C[C@H](NC(=O)c2ccccc2[N+](=O)[O-])C(=O)N1 538681137 RPFDJZDLDGDDHQ-QMMMGPOBSA-N 264.241 -0.330 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CC[C@H](CO)[C@@H](O)C2)c1 554744084 WBDPDCHIKUVTOO-KOLCDFICSA-N 270.289 -0.534 5 20 CBBD Nc1c(C(=O)N2CC[C@H](CO)[C@H](O)C2)cccc1[N+](=O)[O-] 557629245 MTRFZZPHFXWLIG-LDYMZIIASA-N 295.295 -0.008 5 20 CBBD Nc1nc(NC2CC(CO)(CO)C2)ncc1[N+](=O)[O-] 599180645 WUCZOWGPICWDKD-UHFFFAOYSA-N 269.261 -0.488 5 20 CBBD CNC(=O)[C@@H](O)CNc1ncc(C(=O)OC)cc1[N+](=O)[O-] 758112050 ADFNMCVXPKIVJI-QMMMGPOBSA-N 298.255 -0.705 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 763701733 VUKDHUAKCZVRQD-VIFPVBQESA-N 285.231 -0.429 5 20 CBBD C[C@@H]1[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)CC(=O)N1C 806060404 DNRYVVYGJFODMS-SFYZADRCSA-N 282.256 -0.046 5 20 CBBD O=C(O)NCC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 833777180 GJXIQNNEFSBOGJ-UHFFFAOYSA-N 285.212 -0.433 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CN1CC(F)(F)F 839737261 UKOUMPNXVFWMJA-PHDIDXHHSA-N 281.190 -0.158 5 20 CBBD CC1(C)C[C@@](C)(NC(=O)Cn2cnc([N+](=O)[O-])n2)C(=O)O1 848154117 IZFZVMNKCWNDDD-LLVKDONJSA-N 297.271 -0.213 5 20 CBBD CNC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@H](O)[C@@H](O)C1 858674254 IVEVVBOOAJTYRG-QWRGUYRKSA-N 281.268 -0.504 5 20 CBBD O=C(N[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cocn1 973096379 OOZSBMIZBPEIMY-FDDDBJFASA-N 294.267 -0.283 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N1C[C@H](OC)[C@H](OC)C1 1263020664 ZHIDWQQLPIDGKS-DTORHVGOSA-N 285.304 -0.075 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 1318353743 UWYVMWIZTGWTKV-SSDOTTSWSA-N 281.272 -0.416 5 20 CBBD COC(=O)NC1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1325654301 KWJZEPTXYRMAOQ-UHFFFAOYSA-N 283.244 -0.491 5 20 CBBD Cc1cc(=O)n(Cc2noc(CN)n2)cc1[N+](=O)[O-] 1326807042 ZGIXYCBYLLGDPJ-UHFFFAOYSA-N 265.229 -0.045 5 20 CBBD COC[C@@H]1CNCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 1578992621 YIVNKZHGKSKLKW-VIFPVBQESA-N 268.273 -0.017 5 20 CBBD O=C(O)CNC(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 1595103405 AVHAZQFBCUWQRI-UHFFFAOYSA-N 291.223 -0.010 5 20 CBBD CCOCCCN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1753376071 GOKMQLUUOZXRFD-GHMZBOCLSA-N 271.317 -0.121 5 20 CBBD N[C@@H]1C[C@H]1NS(=O)(=O)c1ccccc1[N+](=O)[O-] 36263982 XLALOFDZCLCXBP-RNFRBKRXSA-N 257.271 -0.027 5 20 CBBD Cc1nn(C)c(N2CCN(C(=O)[C@@H](C)O)CC2)c1[N+](=O)[O-] 124997294 OTJUFKKPDZSILN-SECBINFHSA-N 297.315 -0.334 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(C)C(=O)[C@@H]2C)c1[N+](=O)[O-] 188428197 OELZFAIKFOPPDX-QMMMGPOBSA-N 295.299 -0.061 5 20 CBBD CCC(N)(CC)CNC(=O)Cn1cnc([N+](=O)[O-])n1 236774645 IZOZMPFBIGWTBO-UHFFFAOYSA-N 270.293 -0.180 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1cc(O)cc([N+](=O)[O-])c1 274731594 BIGIHKZNLJOTHD-JTQLQIEISA-N 270.241 -0.274 5 20 CBBD O=C1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CCN1 298923829 JEWONDHGVVQGFF-UHFFFAOYSA-N 292.251 -0.508 5 20 CBBD Cc1nn(C)c(N(C)CCNS(C)(=O)=O)c1[N+](=O)[O-] 301307106 ZAXIQCQTXUOPEU-UHFFFAOYSA-N 291.333 -0.378 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 354689420 WNKBFQBSMIKHQY-JTQLQIEISA-N 269.261 -0.886 5 20 CBBD CC[C@@](NC(=O)Cn1cnc([N+](=O)[O-])n1)(C(N)=O)C(C)C 359175448 IZRUYGWHACRDMR-NSHDSACASA-N 298.303 -0.407 5 20 CBBD C[C@](O)(CO)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 362218797 YLEMLLPIBCYHKP-GFCCVEGCSA-N 297.267 -0.607 5 20 CBBD CCN1C[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 450762239 NREJDZKYQSAFIM-LURJTMIESA-N 266.261 0.000 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1OC 490248985 LKEZAVNFXXWXAD-YUMQZZPRSA-N 285.260 -0.942 5 20 CBBD O=C(NCCCN1CCNCC1)c1cc([N+](=O)[O-])n[nH]1 519647144 RPLOHWMTXLMWJA-UHFFFAOYSA-N 282.304 -0.657 5 20 CBBD CNc1nccc(C(=O)NCCCO)c1[N+](=O)[O-] 561116511 YTCZAGQCECIJHV-UHFFFAOYSA-N 254.246 0.144 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 611857081 DJYHXHBLKLEXRL-MRVPVSSYSA-N 285.256 -0.413 5 20 CBBD Cc1[nH]nc(C(=O)NN2CCOCC2)c1[N+](=O)[O-] 734242479 GCBXTSOLIWVOFZ-UHFFFAOYSA-N 255.234 -0.397 5 20 CBBD CNC(=O)CCOC(=O)CCn1cc([N+](=O)[O-])cn1 749043478 QHSKJJHRPFQUSE-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD CNC(=O)NCCC(=O)OCCn1c([N+](=O)[O-])cnc1C 796784601 LAADGEFOHCVHBT-UHFFFAOYSA-N 299.287 -0.038 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@]1(O)CCOC1 846443048 VJAGPTTURVREEP-LBPRGKRZSA-N 296.283 -0.157 5 20 CBBD CS(=O)(=O)N1CCC(CNCC[N+](=O)[O-])CC1 905079455 IJACWUJUKJMIBP-UHFFFAOYSA-N 265.335 -0.476 5 20 CBBD O=C(NCCCNCCN1CCCC1=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157775825 YXJARRUBDZRCDO-GHMZBOCLSA-N 298.343 -0.630 5 20 CBBD CC(=O)NCCNC(=O)Cn1ccc([N+](=O)[O-])n1 1317976293 UYSFZCRXKYPLLH-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD CNCC1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1326583018 VZTPPDZEIDESGU-UHFFFAOYSA-N 282.304 -0.356 5 20 CBBD C[S@@](=O)CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1335229656 VTOSQYIEDRGAKE-QGZVFWFLSA-N 260.275 -0.184 5 20 CBBD C[C@]1(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC(=O)N1 1345619366 RESADNWSJQIVBO-ZYHUDNBSSA-N 297.315 -0.590 5 20 CBBD Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H](CO)C(=O)O)n1 1607710046 SZBSEIUNRLLDMH-QMMMGPOBSA-N 269.213 -0.526 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CC[C@H]1C(=O)O 1608159826 XAUGZYSSOFLPGL-RITPCOANSA-N 268.229 -0.079 5 20 CBBD CS(=O)(=O)NCCNc1ccc([N+](=O)[O-])nc1 47873312 LNVNMCFULLYEDT-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD CNC(=O)NC(=O)Cn1ccc(C)c([N+](=O)[O-])c1=O 129651338 XCQZUKQDJUCBTQ-UHFFFAOYSA-N 268.229 -0.479 5 20 CBBD O=C(NCCC(=O)N1CCOCC1)c1cc([N+](=O)[O-])[nH]n1 285366099 ICJNWODLTJDLCD-UHFFFAOYSA-N 297.271 -0.703 5 20 CBBD C[C@@H]1CC(=O)N[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 293756757 RIRYVMHEPIKMCR-WPRPVWTQSA-N 295.299 -0.178 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCN(C(=O)CO)CC1 301968830 PVGISOPYNWHJBB-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD COc1ccc(NC(=O)CNC(=O)CN)cc1[N+](=O)[O-] 312179564 ZKOAXLZPXBCMPZ-UHFFFAOYSA-N 282.256 -0.383 5 20 CBBD CNC(=O)CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C 338608294 OTHNWRYILHSWCL-UHFFFAOYSA-N 283.288 -0.340 5 20 CBBD O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1nn[nH]n1 339183081 XCNHQLROMQVWSM-UHFFFAOYSA-N 289.211 -0.027 5 20 CBBD C[C@@H](C(=O)O)N(C)C(=O)c1c([N+](=O)[O-])cnn1C 342562037 IQVOXWAQPFXZQS-YFKPBYRVSA-N 256.218 -0.127 5 20 CBBD CCOC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 351727189 JLMKJKQZMXGTJE-MRVPVSSYSA-N 284.272 -0.301 5 20 CBBD COC(=O)c1cnc(N(C)C[C@@H](O)CO)c([N+](=O)[O-])c1 357680932 GVSABHHMZMZLCM-MRVPVSSYSA-N 285.256 -0.434 5 20 CBBD CO[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H](CN)C1 359210684 BJQGAFSNUKPFLG-GXSJLCMTSA-N 297.315 -0.244 5 20 CBBD Cn1nnc(CNC(=O)Cc2ccccc2[N+](=O)[O-])n1 362942224 RTHMHTWHFKCRRT-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD C[C@@H]1NCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 434707106 PTKGJDNDSUQESQ-YUMQZZPRSA-N 268.277 -0.557 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@]2(O)CCO[C@@H]2C)c1[N+](=O)[O-] 447741437 KYVMXOGLZMJCTR-HQJQHLMTSA-N 284.272 -0.104 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@H](CO)[C@@H](O)C2)c1[N+](=O)[O-] 545988148 KHROUQXRYMUPRE-APPZFPTMSA-N 298.299 -0.304 5 20 CBBD CC[C@H](N)CNS(=O)(=O)c1cn(CC)nc1[N+](=O)[O-] 583752724 ZUCUZBJYNSMJHQ-ZETCQYMHSA-N 291.333 -0.173 5 20 CBBD COCCCONC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 819311372 MZWBAFAXZOUOPS-SNVBAGLBSA-N 274.277 -0.290 5 20 CBBD NC(=O)NC(=O)CCn1cc([N+](=O)[O-])cc(C(=O)O)c1=O 833084025 UGWUDTOEQZHUOO-UHFFFAOYSA-N 298.211 -0.960 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]2CCCC[C@H]2N1 839700699 GXEZWMHLJOAXAS-DOLQZWNJSA-N 267.285 -0.079 5 20 CBBD CCONC(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 846495727 DAXOITGMADYOJY-UHFFFAOYSA-N 271.233 -0.576 5 20 CBBD CCC(=O)N1CC(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954240619 UAURZDDCSFKTLL-RKDXNWHRSA-N 255.274 -0.269 5 20 CBBD NC(=O)c1cc(N2CC[C@@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-] 1118591682 FIIVDYNEWZBCHY-QPUJVOFHSA-N 295.295 -0.127 5 20 CBBD CN(C)C(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1124014550 IZPNDIVHOGUSLP-IVZWLZJFSA-N 269.301 -0.022 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCS(=O)CC1 1318333258 CDRPGIKUZFOSJH-UHFFFAOYSA-N 286.313 -0.309 5 20 CBBD CCOCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319610573 ZMYMYQBGEPCQOB-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD COCC1(O)CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1319630399 JSKOYVGWDHRUOY-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD CN(CC1CC1)C(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1323614912 CEKXMTXGTLVIAM-UHFFFAOYSA-N 295.299 -0.224 5 20 CBBD CC(C)S(=O)(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1325302629 DQWBPOOXZVDCQM-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD CN(CC(=O)O)c1ncc([N+](=O)[O-])cc1C(N)=O 50442124 WJAOJWPHWPIBGX-UHFFFAOYSA-N 254.202 -0.391 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NOCC(N)=O 124203176 YAHVXGAECPJRSI-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD COc1c(C(=O)N[C@@H](CO)C(=O)O)cccc1[N+](=O)[O-] 137531166 NHVNKKHCPNTTQF-ZETCQYMHSA-N 284.224 -0.221 5 20 CBBD CC(C)NC(=O)CN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 174708180 PNXFGDJRFXOHRA-LLVKDONJSA-N 299.331 -0.391 5 20 CBBD COC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 279963808 JVTLZFCKXUPRMX-SSDOTTSWSA-N 269.257 -0.086 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@]1(CO)CCOC1 330890371 OWULFNGAMGEFRJ-SNVBAGLBSA-N 270.245 -0.941 5 20 CBBD NC(=O)[C@H]1CCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 339895153 VNJJJULIZFYCTO-SECBINFHSA-N 281.272 -0.342 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1COC[C@@H]1O 342394637 CWQNRCPVBUXWAG-SFYZADRCSA-N 270.245 -0.991 5 20 CBBD C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)N1CCOCC1 343389564 VGLOBVRCQNBWAZ-ZETCQYMHSA-N 297.271 -0.705 5 20 CBBD Cc1nc(=NC(=O)CCn2cc([N+](=O)[O-])nc2C)n(C)[nH]1 348255570 OLFHUWKNDOSSLF-UHFFFAOYSA-N 293.287 -0.013 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CCO1 354404180 DJADGXMMNIMOKX-SECBINFHSA-N 294.267 -0.497 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N(CCO)CCO 359032746 PFVJDMDGCJVORX-UHFFFAOYSA-N 270.245 -0.770 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)C[C@H]1C 371049177 NQSQXRYAFMEXGG-MRVPVSSYSA-N 295.299 -0.163 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N[C@H]1CCNC1 563638941 XDFAZSRRFDQQRJ-ZETCQYMHSA-N 251.246 -0.105 5 20 CBBD CS(=O)(=O)NC1CN(c2ncccc2[N+](=O)[O-])C1 599147007 JAQZIXLUFVDWCP-UHFFFAOYSA-N 272.286 -0.272 5 20 CBBD CNC(=O)CN(C)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821632736 GZWYJTXEEDKHIA-UHFFFAOYSA-N 292.259 -0.648 5 20 CBBD CC(C)(CC(=O)O)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 826538449 RPBNIOWMQNGOSQ-VIFPVBQESA-N 286.288 -0.005 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CCN(CCO)CC1 1005382247 OUEPLZNEBYQTIA-GHMZBOCLSA-N 271.317 -0.433 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cn(C)nn2)C1 1042705786 YPFLATHDOQVELX-GHMZBOCLSA-N 294.315 -0.877 5 20 CBBD Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C(N)=O)c1 1094079644 TVJIONQMQZQWRS-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD COCC(=O)NCCN(C)c1ccnc(O)c1[N+](=O)[O-] 1099897071 QGQQGNWFYWKLGY-UHFFFAOYSA-N 284.272 -0.106 5 20 CBBD Cc1cc(N(C)CCN(C)C(=O)C(N)=O)ncc1[N+](=O)[O-] 1105543165 LVLAAQZFZQRQMP-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD Cn1cc([C@@H]2C[S@@](=O)CCN2CC[N+](=O)[O-])cn1 1333461056 KBZJWTIMIUCCLI-YPMLDQLKSA-N 272.330 -0.198 5 20 CBBD C[C@@](O)(CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(=O)O 1589144275 LPAGZPGCRMOZKI-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD C[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)O1 1607439046 WEFUTRGKODJMCR-APPZFPTMSA-N 270.245 -0.077 5 20 CBBD O=C(O)[C@@H]1CSCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1608648852 NYQRCFWAATUTHQ-XLPZGREQSA-N 274.298 -0.072 5 20 CBBD NC(=O)[C@@H]1CCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 47641142 OLUZTZGBVACIIG-QMMMGPOBSA-N 267.245 -0.732 5 20 CBBD CC(=O)NC[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 176248512 CIDIHBQMMOJUPY-LLVKDONJSA-N 297.315 -0.372 5 20 CBBD C[C@@H](CN)N(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 179201436 RVNHFHYNIJNPIV-QMMMGPOBSA-N 268.273 -0.438 5 20 CBBD O=C(CNC(=O)Cn1ccc([N+](=O)[O-])n1)NCC1CC1 180871761 FTVYAAJVOSOQMR-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD NC(=O)C1=NO[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1 276262570 MYBBIWAUWCKMCG-BYPYZUCNSA-N 281.232 -0.991 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1cccc([N+](=O)[O-])c1O 296809724 FHMDMSAXJIFZDR-VXNVDRBHSA-N 268.225 -0.210 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCCNC1=O 330713098 ZANIZLAGGILMGE-VIFPVBQESA-N 281.272 -0.424 5 20 CBBD CN(C)c1noc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 352106598 MERQLKWAXQZKKH-UHFFFAOYSA-N 281.232 -0.303 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H]2COCCO2)c1 352153317 MJFNJTFUZRZHLB-SECBINFHSA-N 298.251 -0.042 5 20 CBBD O=C(NC[C@@H]1CN(C2CC2)CCO1)c1cc([N+](=O)[O-])n[nH]1 353078693 NAQPJRVDSJXKQZ-SECBINFHSA-N 295.299 -0.089 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@H]1CO 360862080 UTNAEPXAOJDIOJ-UWVGGRQHSA-N 295.295 -0.157 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 445194519 OQIBOONJTMBQAX-LURJTMIESA-N 280.240 -0.344 5 20 CBBD CN1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(=O)N1 537577414 VUJQMUXHYWDICF-SNVBAGLBSA-N 294.267 -0.565 5 20 CBBD O=C(O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 738616015 LDJNPIWFAMAWQZ-UHFFFAOYSA-N 256.170 -0.616 5 20 CBBD O=C(O)c1cc(C(=O)NCc2nn[nH]n2)cc([N+](=O)[O-])c1 738672402 FQJQMIBPWATGPC-UHFFFAOYSA-N 292.211 -0.264 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCN1C(=O)CCC1=O 766966359 CLCBKCOOVVWYFO-UHFFFAOYSA-N 296.239 -0.366 5 20 CBBD CCN(CC(=O)NC)C(=O)c1cnc(O)c([N+](=O)[O-])c1 770205998 QWYXBKBVORFKFG-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD NC(=O)[C@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCO1 776579085 IWFNZWUDHNKDEC-VXGBXAGGSA-N 295.295 -0.186 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1 793898264 IZJIYEITVSRULN-SSDOTTSWSA-N 293.239 -0.650 5 20 CBBD CCCc1[nH]nc(C(=O)OCC(N)=O)c1[N+](=O)[O-] 796261779 RCEGKCSKMZHRSO-UHFFFAOYSA-N 256.218 -0.088 5 20 CBBD O=C(Cc1cccc([N+](=O)[O-])c1)Nn1c(O)nnc1O 816733884 PFJMFYSELNTQLD-UHFFFAOYSA-N 279.212 -0.090 5 20 CBBD CN1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 819622620 UILRMDGAMFITKJ-IWSPIJDZSA-N 255.274 -0.364 5 20 CBBD Nc1ccnc(Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)n1 833091509 RRPITXJTBFLHRT-UHFFFAOYSA-N 291.223 -0.125 5 20 CBBD COCC1(O)CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 836801391 SBAYTUUNLBNMEB-NSHDSACASA-N 296.279 -0.152 5 20 CBBD CNC(=O)[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839529803 HVLZXOWBBHEDPJ-IWSPIJDZSA-N 255.274 -0.221 5 20 CBBD Cc1cc(C(=O)N[C@H](CO)[C@@H](C)O)c(N)c([N+](=O)[O-])c1 839801313 YBUZTIYKIBMLRW-VXNVDRBHSA-N 283.284 -0.043 5 20 CBBD C[C@H](CN(C)S(C)(=O)=O)OC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842349616 MYYYMMFUMVZGFT-BWZBUEFSSA-N 280.302 -0.525 5 20 CBBD CN(C)C(=O)OCCNC(=O)CCn1cc([N+](=O)[O-])cn1 855650669 SMQBLHANUDOTFY-UHFFFAOYSA-N 299.287 -0.004 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCO[C@H](CN)C1 1326597329 BCFBKNHRMRFJOA-SECBINFHSA-N 283.288 -0.714 5 20 CBBD O=C1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCCN1 1330288556 QVHUDKZGDVUVGX-UHFFFAOYSA-N 253.218 -0.720 5 20 CBBD NC1=CCN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)N1 1592740012 IKBNCCTZWAOEER-UHFFFAOYSA-N 275.232 -0.705 5 20 CBBD C[C@@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)C(=O)O 1593541622 HSGXXVHIDMJRNI-ZCFIWIBFSA-N 298.207 -0.658 5 20 CBBD O=C1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CCN1 9653515 PFZXNULPMLVGDK-UHFFFAOYSA-N 279.252 -0.068 5 20 CBBD NC(=O)c1ccc(CN2CCNC(=O)C2)c([N+](=O)[O-])c1 27348961 OQAKNPTZNMTANI-UHFFFAOYSA-N 278.268 -0.375 5 20 CBBD CN1CC[C@H](CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 37894350 VVGGSNMPQYJIFO-PWSUYJOCSA-N 283.332 -0.307 5 20 CBBD C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)N1CCOCC1 52610231 BZDFTBCTLIPFDD-JTQLQIEISA-N 297.315 -0.372 5 20 CBBD CNC(=O)CCCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 119730979 RAKXWXGYIGIUAB-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCCN1 178720496 QNNHOEAKORLOSF-MRVPVSSYSA-N 253.262 -0.341 5 20 CBBD Cn1ccnc1CNC(=O)Cn1ccc([N+](=O)[O-])n1 343300226 PZACUBWNPQRUFO-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD C[C@@H]1CN(C(=O)NCCn2cc([N+](=O)[O-])cn2)CCN1 417908857 JCXNBYBHJOUPFS-SECBINFHSA-N 282.304 -0.205 5 20 CBBD CC(=O)N(C)CC(=O)NCCn1cc([N+](=O)[O-])cn1 492747935 MDKLWIYJZSDSSJ-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD C[C@@H](CNC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)O 594529643 SRLOYFKKFLTFSP-ZETCQYMHSA-N 285.260 -0.189 5 20 CBBD O=C(N1CCC(n2ccc([N+](=O)[O-])n2)CC1)C1(O)CNC1 595953478 JMINQCUNMNXKTF-UHFFFAOYSA-N 295.299 -0.711 5 20 CBBD CN1CC[C@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 734888898 APVQDUDBKCOBEG-QMMMGPOBSA-N 268.229 -0.435 5 20 CBBD O=C1CN(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C(=O)N1 780321206 BCFIDBWLWLIGIA-UHFFFAOYSA-N 280.196 -0.503 5 20 CBBD COCc1ncc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(N)n1 848105136 JYUGSFNBLVHLSY-HTQZYQBOSA-N 281.272 -0.513 5 20 CBBD CCCNC(=O)[C@@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 1262648666 NPLWXZOKGDHPAP-ZCFIWIBFSA-N 269.261 -0.038 5 20 CBBD O=[N+]([O-])c1cnc(N2CCOCCN2)c(-c2nn[nH]n2)c1 1593486039 JODJVUJXSYCLKK-UHFFFAOYSA-N 292.259 -0.489 5 20 CBBD CNC(=O)CNC(=O)COc1cccc([N+](=O)[O-])c1 61365478 YGOMZBTWADMLDG-UHFFFAOYSA-N 267.241 -0.164 5 20 CBBD CCCN(CCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 174658245 CFACLRWXHQWGJY-NSHDSACASA-N 272.305 -0.144 5 20 CBBD CN1CC[C@@H](NC(=O)NCCn2cc([N+](=O)[O-])cn2)C1=O 177916342 HLIRPJXQXWGINA-SECBINFHSA-N 296.287 -0.679 5 20 CBBD C[C@H]1NC(=S)N(CCn2cc([N+](=O)[O-])cn2)C1=O 178352312 UHSDKEVSJKXGQU-ZCFIWIBFSA-N 269.286 -0.104 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCN1 178738564 NZACEIXVKVJPBW-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1F 227870655 PRPVXPJIPNVROS-QMMMGPOBSA-N 271.204 -0.690 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1F)N1C[C@H](O)[C@@H](O)C1 236572215 XFCZSNIVMNPSMD-UWVGGRQHSA-N 270.216 -0.089 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 263764265 ZJUUYGOSNVOPFQ-QMMMGPOBSA-N 283.240 -0.559 5 20 CBBD CN1CCO[C@@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]21 331763717 JUBWXJJLLBWRPD-NXEZZACHSA-N 295.299 -0.667 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)[C@@H](C)O 347922682 QALSRZOZXYJMLV-XCBNKYQSSA-N 297.267 -0.050 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)C(=O)N(C)C 362375292 IAHOONNJXSHYKX-ZCFIWIBFSA-N 282.256 -0.098 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H]2C[C@H]21 590433966 XTEVZGZJJFXLPI-HTRCEHHLSA-N 252.230 -0.058 5 20 CBBD Nc1ccc(N(CCO)CCCO)nc1[N+](=O)[O-] 596136543 BLRDAAAFQDDADC-UHFFFAOYSA-N 256.262 -0.247 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H](O)C1 596507658 YUOZLILPQSHCKZ-XWEPSHTISA-N 269.261 -0.386 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H](O)C1CC1 597410524 OLDLPGWFDDLQFX-VIFPVBQESA-N 254.246 -0.322 5 20 CBBD O=[N+]([O-])c1c(N2CCOCC2)ncnc1N1CC[C@H](O)C1 598594025 DXYOPMADSTVAQR-VIFPVBQESA-N 295.299 -0.208 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)C(=O)O1 808207847 KIWMQHJJTQHCJA-VXNVDRBHSA-N 295.251 -0.423 5 20 CBBD COC(=O)N(C)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 855938973 WXSMMVZRRGGRLP-UHFFFAOYSA-N 286.248 -0.999 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1CSC1 880737275 YHAMDJXGDZEHKW-UHFFFAOYSA-N 269.282 -0.012 5 20 CBBD O=C(NC[C@@H]1COCCO1)c1n[nH]cc1[N+](=O)[O-] 1319837616 ZQUMSSDDIKKSLS-ZCFIWIBFSA-N 256.218 -0.537 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCC[C@H]1CO 1321871940 YDDUYINHOOKVDH-QMMMGPOBSA-N 269.261 -0.440 5 20 CBBD C[C@H](N)[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 1326086805 FYGXZEATTGMKTO-CBAPKCEASA-N 283.288 -0.484 5 20 CBBD CN1CCC[C@@H]1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1331694014 HFEQSBWSYOANKC-SNVBAGLBSA-N 294.311 -0.033 5 20 CBBD Cn1cc([C@H]2C[S@](=O)CCN2CC[N+](=O)[O-])cn1 1333461052 KBZJWTIMIUCCLI-MLCYQJTMSA-N 272.330 -0.198 5 20 CBBD N[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@H]1F 1350405627 RSOIHOXRSCUXDD-RNFRBKRXSA-N 272.240 -0.916 5 20 CBBD CO[C@@H](C(=O)O)C(=O)Nc1c([N+](=O)[O-])ncn1C 1593910877 CLNITYZWJQQRKN-SCSAIBSYSA-N 258.190 -0.634 5 20 CBBD CN(C)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 37883236 VPWLVFZEJOSEJZ-SNVBAGLBSA-N 257.294 -0.697 5 20 CBBD CCCCN(CC(N)=O)C(=O)Cn1cnc([N+](=O)[O-])n1 49227047 GHAYWEKBGKBRQE-UHFFFAOYSA-N 284.276 -0.700 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCCN(CCO)CC1 71349574 JAANFHKHORSISK-UHFFFAOYSA-N 269.305 -0.167 5 20 CBBD CS(=O)(=O)CCNc1ncc([N+](=O)[O-])c(N)n1 76268657 CLFWATCVODMROC-UHFFFAOYSA-N 261.263 -0.577 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 135531725 ASKJGPBMODVBMB-VIFPVBQESA-N 283.240 -0.063 5 20 CBBD Cc1nc(NC(=O)Cn2ncn(C)c2=O)ccc1[N+](=O)[O-] 183091829 CPLGTBIWBJSPBJ-UHFFFAOYSA-N 292.255 -0.168 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C[C@H](CO)O1 229997279 PVWLNXBPDSLTPV-VXNVDRBHSA-N 297.267 -0.083 5 20 CBBD Nc1ccc(C(=O)N2C[C@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 236344769 UKWVGFCRAWEQSQ-UWVGGRQHSA-N 267.241 -0.645 5 20 CBBD C[C@@H](O)CN(CCn1cc([N+](=O)[O-])cn1)[C@H](C)CO 248935424 NDNZQPUZEQHOCY-NXEZZACHSA-N 272.305 -0.145 5 20 CBBD Cc1nn(C)c(NCCN2CCNC(=O)C2)c1[N+](=O)[O-] 272740266 CRLUNOWJYSFMBS-UHFFFAOYSA-N 282.304 -0.520 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NCC1CC1 276583894 YLHCUEROQCXLJM-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@@H](O)[C@H](O)C1 277567509 QDMGITMAUORKGW-NXEZZACHSA-N 295.251 -0.903 5 20 CBBD O=[N+]([O-])c1cc2c(c(CN3C[C@H](O)[C@H](O)C3)c1)OCOC2 278681814 IWFMSTFTMOEGBU-TXEJJXNPSA-N 296.279 -0.001 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 279644139 ZHNFUMOJWKSUEK-MADCSZMMSA-N 297.267 -0.035 5 20 CBBD COC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 299476558 AHOZYLAXSCYUEP-UHFFFAOYSA-N 283.240 -0.612 5 20 CBBD C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@H](CO)O1 302785464 VFHUDOMCKMINLT-RNFRBKRXSA-N 269.261 -0.447 5 20 CBBD C[C@H](CN)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 347682939 PDZWCWLRYUUELU-SSDOTTSWSA-N 255.278 -0.010 5 20 CBBD O=C1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CN1 353939582 ONBWXOLPIRWEBF-QMMMGPOBSA-N 279.252 -0.022 5 20 CBBD CCNC(=O)CN1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 364486694 VGVMQGWDQPGXTE-GHMZBOCLSA-N 298.343 -0.678 5 20 CBBD CN1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C(=O)N1 450608856 JQTKWFZHCCEEIJ-JTQLQIEISA-N 296.258 -0.262 5 20 CBBD CN1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(=O)N1 450616430 QZSIOEXTTGDBAB-QMMMGPOBSA-N 294.267 -0.565 5 20 CBBD CNc1nc(C(=O)NC[C@](C)(O)CO)ccc1[N+](=O)[O-] 456046323 XMZZMCVGMRSUKL-NSHDSACASA-N 284.272 -0.495 5 20 CBBD CC(=O)NCCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 566011796 GAOGKFFDDNCTLV-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD CO[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](CN)C1 574400352 IILYQZYNURQACP-HTQZYQBOSA-N 283.288 -0.104 5 20 CBBD CCN(CCS(C)(=O)=O)C(=O)c1cc([N+](=O)[O-])n[nH]1 802854373 UBOCPMWVTZHHIA-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD CNC(=O)[C@@H](O)CNc1cc(N)ccc1[N+](=O)[O-] 808048498 VVOLCAIEXHGAIZ-VIFPVBQESA-N 254.246 -0.304 5 20 CBBD NC(=O)[C@@]1(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCOC1 847052786 GHNBIEDINLSPDI-DGCLKSJQSA-N 295.295 -0.138 5 20 CBBD COC(COCCNC(=O)c1n[nH]cc1[N+](=O)[O-])OC 1321794066 LIRBBIYXBRDPAV-UHFFFAOYSA-N 288.260 -0.317 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NC[C@H](F)C(=O)O 1601384125 HRMQSAXRKFSWTR-LURJTMIESA-N 287.203 -0.705 5 20 CBBD Cn1cc(COC(=O)COCC(=O)O)c([N+](=O)[O-])n1 1605496394 BQEJNBWSXJFFOR-UHFFFAOYSA-N 273.201 -0.527 5 20 CBBD Nc1ncc(C(=O)N2CC(C(=O)O)C2)cc1[N+](=O)[O-] 1605655650 TXNJBBJMRDGOKT-UHFFFAOYSA-N 266.213 -0.271 5 20 CBBD COCCNC(=O)CNc1c([N+](=O)[O-])ncn1C 8375798 FFVXDRSMKVRQQH-UHFFFAOYSA-N 257.250 -0.497 5 20 CBBD COC(=O)[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CCO1 103134479 JUJZGGOJHPJLBN-QMMMGPOBSA-N 270.245 -0.377 5 20 CBBD O=C(O)C[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 129439860 ZOPUFFJDDRUESW-QMMMGPOBSA-N 298.255 -0.507 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCCCNC1=O 194331496 QCXBLAZEYSBTTJ-JTQLQIEISA-N 295.299 -0.034 5 20 CBBD CNC[C@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 237130500 AGEGZYKIAXMRDH-VIFPVBQESA-N 282.300 -0.272 5 20 CBBD COCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286092679 WJVLETVRAIQGAD-LURJTMIESA-N 258.234 -0.555 5 20 CBBD COC[C@@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 338423321 MACIPBVUGZEBQP-LURJTMIESA-N 296.326 -0.058 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 354158430 LCJKJAASJFSCGX-MRVPVSSYSA-N 298.251 -0.251 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCCS(=O)(=O)CC2)n1 357930001 UFGMWJCXQCAPDR-UHFFFAOYSA-N 288.329 -0.088 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 362410225 JHWJTFJBSPQCKI-LLVKDONJSA-N 299.239 -0.651 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cc([N+](=O)[O-])ccc1O 447633660 DHKKYACERIXAAE-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD NC(=O)NC(=O)OCCCn1cnc([N+](=O)[O-])c1 494107020 LUQAJUOBDYCRGO-UHFFFAOYSA-N 257.206 -0.014 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 548085288 UFZBWOOQYNCCBW-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD COC(=O)C(C)(C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 548738424 GWIFDVMTCPXJNN-UHFFFAOYSA-N 256.218 -0.001 5 20 CBBD Nc1nccc(C(=O)N[C@H]2CCCCNC2=O)c1[N+](=O)[O-] 572301760 OAKWUPUAJMRPJH-QMMMGPOBSA-N 293.283 -0.030 5 20 CBBD CNC(=O)C1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 583574360 WHFUBDJKDJSKGO-UHFFFAOYSA-N 279.256 -0.610 5 20 CBBD Nc1ccc(N2CCO[C@H](C(=O)O)C2)nc1[N+](=O)[O-] 595965544 FVRXTXNSOIANOY-ZETCQYMHSA-N 268.229 -0.138 5 20 CBBD CCN(CCn1ccc([N+](=O)[O-])n1)CC(=O)NC 747962001 PEICYIYDGHNYMB-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC(C(N)=O)=NO1 793898709 VLEPTYYWFWZPKD-SSDOTTSWSA-N 295.255 -0.707 5 20 CBBD Cn1nncc1COC(=O)Cn1cc([N+](=O)[O-])cn1 809134861 HPBMYTFKYQMWRE-UHFFFAOYSA-N 266.217 -0.337 5 20 CBBD COCC1(O)CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1117950675 GPPRCCKNTMMVTG-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CO)CCF 1118271527 QXBQHMUEXFVGLN-LURJTMIESA-N 260.225 -0.221 5 20 CBBD O=[N+]([O-])CCN1CCS(=O)(=O)[C@H]2COCC[C@H]21 1341532548 GUMMYIBYDDQOBS-BDAKNGLRSA-N 264.303 -0.849 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CCO1 112669645 MACINYVWTHCZRB-VIFPVBQESA-N 297.267 -0.053 5 20 CBBD COCCCNC(=O)Cn1cccc([N+](=O)[O-])c1=O 161679798 QHRQEIGAUHYTQO-UHFFFAOYSA-N 269.257 -0.091 5 20 CBBD NC(=O)c1ccc(CN2CCOC[C@H]2CO)c([N+](=O)[O-])c1 168774877 HISNKIOXOSRTOX-LLVKDONJSA-N 295.295 -0.113 5 20 CBBD NC(=O)C1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CCCC1 265296361 ZAMRFGQXFZANMR-UHFFFAOYSA-N 295.299 -0.047 5 20 CBBD CN(Cn1cccc([N+](=O)[O-])c1=O)S(C)(=O)=O 270677247 SXENNOPNAVWTGR-UHFFFAOYSA-N 261.259 -0.395 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 274422753 ONYCTBKOVZOXNH-NXEZZACHSA-N 298.299 -0.210 5 20 CBBD O=C(CNC(=O)c1cnc(O)c([N+](=O)[O-])c1)NC1CC1 274882575 IWUSRRAAEGIYRU-UHFFFAOYSA-N 280.240 -0.296 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 279058555 BIWPTQPWIURNIN-JOYOIKCWSA-N 298.299 -0.163 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CC(=O)N(C)C2)c1[N+](=O)[O-] 330445783 RCPHSSPMXGOAJY-ZETCQYMHSA-N 281.272 -0.403 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1COC[C@@H]1O 352795689 UAQZAFHYQQSVJK-IUCAKERBSA-N 256.262 -0.517 5 20 CBBD CN(Cc1ncon1)C(=O)c1cc([N+](=O)[O-])n[nH]1 354737328 UFORIRUQAZSMHD-UHFFFAOYSA-N 252.190 -0.027 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 362357375 FKLIRLYUOQEISJ-VXNVDRBHSA-N 297.267 -0.083 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1 445207102 BTWBDDAQXJXPGG-LBPRGKRZSA-N 296.283 -0.508 5 20 CBBD CC(CO)(CO)CNC(=O)CCn1cc([N+](=O)[O-])cn1 552402879 ZQLIKMXCUZTKBR-UHFFFAOYSA-N 286.288 -0.712 5 20 CBBD CC(C)(C)[C@@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 564841250 SBBCWHDHQGAXCL-SSDOTTSWSA-N 270.293 -0.324 5 20 CBBD CC(C)NCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 564981696 WCMQGMFNKRCEAE-UHFFFAOYSA-N 270.293 -0.309 5 20 CBBD CN(CC[N+](=O)[O-])C1CCN(S(C)(=O)=O)CC1 791054295 ZJGLDDINEMROHD-UHFFFAOYSA-N 265.335 -0.381 5 20 CBBD CCS(=O)(=O)N(C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839529490 RSILWLYSKMJWFV-RKDXNWHRSA-N 293.345 -0.561 5 20 CBBD CN[C@H]1CCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923284983 YNKQMICAKXOZRF-JQWIXIFHSA-N 283.332 -0.164 5 20 CBBD CC(C)(C)NC(=O)CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126943131 MIURZRVEVZXILV-RKDXNWHRSA-N 286.332 -0.728 5 20 CBBD O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H](CO)[C@H](CO)C1 1167951713 CBXQPGLOGGLPMP-IUCAKERBSA-N 296.279 -0.027 5 20 CBBD C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)c1nncn1C 1320759609 BXSYOESBOSLHMX-MRVPVSSYSA-N 293.287 -0.160 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1323515959 TVGYGPBDUJGGNW-ZETCQYMHSA-N 283.288 -0.218 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CNCCCO1 1326170118 UUMXTKYKMRDNME-SNVBAGLBSA-N 297.315 -0.406 5 20 CBBD C[C@@H](CN1CCN(C)CC1)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1339549782 SLYJKHVLRRZHOE-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD O=C(N[C@H](CC1OCCO1)C(=O)O)c1cc([N+](=O)[O-])c[nH]1 1601414189 MURAMHXAMWQYKQ-MRVPVSSYSA-N 299.239 -0.131 5 20 CBBD COCCOCCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1605112215 SYMOZUOUJFRZEM-UHFFFAOYSA-N 283.248 -0.366 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 35160310 WRXUOVYZGMELES-RXMQYKEDSA-N 258.186 -0.549 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 48242931 VYTGYKIYHSUNOD-SSDOTTSWSA-N 269.261 -0.568 5 20 CBBD COC[C@@H](O)CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 71270886 URGUUCRBXSSNBS-QMMMGPOBSA-N 290.297 -0.120 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 88374168 NHSKQKCGOUSJQL-MRVPVSSYSA-N 269.213 -0.152 5 20 CBBD COc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 227865559 DSOVMPOIJSNPLW-MRVPVSSYSA-N 283.240 -0.821 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCCNC1 238143778 NOLYCPQVBJBOMK-SECBINFHSA-N 267.289 -0.093 5 20 CBBD C[C@@H](CN(C)C)NC(=O)Cn1ccc([N+](=O)[O-])n1 286868108 CXBHVRYJCRSZJX-QMMMGPOBSA-N 255.278 -0.142 5 20 CBBD C[C@@H](O)C(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 330562414 JMVJZXKDDPPDAG-MRVPVSSYSA-N 296.283 -0.412 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1C)[C@H](C)O 347922678 QALSRZOZXYJMLV-OIBJUYFYSA-N 297.267 -0.050 5 20 CBBD CN1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C(=O)N1 393943980 CMXFABMMNSTIFZ-ZETCQYMHSA-N 279.256 -0.748 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])CN1 444191270 IRUWKJZLSVQEFB-SECBINFHSA-N 299.308 -0.097 5 20 CBBD N[C@H]1C[C@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN2C1=O 571702586 NMXGHLKRVDNQGH-ONGXEEELSA-N 294.315 -0.965 5 20 CBBD O=C(CNC(CO)CO)N1CCc2cc([N+](=O)[O-])ccc21 573813557 VBTAVUNZAXUAQE-UHFFFAOYSA-N 295.295 -0.573 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 592462844 AFXOVOKHWFBEOH-APPZFPTMSA-N 297.267 -0.081 5 20 CBBD Cc1nn([C@H]2CCN(CC(=O)O)C2=O)cc1[N+](=O)[O-] 596015038 ZFGNBUSOSCVDQM-ZETCQYMHSA-N 268.229 -0.042 5 20 CBBD COC(=O)C[C@H](O)CNc1ncc([N+](=O)[O-])s1 599165015 NXWJBRPZHWLWLL-YFKPBYRVSA-N 261.259 0.387 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H](CO)CC(F)F 717733844 RCRSOFDKXSFGBM-ZCFIWIBFSA-N 278.215 -0.076 5 20 CBBD CON(C)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 773169155 OQRYSHAJMUIGHW-UHFFFAOYSA-N 271.277 -0.209 5 20 CBBD CN1CCC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 778777966 DMOKJJVSVZSBIR-MRVPVSSYSA-N 282.256 -0.045 5 20 CBBD CN(C)c1noc(COC(=O)Cn2cnc([N+](=O)[O-])n2)n1 801236676 YFUSOLIRDRILMI-UHFFFAOYSA-N 297.231 -0.621 5 20 CBBD CNS(=O)(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839684344 MZGCBJOQBQPHJG-DJLDLDEBSA-N 291.329 -0.808 5 20 CBBD O=C1O[C@H]2C[C@H]1N(C(=O)Cn1ccc([N+](=O)[O-])n1)C2 861871627 SYEMSTXPUIKUQQ-NKWVEPMBSA-N 266.213 -0.682 5 20 CBBD O=C(NC1CN(C(=O)C2=CCOCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282279 ZLRSVPOQXMNWPQ-GHMZBOCLSA-N 295.295 -0.675 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCN1CC=CC1 1116127497 BQSKASJIZBFRKI-UHFFFAOYSA-N 292.295 -0.256 5 20 CBBD CNC(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1319647478 DELRZZXYPINQLY-UHFFFAOYSA-N 255.234 -0.854 5 20 CBBD NC1(CO)CCN(c2ncc([N+](=O)[O-])cn2)CC1 1320167601 UDHQZGYSOSIIHG-UHFFFAOYSA-N 253.262 -0.325 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1323515956 TVGYGPBDUJGGNW-SSDOTTSWSA-N 283.288 -0.218 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNOC2CCOCC2)c1 1326157502 YSUUHVQMUWNYDB-JTQLQIEISA-N 286.288 -0.148 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1C(=O)O 1328335981 BIYXGBQGQUJPHO-SFYZADRCSA-N 297.271 -0.245 5 20 CBBD CN1CC[C@H]1CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1340178221 FBJYXFQQJJKMAU-VIFPVBQESA-N 280.284 -0.423 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCCS(N)(=O)=O 44350753 UQDXRIIUTYJELO-UHFFFAOYSA-N 263.279 -0.581 5 20 CBBD CN(C)CCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 114674954 KKPFVNGOCLLDJY-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD CN1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1 171768762 NDEYDMZAXDBXPW-VIFPVBQESA-N 267.289 -0.141 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 228705366 UIZXXISQDNJTSE-GZMMTYOYSA-N 284.272 -0.553 5 20 CBBD CC(=O)NCCCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 275060059 URACMZHRFPSXKQ-UHFFFAOYSA-N 282.256 -0.049 5 20 CBBD NC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1 296486724 NKBJDCJUNCXCDQ-JTQLQIEISA-N 250.258 -0.142 5 20 CBBD NC(=O)[C@H](O)CNc1c(Cl)cncc1[N+](=O)[O-] 302615529 YWPWVBJJBUFGBC-ZCFIWIBFSA-N 260.637 -0.099 5 20 CBBD C[C@@](CO)(NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 313502354 QLYOJGLRMMCPIU-VIFPVBQESA-N 258.186 -0.247 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1=O 340221252 OSCIOUPANUAXSI-SECBINFHSA-N 253.262 -0.388 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCNC1=O 341750091 KFCDDFVCNOHZGR-JTQLQIEISA-N 280.284 -0.423 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 344685020 WGVCZGAJBUDBGB-ZETCQYMHSA-N 283.288 -0.259 5 20 CBBD CNS(=O)(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1O 345379549 POEMPIDAJXNTRJ-UHFFFAOYSA-N 289.269 -0.212 5 20 CBBD O=C(N[C@@H](CO)[C@@H]1CCCO1)c1cc([N+](=O)[O-])n[nH]1 355459090 SVWSYQDZKAEXCY-YUMQZZPRSA-N 270.245 -0.412 5 20 CBBD C[C@@]1(C(N)=O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 355493040 BAAPOOGUJUUMGU-SNVBAGLBSA-N 267.245 -0.345 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C1 356432397 WAAGOHAZXROJOQ-SSDOTTSWSA-N 282.256 -0.037 5 20 CBBD CN(C(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H]1CCNC1=O 445146074 WHYGIQKNSPXJPO-SSDOTTSWSA-N 280.240 -0.344 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cc[nH]n1 492888859 KENJNUUSBNTYHB-UHFFFAOYSA-N 250.218 -0.056 5 20 CBBD O=C(O)[C@@H]1COCCN1CCn1cc([N+](=O)[O-])cn1 516075854 HAXBRLYOTWAURG-VIFPVBQESA-N 270.245 -0.423 5 20 CBBD CN1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1 548408108 JYDIXFMHTVHCSX-UHFFFAOYSA-N 265.273 -0.040 5 20 CBBD CN(CCCN)S(=O)(=O)c1cccnc1[N+](=O)[O-] 567110090 QRPYFRMFMVAJCU-UHFFFAOYSA-N 274.302 -0.041 5 20 CBBD CCNC(=O)CN(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 619786189 ULCUHIWOBACSIS-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CC[C@@](C)(NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 770021581 YQAKUXQUGDRAIS-GFCCVEGCSA-N 296.283 -0.473 5 20 CBBD CC(C)[C@H](CO)ONC(=O)c1n[nH]cc1[N+](=O)[O-] 857286393 ZSSGATVBUDZHFH-ZETCQYMHSA-N 258.234 -0.004 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC=CC1 990571776 IHRKDQWCOHAAEZ-GHMZBOCLSA-N 279.296 -0.055 5 20 CBBD Cc1cc[nH]c1C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991098425 QNFGKANVSDCCET-NXEZZACHSA-N 292.295 -0.071 5 20 CBBD O=C(Cc1nc[nH]n1)NCCNc1ncccc1[N+](=O)[O-] 1093852123 VZDZZHUFZNENOD-UHFFFAOYSA-N 291.271 -0.121 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1n[nH]cc1[N+](=O)[O-] 1118953422 QGQSKEFDNXSILS-SSDOTTSWSA-N 269.261 -0.886 5 20 CBBD COCCC(=O)NCCCNCc1c([N+](=O)[O-])ncn1C 1154021215 DPIXOFOQXJUUID-UHFFFAOYSA-N 299.331 -0.039 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCn1cccn1 1319645144 FKHYMHIDHGNHMK-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD Cc1noc(Cn2nnnc2[C@@H](C)O)c1[N+](=O)[O-] 1333721124 JFNODRVUZJRRSV-RXMQYKEDSA-N 254.206 -0.021 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@](O)(C(=O)O)C1 1601216743 OWLORKRABGEZLW-GFCCVEGCSA-N 295.251 -0.161 5 20 CBBD CC(=O)NCCNC(=O)Cn1cc([N+](=O)[O-])cn1 44669229 WORCWAPWVHPUHJ-UHFFFAOYSA-N 255.234 -0.956 5 20 CBBD CC(=O)N1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 159726338 DVVWQGXDNGRTHX-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD Cc1nn(CCC(=O)NCCO)c(C)c1[N+](=O)[O-] 164069321 BUWIVSYUALULQI-UHFFFAOYSA-N 256.262 -0.093 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NCCn1cc([N+](=O)[O-])ccc1=O 193661117 FISIAIIDJGUWSL-SKDRFNHKSA-N 294.311 -0.129 5 20 CBBD CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262517863 QCVXPTUGQIHUJJ-QMMMGPOBSA-N 283.240 -0.264 5 20 CBBD CCc1[nH]nc(C(=O)NCCC(=O)NC)c1[N+](=O)[O-] 345583717 FSCOBZHBCYEKEE-UHFFFAOYSA-N 269.261 -0.254 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCn1ccnc1 356163649 HALJJDFTWKTGEK-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD Cn1c(C(=O)NCCN2CCNC(=O)C2)ccc1[N+](=O)[O-] 357986499 GAVYXPKPKYZQLS-UHFFFAOYSA-N 295.299 -0.905 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 359799736 SWASRWLBLTVEPJ-GFCCVEGCSA-N 297.315 -0.386 5 20 CBBD O=C([C@H]1CNCCO1)N1CCc2ncc([N+](=O)[O-])cc2C1 424173984 OVQMEVIFPKFMHN-GFCCVEGCSA-N 292.295 -0.137 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1c1ncc([N+](=O)[O-])cn1 428225552 BWRWMZBENLNLEO-SFYZADRCSA-N 268.229 -0.503 5 20 CBBD NCCNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1 428741467 ZMEVTMDIWYSPLW-UHFFFAOYSA-N 295.299 -0.531 5 20 CBBD CN(C)C[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1O 588864495 KQOYVCCFTIFLEY-MRVPVSSYSA-N 283.284 -0.047 5 20 CBBD Nc1ccc(C(=O)N[C@H](CO)C(=O)O)cc1[N+](=O)[O-] 739205383 QROOKDZLGQQOKH-SSDOTTSWSA-N 269.213 -0.648 5 20 CBBD CC1(C)COCCN1CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839652073 SXNPHBBLFBNROR-NXEZZACHSA-N 271.317 -0.121 5 20 CBBD Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)CNC(=O)CN)CC2 843495619 VDNCDCUKJBVZHJ-UHFFFAOYSA-N 292.295 -0.133 5 20 CBBD CC(C)C(=O)N(CCO)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057000323 PNPKPCCUYHLYTD-NXEZZACHSA-N 287.316 -0.755 5 20 CBBD Cc1cnc(N(C)CCN(C)C(=O)C(N)=O)c([N+](=O)[O-])c1 1105543062 IIDKFKQHGKWLFD-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD CNC(=O)COC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318001492 XKEVOVHSZZSQTG-UHFFFAOYSA-N 256.218 -0.460 5 20 CBBD NC(=O)C[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1 1323291704 UJOXTIAAUAYUPG-VIFPVBQESA-N 295.299 -0.095 5 20 CBBD NC[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCCO1 1326166495 OHWSNOOYNSJXEY-SSDOTTSWSA-N 269.261 -0.492 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C1[C@H]2CNC[C@H]12 1515553674 LNJWTNCNGMMAKX-IUCAKERBSA-N 279.300 -0.224 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC(C)(C)N 1579877474 OSMVJGLYHZMFDD-UHFFFAOYSA-N 255.278 -0.047 5 20 CBBD O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCNC[C@H]1CO 1580474954 CYFBVZBNIYAJRW-RYUDHWBXSA-N 295.295 -0.579 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H](F)C(=O)O 1601162192 HJMKQMJBQOQBMP-LURJTMIESA-N 272.192 -0.077 5 20 CBBD C[C@@](O)(CO)CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603690274 DZZMIDZVLQFOKC-NSHDSACASA-N 294.271 -0.070 5 20 CBBD O=C(O)C(=O)COC(=O)c1ccc([N+](=O)[O-])cn1 1605880749 KSLJWDRBRHXVML-UHFFFAOYSA-N 254.154 -0.200 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1)C1CC1 1606615966 FMZUUIZLFJMKTJ-UHFFFAOYSA-N 263.217 -0.050 5 20 CBBD CN(CCO)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 120370415 YQWCAUGSEPYNDI-UHFFFAOYSA-N 281.268 -0.225 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])cnc1N 230706267 LGTFKYMSGILVAZ-APPZFPTMSA-N 296.283 -0.206 5 20 CBBD CCc1[nH]nc(C(=O)NCCN2CCOCC2)c1[N+](=O)[O-] 263679919 GUKYALILCSZCCA-UHFFFAOYSA-N 297.315 -0.058 5 20 CBBD O=C(N[C@@H]1COC[C@H]1O)c1cc2c(c([N+](=O)[O-])c1)OCO2 297011673 RCRCZDPGCIUBGD-VXNVDRBHSA-N 296.235 -0.187 5 20 CBBD O=C1C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CN1 353907920 IFBFCYPFOYJDIY-SSDOTTSWSA-N 267.245 -0.814 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H](O)COCC1CC1 359549932 FKONUEVKUBPXQR-SNVBAGLBSA-N 298.299 -0.305 5 20 CBBD COC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 497093037 JMENAKANMKPYOF-HTQZYQBOSA-N 257.246 -0.438 5 20 CBBD COCCN(C)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 558749854 YRZLCYXXOXVFOU-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD O=C(O)N1CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 832031690 XNQCMRDVKTWREC-SNVBAGLBSA-N 299.287 -0.552 5 20 CBBD O=C(O)[C@H]1C[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 833178624 HLIHFKKXPJGQIU-YUMQZZPRSA-N 268.229 -0.372 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H](N2CC[C@H](O)C2)C1 1117737930 XUVQGWJHZHOZTB-IUCAKERBSA-N 295.299 -0.401 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)CC(N)=O 1251411013 IRGFYAKWGAZAEJ-UHFFFAOYSA-N 269.261 -0.566 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCCn2nccc21 1321450829 ANTSYZYNPYRYKN-UHFFFAOYSA-N 277.244 -0.180 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnnn1C 1336157774 GFDKYRJOHHTHPJ-LURJTMIESA-N 280.248 -0.808 5 20 CBBD CN(Cc1cnn[nH]1)S(=O)(=O)c1ncccc1[N+](=O)[O-] 1576861148 ATGBUQRWQXAENL-UHFFFAOYSA-N 298.284 -0.071 5 20 CBBD O=C(N[C@@H]1CNCC12CC2)c1n[nH]cc1[N+](=O)[O-] 1580621997 FORZSEUUDCUIHF-SSDOTTSWSA-N 251.246 -0.200 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@](O)(C(=O)O)C2)n1 1597899686 PHLJHYLKUXSGKD-NSHDSACASA-N 298.255 -0.527 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@H]2C[C@@]21C(=O)O 1601390207 WFYMSXBLUQPWEH-HQJQHLMTSA-N 295.255 -0.348 5 20 CBBD O=C1NC[C@H](Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)O1 1609044313 SNCKQJDGRZQTGN-ZCFIWIBFSA-N 283.196 -0.437 5 20 CBBD O=C(O)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 49871664 NAWIOSTVXOMXJC-SSDOTTSWSA-N 254.202 -0.325 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 90275665 MBIPTISCZSNHME-SECBINFHSA-N 258.186 -0.247 5 20 CBBD NC(=O)NC(=O)Cn1cnc2cc([N+](=O)[O-])ccc2c1=O 107577679 DPYSTUNZSYZWOH-UHFFFAOYSA-N 291.223 -0.500 5 20 CBBD Nc1nc(NCC(=O)N2CCOCC2)ncc1[N+](=O)[O-] 271925733 VJYPBXFQMNRIBV-UHFFFAOYSA-N 282.260 -0.762 5 20 CBBD C[C@H](CS(C)(=O)=O)N(C)c1ncc([N+](=O)[O-])c(N)n1 301224737 FKTBLAOTTNRQML-ZCFIWIBFSA-N 289.317 -0.164 5 20 CBBD O=C(N[C@@]1(CO)CCOC1)c1cc([N+](=O)[O-])c[nH]1 330849973 LFDSPQDMGRXMHI-SNVBAGLBSA-N 255.230 -0.196 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 338450047 BGRGEIXCRRLXFF-QMMMGPOBSA-N 297.267 -0.318 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C1CCNCC1 353772007 XPOUATBWANKDCT-UHFFFAOYSA-N 267.289 -0.093 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](O)C(F)F 355145006 ANXNTYFYVOOYME-LURJTMIESA-N 278.215 -0.158 5 20 CBBD Cn1cncc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 356777589 KRVUDEGJPVDJIM-UHFFFAOYSA-N 250.218 -0.019 5 20 CBBD CN1C(=O)CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1=O 579011662 TVTRVZQSOYLAIH-UHFFFAOYSA-N 291.263 -0.036 5 20 CBBD COC[C@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)OC 579976793 PGYFZVXDRXTYEO-ZETCQYMHSA-N 298.255 -0.510 5 20 CBBD CN(CCN1CCNCC1)C(=O)Cn1ccc([N+](=O)[O-])n1 592469563 UUYFIVBQIVRGKV-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD CCN(C)S(=O)(=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 744241439 HZHDTHJJWUAIMA-UHFFFAOYSA-N 291.289 -0.896 5 20 CBBD CN(CC(=O)OCCn1cc([N+](=O)[O-])cn1)C(=O)O 828120224 GOHIXCACUWDQTF-UHFFFAOYSA-N 272.217 -0.056 5 20 CBBD CCn1cc(S(=O)(=O)N(C)C[C@H](C)N)c([N+](=O)[O-])n1 858643074 UGQXPVQYEUWIDF-ZETCQYMHSA-N 291.333 -0.221 5 20 CBBD NC(=O)C(=O)NCCNc1ccc(F)cc1[N+](=O)[O-] 1094079646 TYRRKJZTTSWVRD-UHFFFAOYSA-N 270.220 -0.253 5 20 CBBD CC(=O)N(C)CCNc1ncc([N+](=O)[O-])c(N)n1 1101486371 ATXCUNILIRUADE-UHFFFAOYSA-N 254.250 -0.143 5 20 CBBD CN(C)c1noc(CNC(=O)c2c([N+](=O)[O-])cnn2C)n1 1116728192 NDLHNWREBKDHJC-UHFFFAOYSA-N 295.259 -0.293 5 20 CBBD O=C1CNC(=O)N1CCCn1cnc([N+](=O)[O-])n1 1317960696 KBNDPJALRQGWGO-UHFFFAOYSA-N 254.206 -0.872 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1319756519 PAZCFXUSGRHVEH-QMMMGPOBSA-N 295.299 -0.074 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@]2(O)CCO[C@H]2C)c1[N+](=O)[O-] 1321428861 CIBLZHQVGMAAOW-QPUJVOFHSA-N 298.299 -0.094 5 20 CBBD CN(Cc1nncn1C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1325221552 FPVHOIXWCKVMGX-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD O=C(O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1602208442 BHPWIBSVJMDZNF-GJMOJQLCSA-N 268.229 -0.813 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@](O)(C(=O)O)C1 1609028841 RETRDZFILGUGLA-LBPRGKRZSA-N 296.235 -0.038 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2CNC[C@@H]2C1 195214658 JNNWRLMATRHGAN-DTORHVGOSA-N 265.273 -0.531 5 20 CBBD C[C@@H]1C[C@@H](CN)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 262110495 ZZWFODCPXIXAMR-ZJUUUORDSA-N 294.311 -0.048 5 20 CBBD C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@H](O)C1 278863998 SEVOKZFEEVOTGL-FXAINCCUSA-N 295.295 -0.041 5 20 CBBD COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286869504 YQROQAGDXVWGJD-ZCFIWIBFSA-N 258.234 -0.555 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 299723578 OLPRMXLFIYBUOT-LURJTMIESA-N 252.230 -0.117 5 20 CBBD CCC(CC)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 342534452 WCBMZZZRWCUZBN-UHFFFAOYSA-N 285.260 -0.054 5 20 CBBD CN(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])n1C 345058504 VRMMZGIOSMXMNR-UHFFFAOYSA-N 254.246 -0.249 5 20 CBBD NC(=O)CCn1ccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 352980564 BTIFHJMOLYVZDV-UHFFFAOYSA-N 293.243 -0.358 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC(C)(C)c2nn[nH]n2)n1 427858061 SAARXYKVAZQSQU-UHFFFAOYSA-N 294.275 -0.011 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H](C)O 527195584 HXKGEBJWSFVVNW-IMTBSYHQSA-N 283.240 -0.358 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](CN)C1 581883045 FGDRRHVKTCMTML-JTQLQIEISA-N 296.331 -0.717 5 20 CBBD CNC[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 595984121 VFQVUBNWVIFWPO-ZETCQYMHSA-N 255.278 -0.176 5 20 CBBD COC(=O)c1ccnc(N(C)C[C@H](O)CO)c1[N+](=O)[O-] 598616441 PHMUJNYQKKNFRY-ZETCQYMHSA-N 285.256 -0.434 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@H]1C[C@@H](O)C1 599670375 FGCPQDXXUYDYHF-ADEWGFFLSA-N 284.316 -0.145 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])[nH]1 600471284 WENAOHYYCUCBJR-ZCFIWIBFSA-N 271.229 -0.423 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H](CO)CC(F)F)c1 717712356 IYWCQJHRJMTPEM-VXNVDRBHSA-N 294.258 -0.242 5 20 CBBD Cc1nnc(S)n1CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 791371814 XCNOZFOFRPQURE-UHFFFAOYSA-N 297.300 -0.063 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N 801798885 MYXIALWUPSEEOW-UHFFFAOYSA-N 270.220 -0.208 5 20 CBBD CCCc1[nH]nc(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 807918224 JVWQRHGMSFHOHI-UHFFFAOYSA-N 294.275 -0.313 5 20 CBBD Cc1nc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)co1 1030292984 CNNBWWHEHHLOGG-GHMZBOCLSA-N 280.284 -0.051 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)CC(C)(C)O 1126477537 QLDUEZPTTNJGCA-UHFFFAOYSA-N 299.331 -0.305 5 20 CBBD O=C(CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NCC1CCC1 1126932070 HDKVCVCEKKTQSA-GHMZBOCLSA-N 298.343 -0.726 5 20 CBBD COc1ncccc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932335 SUBUSDWEJBXBEK-GHMZBOCLSA-N 294.311 -0.039 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](CO)[C@H](CO)C1 1329079510 YTGXPBGAVZBGDF-IUCAKERBSA-N 296.279 -0.027 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@](N)(CO)C2)n1 1578349887 BWPWZBIPEBBBHF-GFCCVEGCSA-N 297.315 -0.263 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1 35160335 KIECQTGKPXDTQJ-SECBINFHSA-N 268.225 -0.142 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])c[nH]1 35165483 UKAVTBCNUZAKMJ-ZETCQYMHSA-N 257.202 -0.813 5 20 CBBD O=C(O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 42273407 UOTIOKLCGKNMSE-UHFFFAOYSA-N 267.245 -0.409 5 20 CBBD O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[C@H](O)CO 105843967 WSZBDWHWKQGSLV-LURJTMIESA-N 266.209 -0.456 5 20 CBBD CCCN(CC(=O)NC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 173556348 GQEBADFMFMINHS-LLVKDONJSA-N 299.331 -0.390 5 20 CBBD COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)[C@H](C)O 275999289 OJVZZFNWVKSXSK-YLWLKBPMSA-N 299.239 -0.652 5 20 CBBD CN(C)C(=O)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 330530168 ZYEMPTPEGUOVOA-UHFFFAOYSA-N 255.234 -0.522 5 20 CBBD O=C1NC(=O)N2CCN(CCn3cc([N+](=O)[O-])cn3)C[C@H]12 332196390 CAJUZYCIEVZZLK-SECBINFHSA-N 294.271 -0.973 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@](F)(CO)C2)c1 338597870 YLCSMJFNSZZEPI-GHMZBOCLSA-N 288.279 -0.442 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](S(N)(=O)=O)C1 342429463 YCQUPUWKSGMHTN-ZETCQYMHSA-N 289.317 -0.414 5 20 CBBD NC(=O)c1ccnc(NCCCn2ccnn2)c1[N+](=O)[O-] 357451171 FXNZOTHZIGCQAV-UHFFFAOYSA-N 291.271 0.182 5 20 CBBD O=C1CCC[C@H](CNc2ncc([N+](=O)[O-])cn2)N1 432941531 ZQOJXYZMHIXXSM-SSDOTTSWSA-N 251.246 0.465 5 20 CBBD NCCN(CCOc1ccccc1[N+](=O)[O-])C[C@H](O)CO 595903716 ZYJYNWLCPUODQV-NSHDSACASA-N 299.327 -0.413 5 20 CBBD NC(=O)[C@H](O)CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 597587601 ZNBAVAAHZOIQBY-HBNTYKKESA-N 293.279 -0.339 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 763256672 DRRMIWZYFFZHKQ-VIFPVBQESA-N 297.267 -0.251 5 20 CBBD C[C@@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1=O 813293693 PVFXDHKLLFRGOF-SNVBAGLBSA-N 268.229 -0.387 5 20 CBBD CCN(CC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 829635625 KRNZZLRWZNEVBM-SECBINFHSA-N 272.261 -0.441 5 20 CBBD CN(C)CCONC(=O)c1ccnc(N)c1[N+](=O)[O-] 848159838 KEQLRMFTUNVVAJ-UHFFFAOYSA-N 269.261 -0.205 5 20 CBBD COCC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 969001852 YFWCVJPEZIRODD-LMLFDSFASA-N 297.311 -0.500 5 20 CBBD O=C(NCC1CN(C(=O)c2ncc[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001804629 CPPBZNBBNQKQSZ-RKDXNWHRSA-N 293.283 -0.737 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1CNC1 1118144395 YXRQHQHBYMUFED-UHFFFAOYSA-N 266.257 -0.908 5 20 CBBD C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1O 1319946701 DNWKXHSGELIWHD-HTRCEHHLSA-N 254.246 -0.219 5 20 CBBD O=C(O)[C@H](CO)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1574817380 BPOOJTNRCFGWLC-DTWKUNHWSA-N 284.224 -0.810 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CCO1 50857201 PUJISHQUAWBLJZ-SNVBAGLBSA-N 279.252 -0.079 5 20 CBBD COCC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 52784361 ZADKVEJXEVKRNN-MRVPVSSYSA-N 286.244 -0.603 5 20 CBBD C[C@@H](N)[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 163129045 UNQIJNMDZUKLOD-KOLCDFICSA-N 297.315 -0.244 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1OC 164898014 YPDWKGKUKFYJMD-SECBINFHSA-N 298.251 -0.133 5 20 CBBD C[C@]1(O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 178013449 JSRDGCSYONGVEG-QWRGUYRKSA-N 270.289 -0.391 5 20 CBBD CCC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nnn[nH]1 268254159 XOJRFAAVGIUBQD-ZETCQYMHSA-N 294.275 -0.038 5 20 CBBD O=C1CN(CCNc2ncc([N+](=O)[O-])cc2F)CCN1 413240296 JOIVBVNWKOEVLU-UHFFFAOYSA-N 283.263 -0.027 5 20 CBBD Cc1[nH]nc(C(=O)NCCCN2CCNCC2)c1[N+](=O)[O-] 428739665 RQHITHOXCAMUGM-UHFFFAOYSA-N 296.331 -0.349 5 20 CBBD CNC(=O)C[C@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-] 576171688 UECMETBKLRVWLM-ZETCQYMHSA-N 295.299 0.286 5 20 CBBD CCN1C[C@H](CN=c2nc(N)c([N+](=O)[O-])c[nH]2)CC1=O 593499305 QJNQRNYCQNCBCY-ZETCQYMHSA-N 280.288 -0.331 5 20 CBBD O=C(c1ccc([N+](=O)[O-])[nH]1)N(CCO)CCOCCO 600117507 VRYMSXGSWIGJGB-UHFFFAOYSA-N 287.272 -0.634 5 20 CBBD CCc1ccc(C(=O)NC[C@@H](O)C(N)=O)cc1[N+](=O)[O-] 618923615 JESYHGZOZTUXDN-SNVBAGLBSA-N 281.268 -0.267 5 20 CBBD COc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCO 619485398 NNXWKDWHBBPOEW-UHFFFAOYSA-N 276.270 -0.126 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1CCn1cc([N+](=O)[O-])cn1 782597710 RWYRXBFSPAJMEW-SECBINFHSA-N 267.289 -0.046 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@H]21 813624739 HMVHXZVAIWJBTD-BDINMYNLSA-N 279.256 -0.178 5 20 CBBD CO[C@@](C)(CO)CNC(=O)c1cc([N+](=O)[O-])cnc1N 848268158 XVGYFOGDRIHNKN-LLVKDONJSA-N 284.272 -0.301 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC(n2cncn2)C1 1117399418 MDVUHUYJHDUMES-UHFFFAOYSA-N 263.217 -0.394 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H]2CNCCCO2)c1[N+](=O)[O-] 1328333184 UFIUPAGHDBJZQS-SECBINFHSA-N 297.315 -0.255 5 20 CBBD O=[N+]([O-])c1ncn(Cc2cncc(-c3nn[nH]n3)c2)n1 1593487016 BZFUDHYPPBIXRN-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD CC(C)NC(=O)CNc1ncc([N+](=O)[O-])c(N)n1 58194269 ILEORBZZYXZRFO-UHFFFAOYSA-N 254.250 -0.097 5 20 CBBD CCCNC(=O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 122398251 DWGLKDGIMODMTC-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD Cn1ccc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)n1 213173277 MQQVBMFVDPOWGC-NSHDSACASA-N 280.288 -0.325 5 20 CBBD CN[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 261689395 IFJCSOHYHHCKTK-MRVPVSSYSA-N 268.277 -0.603 5 20 CBBD C[C@H](O)CCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266512026 BMQQXPAEODFRPC-GXSJLCMTSA-N 272.305 -0.145 5 20 CBBD C[C@H](O)C(=O)N1CCN(c2c([N+](=O)[O-])ncn2C)CC1 270817006 QXYVFOIMABDHPA-QMMMGPOBSA-N 283.288 -0.642 5 20 CBBD CCN1C[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 391568001 BYGOBVWWGMJEMN-GXSJLCMTSA-N 297.315 -0.637 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)CCN)c([N+](=O)[O-])n1 447255338 JIFFSMXITUFWJN-SSDOTTSWSA-N 291.333 -0.173 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 576597095 HUTKHMAOGNWKJH-ZCFIWIBFSA-N 295.255 -0.633 5 20 CBBD Nc1nccc(C(=O)NCCCn2cncn2)c1[N+](=O)[O-] 594250342 OJKGTTNSOCLXAP-UHFFFAOYSA-N 291.271 -0.016 5 20 CBBD COC(=O)c1ccnc(NCCn2ncnn2)c1[N+](=O)[O-] 598604341 LGLUEAOJVCXFJB-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD O=C1NC[C@@H]2CN(c3sccc3[N+](=O)[O-])CCN2C1=O 611290200 XRXNCXRJZNOIAX-SSDOTTSWSA-N 296.308 -0.197 5 20 CBBD NS(=O)(=O)CCCOC(=O)Cn1cc([N+](=O)[O-])cn1 744664332 ZMGCUXPMAIKQCI-UHFFFAOYSA-N 292.273 -0.987 5 20 CBBD CN1C(=O)CC[C@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 752041905 SMIQFRUGXMGDND-QMMMGPOBSA-N 282.256 -0.045 5 20 CBBD COC[C@@H](NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])C(N)=O 760076747 BJQQQRQQMOPSCS-ZCFIWIBFSA-N 299.287 -0.329 5 20 CBBD Cn1cnc([N+](=O)[O-])c1CNCCNC(=O)C1CC1 1122432263 QPSDFKDTIQNHHP-UHFFFAOYSA-N 267.289 -0.056 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CCC[C@@H](O)CC1 1324332003 NGGXJOOCRSQYEK-MRVPVSSYSA-N 269.261 -0.440 5 20 CBBD CO[C@@]1(C(=O)O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1599074636 JFOKYFSZLFHFNE-XSSZXYGBSA-N 258.230 -0.646 5 20 CBBD O=C1CN(C(=O)COc2cccnc2[N+](=O)[O-])CCN1 11644959 MLSITRMDDZSZNO-UHFFFAOYSA-N 280.240 -0.673 5 20 CBBD CNC(=O)CN1CCN(c2ncccc2[N+](=O)[O-])CC1 49238239 AOYARPYFRHYNIC-UHFFFAOYSA-N 279.300 -0.142 5 20 CBBD O=C(NCCCc1nc[nH]n1)c1cc([N+](=O)[O-])c[nH]c1=O 80570043 BZEXEMWNYVSKLF-UHFFFAOYSA-N 292.255 -0.236 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)c2c[nH]cn2)c1 152823428 YXNXPNGRJPQLSA-UHFFFAOYSA-N 286.273 -0.507 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)O1 268287389 CPSJPPHAKGIITE-VDTYLAMSSA-N 282.260 -0.588 5 20 CBBD C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@@H](O)C1 278940976 YDMLIWIKDNHGFH-ZHAHWJHGSA-N 295.295 -0.041 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])[nH]n2)C1=O 286278795 CGSKKDITLYVBAB-ZETCQYMHSA-N 267.245 -0.379 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 356940596 WNXXAVLAHAPCIQ-JTQLQIEISA-N 298.251 -0.046 5 20 CBBD COCCNC(=O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 362139369 DLYMAGWAQRYTIU-UHFFFAOYSA-N 298.255 -0.812 5 20 CBBD CNCCCNC(=O)Cn1cc([N+](=O)[O-])nc1C 428138740 CKWHJUKLMQBKCK-UHFFFAOYSA-N 255.278 -0.175 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@]1(CCO)CCOC1 447064666 ZOUWBVFHZXEFJO-LBPRGKRZSA-N 296.283 -0.157 5 20 CBBD CC(C)c1[nH]nc(C(=O)NC(CO)CO)c1[N+](=O)[O-] 581183734 ODKWGTOQWICMAB-UHFFFAOYSA-N 272.261 -0.476 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 600471143 ZOANRDDRLZPFPB-ZETCQYMHSA-N 297.267 -0.169 5 20 CBBD CO[C@]1(C(=O)O)CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 600869429 JWYKDVQVDKFJMD-LLVKDONJSA-N 298.255 -0.507 5 20 CBBD CCOC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 732501651 UVDDSGWNKZCQRL-UHFFFAOYSA-N 284.224 -0.137 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC(=O)[C@H]1CCOC1 762863501 BJWJWSWMWVDPQV-QMMMGPOBSA-N 283.240 -0.060 5 20 CBBD Cn1nnc(COC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)n1 799483213 LUEWAOXHEDFDCQ-UHFFFAOYSA-N 295.259 -0.207 5 20 CBBD CN1C[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1=O 825576128 XORNCICUUGBXGU-BXKDBHETSA-N 293.279 -0.025 5 20 CBBD NC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1 839476295 IAQUTPZLNNXQCE-BBBLOLIVSA-N 263.253 -0.006 5 20 CBBD Cn1c(C(=O)NN2CCOCC2)ccc1[N+](=O)[O-] 844263796 HZZWCVZIGNBPEK-UHFFFAOYSA-N 254.246 -0.090 5 20 CBBD Cc1nc(CN2CCN(CC[N+](=O)[O-])CC2)n[nH]1 930072420 CSNJTEVXMNIZMC-UHFFFAOYSA-N 254.294 -0.493 5 20 CBBD CN(C)C(=O)CCCNC(=O)c1c([N+](=O)[O-])cnn1C 1319645221 FZHUALGNLCKNER-UHFFFAOYSA-N 283.288 -0.074 5 20 CBBD CO[C@@]1(CNC(=O)c2c([N+](=O)[O-])cnn2C)CCOC1 1337981973 WOGKSTKMOOUUGU-LLVKDONJSA-N 284.272 -0.136 5 20 CBBD CN(C)C(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1339452714 GNCCHSAZVLLTRQ-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CON(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H](C)C(=O)O 1594036966 NLOMOSXACPJEAH-SSDOTTSWSA-N 299.239 -0.380 5 20 CBBD O=C(O)[C@@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1601856889 AAHSRKQYLSUANJ-QYNIQEEDSA-N 260.271 -0.320 5 20 CBBD O=C(C1CNC1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 91415176 NCJLIDONSAKFEA-UHFFFAOYSA-N 291.311 -0.142 5 20 CBBD COCCONC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 156083581 BCGRWWGMUUQMQG-SECBINFHSA-N 260.250 -0.680 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 230681693 FPJJZMJAQVFQKG-LURJTMIESA-N 281.272 -0.174 5 20 CBBD CC(C)S(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 290467752 CPTZZPUNKPVGPF-UHFFFAOYSA-N 290.301 -0.129 5 20 CBBD C[C@](CO)(NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)O 313508302 ZTWHCVKOSZNAOI-SECBINFHSA-N 257.202 -0.512 5 20 CBBD CC(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])n2C)C1 331538309 OBASAPMAQVSQCA-UHFFFAOYSA-N 266.257 -0.106 5 20 CBBD CCc1[nH]nc(C(=O)NCC(=O)N(C)C)c1[N+](=O)[O-] 344892116 VLXHYTUXHAGOIT-UHFFFAOYSA-N 269.261 -0.302 5 20 CBBD CN1CC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 348848136 JGOMNCNLFBNSBR-UHFFFAOYSA-N 253.218 -0.315 5 20 CBBD COC(=O)Cn1cc(CCn2cnc([N+](=O)[O-])c2)nn1 448101735 FNNHAKAOWYSIJE-UHFFFAOYSA-N 280.244 -0.202 5 20 CBBD CNC[C@@H](O)CNC[C@H](O)COc1ccccc1[N+](=O)[O-] 584172814 GZBLCZJEXNWCDC-MNOVXSKESA-N 299.327 -0.496 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1CCNCC1 702051185 SHXZBTMBVNRNRL-UHFFFAOYSA-N 253.262 -0.341 5 20 CBBD Cn1c(C(=O)OCc2nc(N)nc(N)n2)ccc1[N+](=O)[O-] 761062154 RRBLUQLAZUAEJJ-UHFFFAOYSA-N 293.243 -0.360 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@H](CN)C1 1326093292 QKICNAXLURRGKX-SSDOTTSWSA-N 269.261 -0.872 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCn3cnnc3C2)c1 1340794867 ITPJOCDXLWGWML-SNVBAGLBSA-N 293.287 -0.741 5 20 CBBD O=C(N[C@H]1CC[C@H]1C(=O)O)c1cc([N+](=O)[O-])n[nH]1 1601571806 UEGMAAPBGINURF-UHNVWZDZSA-N 254.202 -0.089 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H](C(=O)O)[C@@H](C)O)c1[N+](=O)[O-] 1607997114 ZIHHQSQZQTZEIL-RITPCOANSA-N 286.244 -0.799 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H]2CCOC2)c1 38094671 PVIODNXTGGEGMR-GXSJLCMTSA-N 270.289 -0.222 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)Cn1cc([N+](=O)[O-])cn1 42718913 YBLDVYRPOCCDGZ-UHFFFAOYSA-N 283.288 -0.272 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCNCC2)c1 88061322 NTSZBLUWDVUDFK-SNVBAGLBSA-N 255.278 -0.943 5 20 CBBD O=C1CN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCN1 101536099 PHFLYDZVGVMZCV-UHFFFAOYSA-N 292.251 -0.108 5 20 CBBD CN1CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 161989668 RQTIEBIWJCAAEV-UHFFFAOYSA-N 296.287 -0.725 5 20 CBBD CN1C[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 172489594 JYUQKJQMTKHUKF-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O 182043839 ITHFNDODLNLXRE-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD COC(=O)[C@H]1C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 185512742 QLKIDKLCHYQBHB-RKDXNWHRSA-N 284.272 -0.601 5 20 CBBD C[C@@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 192531469 IGWMGTGDZRIYAE-SSDOTTSWSA-N 257.250 -0.529 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1O 249602978 YWLVQTFFFGLTPC-ADEWGFFLSA-N 284.316 -0.145 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 261749685 HFJLUIORBSQOPV-MRVPVSSYSA-N 295.251 -0.310 5 20 CBBD O=Cc1ccc(OCC(=O)NCCO)c([N+](=O)[O-])c1 269275844 OVXCOEUHLCCRJR-UHFFFAOYSA-N 268.225 -0.105 5 20 CBBD CCOC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 299528500 QZUIAHUSMKQYLQ-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCCn2ncnn2)c1[N+](=O)[O-] 338961887 RPXSSWYGDAIGFM-UHFFFAOYSA-N 294.275 -0.142 5 20 CBBD CC[C@@H](C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339345260 FMVGCVHHZLNWDD-HTRCEHHLSA-N 285.260 -0.198 5 20 CBBD COC(=O)[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 343576420 GTYFAFUEWUXTSY-SSDOTTSWSA-N 283.244 -0.655 5 20 CBBD COC(=O)C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)OC 347640891 BFJQFJSBOPBNKL-QMMMGPOBSA-N 299.239 -0.243 5 20 CBBD CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)N1 436884959 BTCLOSMEFKFACM-QMMMGPOBSA-N 280.240 -0.625 5 20 CBBD Cn1nnc2c1CC[C@@H](Nc1ncc([N+](=O)[O-])c(N)n1)C2 594598306 HTCRVAWWUOVIHR-ZCFIWIBFSA-N 290.287 0.065 5 20 CBBD O=C(O)[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 595987765 XAJNUYLGABWECK-ZCFIWIBFSA-N 270.201 -0.757 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)CC(F)F 717733840 RCRSOFDKXSFGBM-LURJTMIESA-N 278.215 -0.076 5 20 CBBD COC[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(N)=O 760057830 BFKYEIIDHQLCOA-QMMMGPOBSA-N 299.287 -0.857 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCO[C@@H](C(=O)O)C2)n1 821297710 FVGICEYNIWQEBZ-SSDOTTSWSA-N 284.228 -0.746 5 20 CBBD CS(=O)(=O)N1CCC[C@@H]1CNCC[N+](=O)[O-] 905189354 RUQZMIQIWZFMGJ-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD O=C(NCCNc1ncccc1[N+](=O)[O-])c1cnn[nH]1 1094243627 WNFXYDAHFGOPJB-UHFFFAOYSA-N 277.244 -0.050 5 20 CBBD CC(C)(CCC(=O)N1C[C@H](O)C[C@H]1C(=O)O)[N+](=O)[O-] 1590656346 PSRUQHVPULSIAU-SFYZADRCSA-N 274.273 -0.132 5 20 CBBD CNC(=O)CCNc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591207902 JLJRMDZLBBBWHV-UHFFFAOYSA-N 292.259 -0.282 5 20 CBBD Nc1c(C(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-] 119902907 MDMKDRFQPUXPSX-UHFFFAOYSA-N 278.228 -0.482 5 20 CBBD CCNS(=O)(=O)CCNc1ncc([N+](=O)[O-])cn1 230873507 OZEWJAQQHTWWOW-UHFFFAOYSA-N 275.290 -0.264 5 20 CBBD O=[N+]([O-])c1ccc2nc(N3C[C@@H](O)[C@H](O)C3)nc(O)c2c1 343205859 MHSDCUIMSCLVOI-NXEZZACHSA-N 292.251 -0.215 5 20 CBBD CN(C)[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 358286165 HUFJMMWUXRJXRK-VIFPVBQESA-N 282.304 -0.357 5 20 CBBD C[C@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cnc1O 439318729 HIJAIAILOWETCU-RXMQYKEDSA-N 268.229 -0.311 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@@H](C)O 527195583 HXKGEBJWSFVVNW-HZGVNTEJSA-N 283.240 -0.358 5 20 CBBD CNc1nccc(C(=O)NC[C@@]2(O)CCOC2)c1[N+](=O)[O-] 553196873 INXRKMPGBSCDBS-LBPRGKRZSA-N 296.283 -0.087 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCC(=O)N1CCOCC1 557269569 YEPCTTAHFBRLMS-UHFFFAOYSA-N 296.283 -0.478 5 20 CBBD CC(C)(C(N)=O)C(=O)OCCn1ccc([N+](=O)[O-])n1 769667321 FYWMUPMOJJCJSG-UHFFFAOYSA-N 270.245 -0.154 5 20 CBBD C[C@@H](COC(=O)[C@@H]1CCCN(C(N)=O)C1)[N+](=O)[O-] 813105069 VEEPEJJVUGNOEV-JGVFFNPUSA-N 259.262 -0.015 5 20 CBBD CCN(CCNC(=O)CC(N)=O)c1ncccc1[N+](=O)[O-] 1100474861 NVUUMVKDFILWNR-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD NC(=O)CNC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCCC1 1115530717 NGQXGFFBDFOLEZ-NXEZZACHSA-N 298.343 -0.454 5 20 CBBD COc1c(C(=O)N2CC(O)(C(=O)O)C2)cccc1[N+](=O)[O-] 1599328006 BVGFGBJFQKLMEU-UHFFFAOYSA-N 296.235 -0.125 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CC[C@H]1C(=O)O 1601387034 SGNXPMCCVGOVPR-RQJHMYQMSA-N 268.229 -0.229 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CCF)C(=O)O 1608376595 BENLSJKWYOOQTQ-SSDOTTSWSA-N 274.208 -0.280 5 20 CBBD NS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1F 42267730 YTXRAVPVLWHSDJ-UHFFFAOYSA-N 291.260 -0.248 5 20 CBBD CN(C)C(=O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 44991891 HQMACJMNVWWSKR-SNVBAGLBSA-N 285.304 -0.780 5 20 CBBD O=C(NCc1csc(=O)[nH]1)c1cc([N+](=O)[O-])c[nH]c1=O 89507682 WJXXZLAYKHXSCH-UHFFFAOYSA-N 296.264 -0.037 5 20 CBBD CNS(=O)(=O)[C@@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 138331583 UOEAJSIUDGBEEI-SECBINFHSA-N 289.317 -0.628 5 20 CBBD NC(=O)c1ccnc(NCCN2CCOCC2)c1[N+](=O)[O-] 290511379 LTXXXDRDKDHIPO-UHFFFAOYSA-N 295.299 -0.167 5 20 CBBD COC(=O)[C@@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)OC 292403054 VBDZPKMRKAORDC-MRVPVSSYSA-N 298.255 -0.311 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@]1(O)CCOC1 332316715 MOMXRBONEYAXLE-NSHDSACASA-N 284.272 -0.551 5 20 CBBD COCCN(CCOC)C(=O)Cn1cnc([N+](=O)[O-])n1 342925307 VFKBEFKAHOOFFZ-UHFFFAOYSA-N 287.276 -0.692 5 20 CBBD CCOC(=O)c1ccnc(N[C@H](CO)C(N)=O)c1[N+](=O)[O-] 343247804 ARJPVGMHTRONPA-SSDOTTSWSA-N 298.255 -0.575 5 20 CBBD CC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 442562806 YELLKUDAXVBFQF-ZETCQYMHSA-N 255.230 -0.374 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCNS(C)(=O)=O 521717104 OSIVBEMUINYAAO-UHFFFAOYSA-N 290.301 -0.788 5 20 CBBD COC(=O)c1cnc(NCc2nn[nH]n2)c([N+](=O)[O-])c1 616371741 AZCRNYBPGASCDN-UHFFFAOYSA-N 279.216 -0.098 5 20 CBBD CN(CC(=O)O)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 737401913 YAQDGLKVCHOBCV-UHFFFAOYSA-N 295.251 -0.132 5 20 CBBD COCCCONC[C@H](O)Cn1cc([N+](=O)[O-])cn1 819311369 MZWBAFAXZOUOPS-JTQLQIEISA-N 274.277 -0.290 5 20 CBBD CC(=O)N[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 979739467 QLTXULDKNIOGLV-ZYUZMQFOSA-N 255.274 -0.318 5 20 CBBD COCC(=O)NCC1(Nc2ncc([N+](=O)[O-])c(N)n2)CC1 1110039076 YOPWYDPGQATPCD-UHFFFAOYSA-N 296.287 -0.326 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)NC[C@H]2C1 1324604361 HXMFLJGHWJFFKE-LURJTMIESA-N 280.244 -0.833 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCC1(CO)COC1 1341979626 JZVYAOBDUVLZCJ-UHFFFAOYSA-N 281.268 -0.084 5 20 CBBD O=C(NC[C@H]1C[C@H](NCc2cnn[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1578012923 DBTMEWWBCOYKCM-YJFSRANCSA-N 294.315 -0.546 5 20 CBBD O=C(O)CCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1606201610 VLWRGLLAIVPEKC-MRVPVSSYSA-N 258.234 -0.784 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H](O)C[C@H]1C(=O)O 1607985482 VRKZALSKZSMRLA-SCZZXKLOSA-N 295.251 -0.042 5 20 CBBD COc1ccc(C(=O)N[C@H](CO)C(=O)O)cc1[N+](=O)[O-] 19266901 WYSHPVKZNYPMQQ-SSDOTTSWSA-N 284.224 -0.221 5 20 CBBD O=C(NCCCN1CCOCC1)c1cc([N+](=O)[O-])n[nH]1 140255004 ULTIUHDNDACPNJ-UHFFFAOYSA-N 283.288 -0.230 5 20 CBBD NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 267317204 NVBRCVJPPHGYAD-BDAKNGLRSA-N 295.299 -0.048 5 20 CBBD C[C@H](CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CN(C)C 312446284 CPBKCHOSOFNBEQ-ZYHUDNBSSA-N 285.348 -0.061 5 20 CBBD NC(=O)NC(=O)CCn1cc([N+](=O)[O-])cc(Cl)c1=O 346642807 IZZWJFHFDZIJOZ-UHFFFAOYSA-N 288.647 -0.005 5 20 CBBD CNC(=O)NC(=O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O 346653487 IVAWZSLWPUFWSJ-UHFFFAOYSA-N 288.647 -0.135 5 20 CBBD CCn1cc(S(=O)(=O)NC(C)(C)CN)c([N+](=O)[O-])n1 353219338 RZHWXMLVICOMBO-UHFFFAOYSA-N 291.333 -0.173 5 20 CBBD COC(=O)[C@@](C)(O)CNc1ncc([N+](=O)[O-])cn1 361668029 UFPIMOXRSMFUQL-VIFPVBQESA-N 256.218 -0.279 5 20 CBBD CCCc1[nH]nc(C(=O)NCc2nnn(C)n2)c1[N+](=O)[O-] 428830393 QVMHAQANRYADDT-UHFFFAOYSA-N 294.275 -0.276 5 20 CBBD CC(C)(C(=O)NCCOCC(N)=O)n1cc([N+](=O)[O-])cn1 443803804 QKJGIDSOEBHACK-UHFFFAOYSA-N 299.287 -0.856 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[C@H](c2nn[nH]n2)C1 538225811 XIATVRHFJUCARL-LURJTMIESA-N 292.259 -0.149 5 20 CBBD COC[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])OC 549189813 ATBGYYUERRFTOP-ZCFIWIBFSA-N 258.234 -0.291 5 20 CBBD Nc1nccc(C(=O)NC[C@@H]2COCCO2)c1[N+](=O)[O-] 567121711 NDUMJFFTJJFGPD-SSDOTTSWSA-N 282.256 -0.283 5 20 CBBD NC(=O)c1ccc(CNC(CO)CO)c([N+](=O)[O-])c1 570407793 LPNVTQWTJFTHBC-UHFFFAOYSA-N 269.257 -0.864 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC2(C1)OCCO2 788302278 YHQNNUHJEYYATL-UHFFFAOYSA-N 268.229 -0.093 5 20 CBBD NC(=O)CONC(=O)c1cc(O)ccc1[N+](=O)[O-] 791390838 FPKDUIRNAWZQFO-UHFFFAOYSA-N 255.186 -0.553 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NOC/C=C\Cl 794304989 KHPWTXZZGWBXNU-UPHRSURJSA-N 261.625 -0.013 5 20 CBBD CC(=O)NCCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 819810759 PFJYPQKQUATVRN-UHFFFAOYSA-N 292.259 -0.282 5 20 CBBD CN(C)C(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839523233 IILKWSNFVVUKRI-RKDXNWHRSA-N 270.289 -0.523 5 20 CBBD O=C(OCCCN1CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 840670245 DRAXYNCEDWMROM-NXEZZACHSA-N 258.274 -0.083 5 20 CBBD NC(=O)c1ccnc(NC[C@@H]2COCO2)c1[N+](=O)[O-] 853686819 FVEQEVZGSMRGDE-ZCFIWIBFSA-N 268.229 -0.127 5 20 CBBD CCn1cc(S(=O)(=O)N(C)C[C@@H](C)N)c([N+](=O)[O-])n1 858643065 UGQXPVQYEUWIDF-SSDOTTSWSA-N 291.333 -0.221 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(C(=O)C3CC3)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] 976479666 AFVKISIKHXLLFC-NZFPMDFQSA-N 279.296 -0.365 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@H]1CCNC1=O 1256589008 XKYICGGYQCFSRM-QMMMGPOBSA-N 295.299 -0.013 5 20 CBBD CC(C)CN1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1=O 1262864160 ADPVBTCCRPMILO-UHFFFAOYSA-N 296.331 -0.104 5 20 CBBD CCOCC[C@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1321991319 MKKJUAMNJXCXPN-VIFPVBQESA-N 299.283 -0.357 5 20 CBBD Cc1noc(CN[C@@]2(C(N)=O)CCOC2)c1[N+](=O)[O-] 1347128289 BRIOFEVTFWMTGR-JTQLQIEISA-N 270.245 -0.375 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCOCCCN 1579868686 IGMCGILHHLVZJY-UHFFFAOYSA-N 285.304 -0.419 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2CC[C@@H](O)[C@@H](O)C2)n1 1600104856 IXLXNUAICDDFOM-BDAKNGLRSA-N 297.267 -0.072 5 20 CBBD CC1(C(=O)O)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1604502006 JJLMBXHYLXASEF-UHFFFAOYSA-N 295.251 -0.310 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC(N)=O 8143659 VQQHFXDHMIUDOT-UHFFFAOYSA-N 266.257 -0.124 5 20 CBBD COC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 35220905 HQPUQQJMVMISHB-UHFFFAOYSA-N 256.218 -0.577 5 20 CBBD C[C@@H](CCCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 94943783 BGOOTWCJJHRNEH-ONGXEEELSA-N 272.305 -0.097 5 20 CBBD CN(C)c1n[nH]c(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 340966015 BMCMTNNGUZORBY-UHFFFAOYSA-N 281.236 -0.991 5 20 CBBD Cn1nnnc1Cn1cnc2cc([N+](=O)[O-])ccc2c1=O 356896482 VXIZXVSVEKBGTI-UHFFFAOYSA-N 287.239 -0.124 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1O)[C@H]1COC[C@H]1O 359659109 SKUIOHZIIKDOEU-DTWKUNHWSA-N 283.240 -0.473 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 362355464 XHFLFYAGUWSIPX-LURJTMIESA-N 255.234 -0.829 5 20 CBBD COCCN(C)C[C@H](O)Cn1cnc([N+](=O)[O-])c1 385886666 CQAROWDRSNTAAA-VIFPVBQESA-N 258.278 -0.270 5 20 CBBD Cc1[nH]nc(C(=O)N(C)Cc2nnc(O)o2)c1[N+](=O)[O-] 588848828 CTKYTMMZGDCVLH-UHFFFAOYSA-N 282.216 -0.013 5 20 CBBD O=C(NCC[C@]1(O)CCCOC1)c1c[nH]nc1[N+](=O)[O-] 593880014 LZYMLZAEJATJCY-LLVKDONJSA-N 284.272 -0.021 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCOC[C@H]1CO 595715422 HHCSNVRSXZUFMJ-LLVKDONJSA-N 283.284 -0.550 5 20 CBBD Cn1nncc1CNC(=O)CCn1cc([N+](=O)[O-])cn1 1117523978 RDZOCAVJDCWOSB-UHFFFAOYSA-N 279.260 -0.374 5 20 CBBD O=[N+]([O-])c1cnn(CCNc2ccc3nnnn3n2)c1 1322689904 XGXVUQKONXSFKT-UHFFFAOYSA-N 275.232 -0.264 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1339894225 NJGBSXDXZHWCEA-SVRRBLITSA-N 281.272 -0.417 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CCC[C@@H](C(N)=O)C1 1345888577 WJBXQKCWRWTVLG-SECBINFHSA-N 296.331 -0.274 5 20 CBBD NC(=O)NCCNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1592731389 AFZMGXDBHDAAPQ-UHFFFAOYSA-N 292.259 -0.145 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2CC[C@](O)(C(=O)O)C2)n1C 1777526258 GDVPSMISDADJNK-SNVBAGLBSA-N 270.245 -0.337 5 20 CBBD COC(=O)[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CCO1 112671317 YYNSKIKNMXPDIE-ZETCQYMHSA-N 270.245 -0.294 5 20 CBBD C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(N)=O 192901520 FGWOVXHJTXNQLR-ZCFIWIBFSA-N 273.270 -0.253 5 20 CBBD Nc1nc(NCCc2nnc[nH]2)ncc1[N+](=O)[O-] 268640200 RCOLBQKVZZPDRC-UHFFFAOYSA-N 250.222 -0.260 5 20 CBBD COC[C@H](CCO)NC(=O)CCn1cc([N+](=O)[O-])cn1 269105498 ARUCAHDZWZXRAW-VIFPVBQESA-N 286.288 -0.305 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCCOCCO 272440884 RATRXSLUEJFEAO-UHFFFAOYSA-N 284.272 -0.100 5 20 CBBD CCOC(=O)c1ccnc(N2C[C@@H](O)[C@H](O)C2)c1[N+](=O)[O-] 277552352 XUJGWQXORJTXHH-RKDXNWHRSA-N 297.267 -0.292 5 20 CBBD O=C(O)c1cnc(N2C[C@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1 316877502 POADTLJEYNEZND-APPZFPTMSA-N 283.240 -0.523 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H](O)CC2)c1 339782177 WXKGXNOSZBQAGF-RYUDHWBXSA-N 284.316 -0.001 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H](CO)[C@@H]2CCCO2)c1[N+](=O)[O-] 344922546 PGKBTSYTKMGWKK-YUMQZZPRSA-N 284.272 -0.104 5 20 CBBD COC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])nn1C 359515210 RTZYPYSWFASRFZ-UHFFFAOYSA-N 256.218 -0.427 5 20 CBBD Cc1nn(C)c(N2C[C@@H](C(=O)O)C[C@@H](O)C2)c1[N+](=O)[O-] 401777514 FIRLXTGQGOJMQX-JGVFFNPUSA-N 284.272 -0.091 5 20 CBBD COC[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(=O)OC 445133809 IXFAOUDCPABEOC-SSDOTTSWSA-N 299.239 -0.387 5 20 CBBD Cc1cc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n(C)n1 583560377 INJBNQPMJKPDBQ-GFCCVEGCSA-N 294.315 -0.016 5 20 CBBD NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O 600241638 MIVZEIKSQXGCHD-APPZFPTMSA-N 295.251 -0.639 5 20 CBBD C[C@H]1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C[C@@H]1O 825000316 OLGHSYYWSQEUNN-XPUUQOCRSA-N 291.271 -0.013 5 20 CBBD Cc1ccnc(NCCNC(=O)CNC(N)=O)c1[N+](=O)[O-] 1093500841 NZOWMLKNGRHKSJ-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD NC(=O)[C@]1(NCCn2cc([N+](=O)[O-])cn2)CCOC1 1118306761 PAAAHLLFBALXRV-JTQLQIEISA-N 269.261 -0.975 5 20 CBBD CCS(=O)(=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319646870 RHQDNENDMDCUCI-UHFFFAOYSA-N 290.301 -0.507 5 20 CBBD CN(CC(=O)O)C(=O)c1ccnc(N)c1[N+](=O)[O-] 1593720900 ZKEQXVMUOFZZCQ-UHFFFAOYSA-N 254.202 -0.271 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1601759027 WZLIJCWYNPNLBO-XPUUQOCRSA-N 284.228 -0.632 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC(=O)NC1CC1 65719731 SSYQLALCDGCVBA-UHFFFAOYSA-N 295.299 -0.163 5 20 CBBD CN(CCN1CCNCC1)C(=O)c1ccc([N+](=O)[O-])n1C 71149486 UFSPSZSTQZAWOP-UHFFFAOYSA-N 295.343 -0.090 5 20 CBBD N[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 158452336 UKSRJZLZFIADKW-SECBINFHSA-N 280.284 -0.294 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(=O)O 167373157 SWHDZKAPQLFTJP-ZETCQYMHSA-N 271.229 -0.237 5 20 CBBD COC[C@H](CO)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1 234814549 KCTJIDKQVMSSLD-QMMMGPOBSA-N 290.297 -0.120 5 20 CBBD Nc1nc(NCCn2cncn2)ncc1[N+](=O)[O-] 263931165 ADGGPBUCUQKDOA-UHFFFAOYSA-N 250.222 -0.329 5 20 CBBD C[C@@H](O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@H](C)C1 275381096 PDPGNIWGUVTANI-RKDXNWHRSA-N 296.331 -0.142 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@H](C)O 276027620 TYAJYEZVEONCMM-QUBYGPBYSA-N 298.251 -0.047 5 20 CBBD C[C@@H]1COCCN1CCNC(=O)c1c([N+](=O)[O-])cnn1C 330585924 XDZVLTIBVCDBEK-SECBINFHSA-N 297.315 -0.221 5 20 CBBD CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 330861178 PSKXKMJMKHDAHX-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1COCCO1 331134832 CHWUFFSINUORCJ-VIFPVBQESA-N 270.245 -0.677 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1COC[C@@H]1O 342411297 BUZXQWJJYRYMCO-UWVGGRQHSA-N 298.299 -0.292 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)c1nn[nH]n1 359800864 QRKNDJIWHMNOTR-UHFFFAOYSA-N 294.275 -0.336 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1OC 362784164 AHBLUEXOZYMHMJ-UWVGGRQHSA-N 298.299 -0.028 5 20 CBBD Nc1nc(SCCCS(N)(=O)=O)ncc1[N+](=O)[O-] 574705390 ZBYOJDPBYCKRQO-UHFFFAOYSA-N 293.330 -0.262 5 20 CBBD Cc1cc(C(=O)NCC(=O)NCCN)ccc1[N+](=O)[O-] 581010800 ZKTSCLRYYKMODC-UHFFFAOYSA-N 280.284 -0.292 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(c2c([N+](=O)[O-])c(C)nn2C)C1 592003996 JPAHNHZCMUKIIG-RKDXNWHRSA-N 298.299 -0.003 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1C[C@@H]2COC[C@]2(C(=O)O)C1 595280779 IAWDUVUDZOCLSM-KSBSHMNSSA-N 296.239 -0.509 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC(=O)N(C)CC1 598293590 FOZVTDXAEDAAHG-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD COC[C@@](C)(CC(=O)OC)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840380188 SYIKCAGSFFAJDP-SOCHQFKDSA-N 274.273 -0.264 5 20 CBBD COC1(CO)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 848309203 MOYJJQCSIYEFJU-RKDXNWHRSA-N 258.274 -0.349 5 20 CBBD COC(=O)N(C)CCNC(=O)c1c([N+](=O)[O-])cnn1C 855942808 ZXKZIROSKLELOP-UHFFFAOYSA-N 285.260 -0.244 5 20 CBBD CCN(CC)C(=O)[C@@H](C)OC(=O)Cn1cnc([N+](=O)[O-])n1 919521192 NONOJAOPYGTYOZ-MRVPVSSYSA-N 299.287 -0.014 5 20 CBBD Cn1ccc(C(=O)N2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 991291560 VSGXSIDXIRZYCN-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD CCn1ccc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030293026 DJGSLRSPMQAVLL-VXGBXAGGSA-N 293.327 -0.131 5 20 CBBD O=C(NCC1[C@H]2CNC[C@H]12)c1cc([N+](=O)[O-])cnc1O 1580641883 LQNMOTYFIZXNJP-IUCAKERBSA-N 278.268 -0.109 5 20 CBBD CCc1[nH]nc(C(=O)N[C@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1597399687 KUKXACURYRXBPF-LLVKDONJSA-N 298.255 -0.146 5 20 CBBD Cc1ccc(C(=O)N(CC(N)=O)CC(N)=O)cc1[N+](=O)[O-] 68340490 JVPFBGNVEWOKAQ-UHFFFAOYSA-N 294.267 -0.684 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC(O)(C2CC2)C1 89663970 ZIEKMVSKIJEYMY-UHFFFAOYSA-N 266.257 -0.225 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1 217694964 PCQLSRFNTLPQKK-VIFPVBQESA-N 268.225 -0.142 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](C(=O)O)C1CC1 262139338 LSARGBRNOJIFOY-NSHDSACASA-N 295.251 -0.264 5 20 CBBD COCCN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 263964915 RCUIFRZOYSNLGJ-UHFFFAOYSA-N 282.304 -0.265 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCN[C@H](C(N)=O)C1 271616630 VYRFGNOCJRVGFU-VIFPVBQESA-N 265.273 -0.438 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NN1CCCNC1=O 272604166 QDBSLAVEXGNTCF-UHFFFAOYSA-N 282.260 -0.372 5 20 CBBD CC(C)[C@@](C)(NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 288103618 XAUPXIPKGIERAT-LLVKDONJSA-N 283.288 -0.193 5 20 CBBD NC(=O)[C@@H](O)CNc1nc2ccccc2cc1[N+](=O)[O-] 339971332 QKZVVLOEZUKDSQ-JTQLQIEISA-N 276.252 0.401 5 20 CBBD CC[C@@H]1CN(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)CCO1 362684186 OFQPEHGVOLAAHF-SECBINFHSA-N 296.331 -0.088 5 20 CBBD CN1CCNC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N 449701491 SPQWUHZJVIFOJP-SECBINFHSA-N 293.327 -0.190 5 20 CBBD COC(=O)CN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-] 548082448 ARRIEUMPNRGQSG-UHFFFAOYSA-N 268.229 -0.183 5 20 CBBD C[C@@H](O)[C@H]1CCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 598237053 SVBGUOHFRVQMIP-HTQZYQBOSA-N 269.261 -0.442 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1O 600458543 MSXPEKNXGDTGRZ-ZETCQYMHSA-N 298.251 -0.046 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CCCNC1=O 619867889 LMUGMZVPDJZKKV-VIFPVBQESA-N 295.299 -0.258 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2C[C@]2(CO)C1 783789985 VXUBNKDUDVTHRD-GZMMTYOYSA-N 266.257 -0.368 5 20 CBBD C[C@]1(NC(=O)Cn2ccc([N+](=O)[O-])n2)CCOC1=O 813293692 PVFXDHKLLFRGOF-JTQLQIEISA-N 268.229 -0.387 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cnco2)C1 954242874 ZINAUCDNAAOFAY-RKDXNWHRSA-N 294.267 -0.377 5 20 CBBD Cc1nonc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030292549 ODXWZPOUGBRPIK-PSASIEDQSA-N 281.272 -0.656 5 20 CBBD O=[N+]([O-])c1ccn(Cc2nc(Cn3cncn3)no2)n1 1320223112 UIHPCGFRWZPOFI-UHFFFAOYSA-N 276.216 -0.138 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 1320948934 MSBANACYEPMXRT-LURJTMIESA-N 288.285 -0.423 5 20 CBBD CCS(=O)(=O)CC(=O)Nc1c([N+](=O)[O-])cnn1C 1324084777 BQUPODFVKLYYOY-UHFFFAOYSA-N 276.274 -0.299 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H](C)CN)c1[N+](=O)[O-] 1328236793 SWEVQEZGAQOEGR-LURJTMIESA-N 255.278 -0.039 5 20 CBBD O=C(N[C@@H](CC1OCCO1)C(=O)O)c1cc([N+](=O)[O-])c[nH]1 1601414191 MURAMHXAMWQYKQ-QMMMGPOBSA-N 299.239 -0.131 5 20 CBBD CCNC(=O)C1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 121267374 IGBLHTSKPKEGOG-UHFFFAOYSA-N 281.272 -0.614 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNCC1 237575066 ODCOESJEWWPFSL-UHFFFAOYSA-N 253.262 -0.468 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](CO)O1 249386614 RFKFYFQKOKKIBQ-PWSUYJOCSA-N 297.311 -0.162 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1C[C@H](O)[C@@H](O)C1 277567511 QDMGITMAUORKGW-UWVGGRQHSA-N 295.251 -0.903 5 20 CBBD CC1(C)CNC(=O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 282577484 FVIZQCSYCOBVJX-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD C[C@@H](CO)N1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1 355160571 FXADWVZKVXORBR-VIFPVBQESA-N 297.315 -0.153 5 20 CBBD CN1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](CN)C1 569972494 ZBWAYPBCRSQEKJ-VIFPVBQESA-N 293.327 -0.108 5 20 CBBD CNc1nccc(C(=O)NC[C@H]2COCCO2)c1[N+](=O)[O-] 580447449 IIICVZAJWRWMCO-QMMMGPOBSA-N 296.283 0.177 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@H]2CNCCO2)c1[N+](=O)[O-] 580714351 SNEYTWKSWHUOSH-MRVPVSSYSA-N 297.315 -0.011 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1[C@@H]2CO[C@H]3[C@@H]2OC[C@H]31 611142813 LFXYFGOXXDLNLJ-GAJNKVMBSA-N 294.267 -0.523 5 20 CBBD CC[C@H](OC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 766973821 UJWNIGSTJQNKGH-LURJTMIESA-N 256.218 -0.251 5 20 CBBD O=C([C@H]1CCCO1)N1CCN(CC[N+](=O)[O-])CC1 791054391 UKUBXLFYVPQMRE-SNVBAGLBSA-N 257.290 -0.414 5 20 CBBD O=C(O)[C@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 821510494 HRRBONFGJCHTFW-QMMMGPOBSA-N 295.251 -0.310 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCSC[C@H]1CCO 840402781 NHXPIPQNKIUKHU-IWSPIJDZSA-N 260.315 -0.022 5 20 CBBD C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C(N)=O)C1 840425524 AOBOFLQREYNIGG-BGZDPUMWSA-N 255.274 -0.236 5 20 CBBD CC(C)(COC(=O)[C@@H]1CCS(=O)(=O)N1)[N+](=O)[O-] 851129600 KVKCUEPBRQXBED-LURJTMIESA-N 266.275 -0.723 5 20 CBBD COC(=O)[C@H]1C[C@@H](OC)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 857330644 LAMFZQMDXKCTCC-SGIHWFKDSA-N 286.284 -0.169 5 20 CBBD O=C(NCC1(O)CN(C(=O)CC2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1042976082 XDFQOUDAEOMDEY-NXEZZACHSA-N 297.311 -0.859 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CC(N)=O)c1[N+](=O)[O-] 1115894225 AHXDTNFSWKSLNL-UHFFFAOYSA-N 255.234 -0.806 5 20 CBBD CNC(=O)OCCOC(=O)Cn1cnc([N+](=O)[O-])n1 1122963615 HZNFWKVDWFNNTO-UHFFFAOYSA-N 273.205 -0.915 5 20 CBBD Cn1cnnc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157760704 HQIXLQXNJGHCMM-RKDXNWHRSA-N 282.304 -0.924 5 20 CBBD CCn1c(C[N+](=O)[O-])nnc1N(C)C[C@H]1COCCO1 1263020538 WFXLUCATSZPOEN-VIFPVBQESA-N 285.304 -0.074 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2C=C[C@H](CO)C2)c1 1326201585 XGGWOCFDCKYBIR-HOSYDEDBSA-N 282.300 -0.321 5 20 CBBD CCn1cnnc1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1336414193 NCDOZVLUWAVVPX-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD NCCC(=O)NC[C@H]1CCCCN1CC[N+](=O)[O-] 1580281554 DVDZUMOBLXLTHC-SNVBAGLBSA-N 258.322 -0.417 5 20 CBBD O=C(O)CCN1CC[C@@H](OC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 1608724372 MFLJJBDEFSBNKX-BWZBUEFSSA-N 286.240 -0.730 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)[C@@H]2CCOC2)c1 269153396 TWXDSHWMFHIPAB-SECBINFHSA-N 290.301 -0.500 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H](O)C(F)F 360755354 PGOITOKUXQMNCP-RXMQYKEDSA-N 264.188 -0.316 5 20 CBBD C[C@H](O)CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H](C)CO 571742810 JLKZWECWWYKCJA-BQBZGAKWSA-N 272.261 -0.478 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2[C@@H]3CNC[C@@H]32)nc1 595112124 SSZRLLZWPWGPDJ-MBTKJCJQSA-N 284.297 -0.514 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCOCCN1 597708130 WMXKRWURBWIMJZ-UHFFFAOYSA-N 282.256 -0.880 5 20 CBBD COC(=O)[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)C1 598520061 LFRXPYIXCXVSOB-LJGSYFOKSA-N 283.244 -0.746 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](O)[C@@H](O)C2)c1 600217410 XYPQERJJBUMCMY-QWRGUYRKSA-N 282.252 -0.219 5 20 CBBD CNc1c(C(=O)OCC(=O)NC(N)=O)cccc1[N+](=O)[O-] 765510904 CCISUDCNWUGIKG-UHFFFAOYSA-N 296.239 -0.012 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1c([N+](=O)[O-])ncn1C 782390437 BUDITNOJKZSJGM-SSDOTTSWSA-N 253.262 -0.005 5 20 CBBD Cc1nc(C)n(C2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 820058768 MZTOKHANYJOURG-NXEZZACHSA-N 265.273 -0.057 5 20 CBBD COC[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C 886873076 IGPNHLXFBDRHGK-SNVBAGLBSA-N 298.299 -0.026 5 20 CBBD CCNC(=O)COC(=O)c1c([N+](=O)[O-])c(C)nn1C 920661647 WOQSQLCWTRYZHP-UHFFFAOYSA-N 270.245 -0.070 5 20 CBBD NC(=O)C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 1022633579 MOQJQWRBDNTGQM-AOOOYVTPSA-N 292.295 -0.183 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@@H](NC(=O)C(N)=O)C2)n1 1059803976 OASWZZJVNAPXBU-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](C)CS(C)(=O)=O)c1[N+](=O)[O-] 1116059550 COUOVHJTUFVGEY-RXMQYKEDSA-N 290.301 -0.211 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@]2(O)CCOC2)c1[N+](=O)[O-] 1116910485 HVQWCGSPGUXCBT-SNVBAGLBSA-N 270.245 -0.492 5 20 CBBD Cn1cc(C(=O)Nc2c([N+](=O)[O-])cnn2C)nn1 1117507479 MLXLUYAULIPJGU-UHFFFAOYSA-N 251.206 -0.291 5 20 CBBD Cc1nnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1 1126931885 DEJHLNJCNRINJH-HTQZYQBOSA-N 285.329 -0.282 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC1[C@@H]2CNC[C@@H]12 1579877226 DUPPLSOVMDBQPV-RKDXNWHRSA-N 279.300 -0.319 5 20 CBBD CCN(C)C(=O)Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1596182583 GHJVBEBHYOBWOO-UHFFFAOYSA-N 283.240 -0.067 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCCN1CCNCC1 35307422 MVNMGZVIVBJJAY-UHFFFAOYSA-N 295.343 -0.042 5 20 CBBD O=C1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CN1 104088018 NRGSSWAGHIKDLB-LURJTMIESA-N 252.230 -0.069 5 20 CBBD COc1c(C(=O)NOCC(N)=O)cccc1[N+](=O)[O-] 137572612 NYSQOAGLPGMNPS-UHFFFAOYSA-N 269.213 -0.250 5 20 CBBD CCS(=O)(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 170809983 DEWNYXKLGHONCK-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 231621750 SWVGPIWJDIXSAA-QMMMGPOBSA-N 285.256 -0.177 5 20 CBBD O=C1CN(CCNC(=O)c2ccc([N+](=O)[O-])cc2)CCN1 272716530 WODYQIYMURXFBX-UHFFFAOYSA-N 292.295 -0.244 5 20 CBBD O=C(NC(CO)CO)c1ccc(O)c([N+](=O)[O-])c1 273353343 UJMXFLQENXNTGV-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD CCN(CCO)CCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 274583955 SXSGUYXWJVRBPU-UHFFFAOYSA-N 285.304 -0.330 5 20 CBBD CC(C)CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])[nH]n1 284982445 ABGBCMRJJPJVLT-UHFFFAOYSA-N 269.261 -0.099 5 20 CBBD Nc1nc(=NCCc2cnccn2)[nH]cc1[N+](=O)[O-] 340989189 ZVTQGVPCLADGHM-UHFFFAOYSA-N 261.245 -0.167 5 20 CBBD CN(C(=O)CN(CCN)CCO)c1ccc([N+](=O)[O-])cc1 342380162 BUEXDMLJRHTCOX-UHFFFAOYSA-N 296.327 -0.189 5 20 CBBD CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1COC[C@H]1O 343616903 AUJQWGDKYJKUBR-WDEREUQCSA-N 281.268 -0.110 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](C)O[C@@H](CO)C2)c1[N+](=O)[O-] 347508356 AWHOIOOKXPLYIY-POYBYMJQSA-N 284.272 -0.152 5 20 CBBD C[C@H]1C[C@@H](O)CN1C(=O)NCCn1cc([N+](=O)[O-])cn1 349594851 BFVJEMJOYAOELT-WCBMZHEXSA-N 283.288 -0.044 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1O 351864019 RFHKXSJYCVAQSR-VXNVDRBHSA-N 254.246 -0.370 5 20 CBBD COC(=O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 352129163 NVSDPUNIYSPDCM-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD CCOC[C@@H](O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 433369208 ZYNDTCDNVVNWDA-VIFPVBQESA-N 286.288 -0.387 5 20 CBBD COCCOCC(=O)NCCn1cc([N+](=O)[O-])cn1 493182252 POPHQTJWMQDBIR-UHFFFAOYSA-N 272.261 -0.430 5 20 CBBD O=C(CCN1CCOCC1)NCCn1cc([N+](=O)[O-])cn1 769382454 PHDFAJVWIPSJFK-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD CCOC(=O)C[C@@H](O)COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 859720828 WHOHUWWBLCPRAR-BWZBUEFSSA-N 261.230 -0.491 5 20 CBBD Nc1nc(NCCNC(=O)c2cnon2)ncc1[N+](=O)[O-] 1093798530 SORABJSULFCILK-UHFFFAOYSA-N 294.231 -0.808 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](CO)[C@H](O)C1 1116789017 VOKOFTISOSADOI-VXNVDRBHSA-N 284.272 -0.856 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@H](O)C1 1323227211 VYVOBCAETKKNKY-ZETCQYMHSA-N 254.246 -0.075 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1[C@H]2CNC[C@H]12 1580579108 XFRRLGJBMJLXCP-YUMQZZPRSA-N 265.273 -0.627 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CF)C(=O)O 1608159388 QKEHSKHZWMRQDC-BYPYZUCNSA-N 260.181 -0.519 5 20 CBBD NC(=O)CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 54377068 ADSWHNMTEFMWFL-UHFFFAOYSA-N 281.272 -0.834 5 20 CBBD CNC(=O)CN(C)CCn1cc([N+](=O)[O-])ccc1=O 90517058 MYJQWDQBZZMEIM-UHFFFAOYSA-N 268.273 -0.566 5 20 CBBD CCNC(=O)NC(=O)Cn1cc([N+](=O)[O-])c(C)cc1=O 128496214 MASDNEXYWNLZMT-UHFFFAOYSA-N 282.256 -0.089 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](CO)O1 191870307 GRCBINWFKFDXNU-BQBZGAKWSA-N 270.245 -0.460 5 20 CBBD CCN1CCN(CCn2ccc([N+](=O)[O-])n2)CC1=O 273574081 YOHUXVJKZDEGBV-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD NC(=O)CNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 337944621 ZRLPSFYFWOPUPJ-UHFFFAOYSA-N 294.223 -0.896 5 20 CBBD O=C(NCCn1ncnn1)c1cc([N+](=O)[O-])cnc1O 338962052 NUCFATKXUQWJSR-UHFFFAOYSA-N 279.216 -0.888 5 20 CBBD CN(C[C@@H](O)CO)C(=O)c1c(N)cccc1[N+](=O)[O-] 353942124 QKCHGJYSGUEOMB-SSDOTTSWSA-N 269.257 -0.398 5 20 CBBD CNc1nccc(C(=O)NC[C@](C)(O)COC)c1[N+](=O)[O-] 582496888 OVZUPWKTRWVGCU-LBPRGKRZSA-N 298.299 0.159 5 20 CBBD CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1=O 583944511 OOZLFXKLRSQTFQ-UHFFFAOYSA-N 293.239 -0.987 5 20 CBBD O=C(Nc1nnc2nc[nH]n12)c1ccc([N+](=O)[O-])o1 590551954 ABSGLIGWLBFLHY-UHFFFAOYSA-N 263.173 0.206 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 592308399 LIUIEOGZDDNTNE-POYBYMJQSA-N 269.261 -0.494 5 20 CBBD O=[N+]([O-])c1c(N2CCN(CCO)CC2)ccnc1O 596056144 RYIGNULIBJIHDC-UHFFFAOYSA-N 268.273 -0.190 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC1CCNCC1 702034998 HHGLWMRHSKCRBC-UHFFFAOYSA-N 253.262 -0.341 5 20 CBBD CC[C@@H]1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C[C@H]1O 1324550294 LSIKHEUEEZANOO-BXKDBHETSA-N 295.295 -0.014 5 20 CBBD CN1CCN(CCn2cc([N+](=O)[O-])cn2)[C@H](CO)C1 1333037355 DVUPXRHSSSKBAG-NSHDSACASA-N 269.305 -0.600 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@](F)(CO)C1 1340086260 JPKTUMKYYAWEBH-SECBINFHSA-N 258.209 -0.136 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1341460187 MSICMEDGYPTFOS-NSHDSACASA-N 285.304 -0.629 5 20 CBBD CC(=O)N1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 28268059 WWQGCVLBUMGGMU-UHFFFAOYSA-N 281.272 -0.518 5 20 CBBD CN(CC(N)=O)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 51826260 ORTRCLIYYYVYPT-SNVBAGLBSA-N 283.284 -0.248 5 20 CBBD O=C(NCc1ncc[nH]1)c1cc([N+](=O)[O-])c[nH]c1=O 80587412 ULRISQMVTZFHFE-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD C[C@H](O)[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 183150836 URSZEJVXCWYOGT-NHCYSSNCSA-N 284.316 -0.145 5 20 CBBD O=C1NC[C@@H]2[C@H]1CCCN2C(=O)c1n[nH]cc1[N+](=O)[O-] 337149268 QSBSHKGILCCSTP-RNFRBKRXSA-N 279.256 -0.332 5 20 CBBD CNC(=O)N[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 342354983 NTUMPANOTADAQS-VIFPVBQESA-N 282.304 -0.205 5 20 CBBD CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1COC[C@H]1O 342394706 DEUNZKAURNTFID-RNFRBKRXSA-N 256.218 -0.850 5 20 CBBD C[C@@H](CCN)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 349938232 PNFSXAVGUFMYBR-QMMMGPOBSA-N 268.273 -0.390 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[S@@]1=O 352312264 DYIMLFDQFJGCEC-RLBGWGEZSA-N 286.313 -0.229 5 20 CBBD CC(C)[C@@H](O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 357239124 KRYFGCIBFOMZSQ-QMMMGPOBSA-N 271.277 -0.291 5 20 CBBD Nc1nc(N2CCN([C@@H]3CCOC3)CC2)ncc1[N+](=O)[O-] 364042008 ZLOZVWPYRNLLEC-SECBINFHSA-N 294.315 -0.122 5 20 CBBD CNc1nc(C(=O)N[C@@H]2CCN(C)C2=O)ccc1[N+](=O)[O-] 455728640 GPTNAZQGQYSUJM-MRVPVSSYSA-N 293.283 -0.008 5 20 CBBD O=C(NC(CO)CO)c1cc2c(cc1[N+](=O)[O-])OCCO2 527195430 PTNADRLFOIUOCP-UHFFFAOYSA-N 298.251 -0.551 5 20 CBBD C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 610714621 ZZTGSHMQWFOHBW-SCZZXKLOSA-N 294.315 -0.215 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(N)=O 791252326 BEVIENVXSFBCMP-JTQLQIEISA-N 296.283 -0.763 5 20 CBBD CCN(OC)C(=O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 826751416 KBZDOZJUPUGCFA-UHFFFAOYSA-N 297.271 -0.090 5 20 CBBD CONC(=O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 857332595 YKYKEYKAMQFCEN-JTQLQIEISA-N 269.257 -0.105 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCCN(C=O)CC1 894997642 WVVKGAQZZWWCPB-UHFFFAOYSA-N 253.262 -0.003 5 20 CBBD O=C(NCCn1cncn1)c1c[nH]nc1[N+](=O)[O-] 1118011633 UGNKJDLRIHFSFN-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD C[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])N1CCN(C)CC1 1321104434 FCXOCQCHKZFUEG-VIFPVBQESA-N 296.331 -0.316 5 20 CBBD NC(=O)c1ccnc(N2CC[C@@H](CO)C2)c1[N+](=O)[O-] 1330037539 ZKYJXOUJAVWRMR-SSDOTTSWSA-N 266.257 -0.093 5 20 CBBD NCC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1 1349420009 DYMOGWVEHKVOLE-UHFFFAOYSA-N 253.262 -0.087 5 20 CBBD O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@@H](O)CO 1593473814 BKMBKFVCLXUDOC-SSDOTTSWSA-N 280.244 -0.460 5 20 CBBD CON(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H](C)C(=O)O 1594039385 BFIDMLOCPIFTLU-RXMQYKEDSA-N 272.217 -0.195 5 20 CBBD CNC(=O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 25201248 IXXAINVUNGQYOT-UHFFFAOYSA-N 251.242 -0.001 5 20 CBBD O=C(NCC(=O)N1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1 177985184 UGGGZXHXNGNGKZ-LLVKDONJSA-N 293.279 -0.082 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1 271242915 FMMGNWKRBKYEDB-JTQLQIEISA-N 295.251 -0.373 5 20 CBBD CC(C)N1C(=O)C[C@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1=O 285922158 CKKUSPUIKOQPEI-ZETCQYMHSA-N 295.255 -0.416 5 20 CBBD C[C@H](O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 302447156 RNITXKMHOJAEBJ-VIFPVBQESA-N 267.289 -0.112 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@]1(CO)CCOC1 330910534 VLTRLOUEYRYOGX-NSHDSACASA-N 270.289 -0.126 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)N(C)C 339405375 BLFQXSWYZPQJIS-MRVPVSSYSA-N 296.283 -0.651 5 20 CBBD CC(C)(CO)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340546254 NZJLBZRBAGACTO-UHFFFAOYSA-N 269.257 -0.356 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H]2CCNC2)c([N+](=O)[O-])n1 353222590 ZWGNXHZGZVEBHJ-ZETCQYMHSA-N 289.317 -0.549 5 20 CBBD NC(=O)[C@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 357652066 SFSCOYVBRNVZHE-QMMMGPOBSA-N 281.272 -0.485 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 371096638 CLSOREUKJYJURF-PRJMDXOYSA-N 258.230 -0.948 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(C)(O)C1 408163986 JAZJTHCSJGKUGE-UHFFFAOYSA-N 254.246 -0.307 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 583365619 JRQYAJGAYUIQDA-UHFFFAOYSA-N 295.299 0.074 5 20 CBBD CC(C)(C(=O)NCc1nn[nH]n1)n1cc([N+](=O)[O-])cn1 609532348 LKUUPVSSWRRLCT-UHFFFAOYSA-N 280.248 -0.644 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NN1CC(=O)NC1=O 757937225 RBXJTWFDZZYNNJ-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD O=C(NC1CN(C(=O)c2cscn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991282170 XPYSKDFTJIKUCG-VXNVDRBHSA-N 296.308 -0.251 5 20 CBBD CN(CCNC(=O)CC(N)=O)c1ccc([N+](=O)[O-])cn1 1099970765 IRMAJBZEIIWEBH-UHFFFAOYSA-N 281.272 -0.582 5 20 CBBD C[C@H]1CNCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1119618491 LKLQTMOIKKCTTR-ONGXEEELSA-N 269.305 -0.554 5 20 CBBD Cc1nn(C)c(C(=O)N(C)CC(=O)N(C)C)c1[N+](=O)[O-] 1317995925 XJXRYVAWMTVDMO-UHFFFAOYSA-N 283.288 -0.203 5 20 CBBD O=C(NCCC(=O)N1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1319829934 IMSHIUDDCTURMS-UHFFFAOYSA-N 297.271 -0.703 5 20 CBBD Cc1[nH]nc(C(=O)NCc2nnc(C)n2C)c1[N+](=O)[O-] 1337224841 LLMVIIKMKIMENA-UHFFFAOYSA-N 279.260 -0.007 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 1602218515 BYKZWXZOLZSDBZ-RKDXNWHRSA-N 298.255 -0.772 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](CO)C(=O)O 1610559899 WLKBKZZHIPQOJM-SSDOTTSWSA-N 286.244 -0.948 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1C[C@H](O)CN1 52943237 AUKPQAZQGJWIJT-WDEREUQCSA-N 265.269 -0.066 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](CO)C(N)=O 341746664 LCQZXTBXDSKEDF-QMMMGPOBSA-N 283.240 -0.821 5 20 CBBD CC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1 351736249 KWSIRDBNRGFBBP-QMMMGPOBSA-N 293.283 -0.077 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@@H]1CC(=O)NC1=O 360804711 XUKDCOMJJKYFLK-ZCFIWIBFSA-N 295.255 -0.795 5 20 CBBD COC(=O)C[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 489331190 XIJGHIAICXNJJK-ZETCQYMHSA-N 298.255 -0.278 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 555318998 WYMFMEYXKWKPOA-CAHLUQPWSA-N 267.245 -0.428 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 566262021 YZNSPAJCOLRPNJ-HTRCEHHLSA-N 270.245 -0.528 5 20 CBBD CNc1nccc(C(=O)NC[C@@H](C)C(=O)OC)c1[N+](=O)[O-] 566982074 BSMZWVDSQNAZRE-SSDOTTSWSA-N 296.283 0.570 5 20 CBBD NC(=O)CCNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 738444892 XXAPZIYESGIRDH-UHFFFAOYSA-N 281.224 -0.102 5 20 CBBD Cn1nnc(COC(=O)CCn2cc([N+](=O)[O-])cn2)n1 799480656 PUEGJUUMCVICGA-UHFFFAOYSA-N 281.232 -0.552 5 20 CBBD CC(C)NC(=O)NCCOC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 829279613 VVTVGGBTAWADSF-HTQZYQBOSA-N 259.262 -0.098 5 20 CBBD CN(C)CC1(O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 913677110 ALBQYFBGVCMIFB-NXEZZACHSA-N 271.317 -0.433 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccnnc1 1000466574 MVPNHXUKTHOANT-NXEZZACHSA-N 291.267 -0.918 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1n[nH]cc1[N+](=O)[O-] 1331402208 CCVBJOQLTGUCCB-UHFFFAOYSA-N 265.233 -0.281 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CC=C(C(=O)O)C1 1601390235 XUQDVOZUMHHWTE-SSDOTTSWSA-N 281.228 -0.524 5 20 CBBD O=C(O)C1CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1601844331 YIUVTHKNFSXLFA-UHFFFAOYSA-N 281.224 -0.701 5 20 CBBD O=C(O)CSCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1608767644 HFKIUDSARJXIQX-UHFFFAOYSA-N 274.258 -0.135 5 20 CBBD COC(=O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 43271968 QRPGCDGWQHCMTF-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 104890738 JTWRBJZSSMHQGZ-QMMMGPOBSA-N 281.272 -0.472 5 20 CBBD NC(=O)COCCNC(=O)c1cc(F)ccc1[N+](=O)[O-] 228693090 QUUBPLQNGFIPNT-UHFFFAOYSA-N 285.231 -0.034 5 20 CBBD CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262517861 QCVXPTUGQIHUJJ-MRVPVSSYSA-N 283.240 -0.264 5 20 CBBD NC(=O)[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2O)CCO1 267964630 UMQIXCZDWDTIFC-VIFPVBQESA-N 295.251 -0.373 5 20 CBBD CC(C)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285444715 MHVKGIWIDPYGNO-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD Nc1c(C(=O)N[C@@H]2COC[C@H]2O)cc(F)cc1[N+](=O)[O-] 297139063 ZYLIQBGSQZMTOK-VXNVDRBHSA-N 285.231 -0.194 5 20 CBBD CCN1CCN(C(=O)CNc2c([N+](=O)[O-])ncn2C)CC1 299314586 DVZJXKOTJCCXJC-UHFFFAOYSA-N 296.331 -0.096 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1=O 330420627 RDFIBUFYHNZTKO-LURJTMIESA-N 252.230 -0.117 5 20 CBBD Cc1[nH]nc(C(=O)N2CCC[C@@H]2C(N)=O)c1[N+](=O)[O-] 339892529 PLJRNBJBRUPBDF-ZCFIWIBFSA-N 267.245 -0.284 5 20 CBBD C[C@@H](CCO)CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 340553250 LPJZMFVMDHCQER-VIFPVBQESA-N 283.284 -0.109 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)c1n[nH]cc1[N+](=O)[O-] 343099922 OSEBKNGAZVXIAH-UHFFFAOYSA-N 267.245 -0.332 5 20 CBBD CN(C)c1noc(CNC(=O)c2cc([N+](=O)[O-])nn2C)n1 356404743 HWDGJZQUPYXPCQ-UHFFFAOYSA-N 295.259 -0.293 5 20 CBBD O=C(O)[C@@H](O)CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 547897729 AGFSXIVTIPIEIA-BYPYZUCNSA-N 296.282 -0.620 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@H](CO)[C@@H](O)C1 565929258 IXYFJRVCZPOZPQ-KOLCDFICSA-N 298.299 -0.617 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(c2ncc([N+](=O)[O-])cn2)C1 592001718 BLNBPLOZHCKBAY-VXNVDRBHSA-N 282.256 -0.255 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1N 595228884 PNLPPQDZMNQTNB-SFYZADRCSA-N 268.277 -0.618 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@H]1COCCN1 599922036 XPUWMVJJHRJKJP-VIFPVBQESA-N 298.303 -0.921 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CN(C)CCO1 619789088 FMBPRKUXCCVOBW-CBAPKCEASA-N 283.288 -0.233 5 20 CBBD NC(=O)C1(NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCCC1 746472904 REGTZGHGEUBILT-SNVBAGLBSA-N 297.315 -0.460 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)NC(N)=O)n1 755577476 YNTWHYSOSAUETK-RXMQYKEDSA-N 299.243 -0.449 5 20 CBBD COCC(=O)OCCn1cc([N+](=O)[O-])ccc1=O 761359275 DQAVOCVUVKLXNK-UHFFFAOYSA-N 256.214 -0.054 5 20 CBBD CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cn1 761983117 MQFSGPGVUZEDFY-LURJTMIESA-N 296.239 -0.009 5 20 CBBD CC1(C(=O)OCCn2cnc([N+](=O)[O-])n2)COC1 782611283 NNJVWAWEUZUQSP-UHFFFAOYSA-N 256.218 -0.234 5 20 CBBD Cn1ncc(CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])n1 817952983 VUZSCAVSICWEGN-UHFFFAOYSA-N 279.260 -0.191 5 20 CBBD Cc1nnc(CN2CC(N(C)C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1042705493 UHQKFPLLDUOYTI-NXEZZACHSA-N 295.299 -0.314 5 20 CBBD CN(CCNc1ccccc1[N+](=O)[O-])C(=O)C(N)=O 1101944591 BITHSWOOZHMIOH-UHFFFAOYSA-N 266.257 -0.050 5 20 CBBD C[C@@H](CS(C)(=O)=O)N(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 1116414182 WZKFHYMAWGQLGD-LURJTMIESA-N 290.301 -0.177 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1c(Cl)cccc1[N+](=O)[O-] 1258034029 DYBYOHQHOSDEAM-LURJTMIESA-N 287.659 -0.176 5 20 CBBD CN(C)S(=O)(=O)NC(=O)c1cc([N+](=O)[O-])cn1C 1317947459 PTKYBIQYBROTTM-UHFFFAOYSA-N 276.274 -0.531 5 20 CBBD O=C(c1c[nH]nc1[N+](=O)[O-])N1CC(n2cncn2)C1 1325234396 TUPDJEQPADUSJK-UHFFFAOYSA-N 263.217 -0.394 5 20 CBBD O=C(O)[C@@H]1CC[C@H](C(=O)Nc2cc([N+](=O)[O-])n[nH]2)O1 1602177473 DEZUMQSXVGZEKP-UHNVWZDZSA-N 270.201 -0.111 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@@H]2CCCO2)c1 37882050 BYTAMAXDRVHIEN-MNOVXSKESA-N 270.289 -0.079 5 20 CBBD CCNC(=O)CN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75642593 ILWUCBVTSOWPLN-JTQLQIEISA-N 285.304 -0.780 5 20 CBBD CCC[C@@H](O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 134409344 ZJAQLZIMRZKXND-MNOVXSKESA-N 272.305 -0.097 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H](C)O[C@@H](CO)C1 187877201 PKFRAGCDVXSVIF-WCBMZHEXSA-N 298.299 -0.292 5 20 CBBD C[C@H](O)C[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228113289 PCQWISNNIRXJSQ-WCABBAIRSA-N 272.305 -0.099 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 230685717 FMPDCIDBUPNREM-RXMQYKEDSA-N 267.245 -0.564 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1C[C@H](O)C[C@H]1C(=O)O 252455201 PIFZEJYMMYYPKR-RITPCOANSA-N 256.218 -0.648 5 20 CBBD C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262532018 PEYLLFZOLHSCKS-SSDOTTSWSA-N 283.240 -0.407 5 20 CBBD O=C(NC(CO)CO)c1cc(O)cc([N+](=O)[O-])c1 274829868 RPERBUUAINVSTB-UHFFFAOYSA-N 256.214 -0.617 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@H]1CC(C(N)=O)=NO1 278818031 IWAAYIQGAYCUNG-RXMQYKEDSA-N 268.233 -0.630 5 20 CBBD NC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 339457669 ONODZBOLTUPSQH-UHFFFAOYSA-N 288.285 -0.459 5 20 CBBD NC(=O)c1cccc(N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 342937018 FWSOYAXKOHIASP-ZCFIWIBFSA-N 264.241 -0.006 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356551466 BJILGCHNYJYTKO-SSDOTTSWSA-N 283.288 -0.075 5 20 CBBD CC(C)N(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362336104 UOSAQVRLUWZQJW-UHFFFAOYSA-N 271.233 -0.492 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1Cc1c([N+](=O)[O-])ncn1C 408259413 LBLBWXMRZKGROA-MRVPVSSYSA-N 288.329 -0.053 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN3C(=O)OC[C@H]3C2)c1[N+](=O)[O-] 493445073 QDXPZFPGMPGZEJ-SSDOTTSWSA-N 295.255 -0.097 5 20 CBBD CN1CCC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 517962020 YBVGTYXULDVHSR-MRVPVSSYSA-N 293.283 -0.077 5 20 CBBD CNC(=O)C(=O)NCCOc1ccc([N+](=O)[O-])cc1 551001882 LETNSVABASSMCP-UHFFFAOYSA-N 267.241 -0.164 5 20 CBBD CO[C@H]1C[C@@H](C(=O)O)N(CCn2ccc([N+](=O)[O-])n2)C1 568067127 MXEDICLMCNDOBQ-IUCAKERBSA-N 284.272 -0.035 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@H]3CNC[C@H]23)nc1 595112125 SSZRLLZWPWGPDJ-YUMQZZPRSA-N 284.297 -0.514 5 20 CBBD CN1CCN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CCC1=O 598297828 XVVRCALGMVXWAR-UHFFFAOYSA-N 294.267 0.000 5 20 CBBD COC(=O)COCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 600402625 QXIYFGGMDVUDIW-UHFFFAOYSA-N 286.244 -0.454 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCNC1=O 619867682 FOZIXVABXQZSAO-MRVPVSSYSA-N 281.272 -0.566 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC[C@H]1CCNC1=O 813916954 RPWIXHWMANDULH-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD NC(=O)C(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1 1107480419 JBEIZPKXQNSYBG-OWOJBTEDSA-N 279.256 -0.441 5 20 CBBD NC(=O)c1cc(N2CC[C@@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-] 1118591683 FIIVDYNEWZBCHY-UFBFGSQYSA-N 295.295 -0.127 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1C[C@H]2C[C@]2(CO)C1 1320698931 NGCXXHULDVXFDA-BXKDBHETSA-N 280.284 -0.059 5 20 CBBD COCCN(CC(=O)O)c1ncc([N+](=O)[O-])cn1 49607055 WTYBNNZVTBHIAJ-UHFFFAOYSA-N 256.218 -0.078 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)NC(CO)CO 87749768 CBFMEGMCXQUHJO-UHFFFAOYSA-N 254.242 -0.014 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@@H](O)CO)c2nonc12 90281691 VHCGYSYGVTYUJI-RXMQYKEDSA-N 254.202 -0.104 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCO[C@H](C(N)=O)C2)n1 123556453 JKWORGNYJFWBMX-VIFPVBQESA-N 266.257 -0.011 5 20 CBBD Cc1[nH]nc(C(=O)N2CCNC(=O)[C@H]2C)c1[N+](=O)[O-] 264184996 ALXXQPYPJDDEGI-ZCFIWIBFSA-N 267.245 -0.413 5 20 CBBD COC(=O)[C@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)[C@@H](C)O 277929584 ATLATQXXYNNESQ-SVGQVSJJSA-N 299.239 -0.652 5 20 CBBD CCNC(=O)C1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 331541359 OJFGYILWYSSUBO-UHFFFAOYSA-N 281.272 -0.464 5 20 CBBD O=C1NC[C@@H]2[C@@H]1CCCN2C(=O)c1cc([N+](=O)[O-])n[nH]1 343306031 XDGKWHVNDGYGOR-POYBYMJQSA-N 279.256 -0.332 5 20 CBBD Cn1cc(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cn1 344237963 XDVBSILXQFRJCM-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD CCn1cc(S(=O)(=O)N(C)[C@H](C)CN)c([N+](=O)[O-])n1 353217840 MVPSIVYGYOUKLH-SSDOTTSWSA-N 291.333 -0.221 5 20 CBBD CN(CCn1ccc([N+](=O)[O-])n1)[C@@]1(CO)CCOC1 359574063 AZFFYNSNBKPKJN-LLVKDONJSA-N 270.289 -0.126 5 20 CBBD CNc1c(C(=O)NC(CO)CO)cccc1[N+](=O)[O-] 360937286 JKAHPIRGRASFHG-UHFFFAOYSA-N 269.257 -0.281 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 445212091 LNHPPKYJCYXKGU-ZETCQYMHSA-N 294.267 -0.002 5 20 CBBD CC(=O)NCCN(C)CCn1cc([N+](=O)[O-])cn1 520576775 WCWHFMMFSDYQMK-UHFFFAOYSA-N 255.278 -0.141 5 20 CBBD COCC[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)C(N)=O 538349922 TVQLUOXMEGXIBQ-MRVPVSSYSA-N 284.272 -0.447 5 20 CBBD C[C@H](CNc1ncc([N+](=O)[O-])cn1)S(C)(=O)=O 546177884 YXBPTXHOTIDVFW-ZCFIWIBFSA-N 260.275 0.230 5 20 CBBD CCOC[C@@H](O)CNCCn1cc([N+](=O)[O-])cn1 563952468 IOJQXEWZPHDFHP-JTQLQIEISA-N 258.278 -0.222 5 20 CBBD N[C@H]1C[C@@H]2CN(c3ncc([N+](=O)[O-])cc3F)CCN2C1=O 569139740 SSYXZIPCOVKQMS-SCZZXKLOSA-N 295.274 -0.123 5 20 CBBD O=C(NC/C=C/CO)NCCn1cc([N+](=O)[O-])cn1 596505217 PRYATJIIUAJJTF-OWOJBTEDSA-N 269.261 -0.361 5 20 CBBD Cc1[nH]nc(C(=O)N2CCCNC(=O)C2)c1[N+](=O)[O-] 726800330 DZDQQUDJXZOWFN-UHFFFAOYSA-N 267.245 -0.412 5 20 CBBD C/C(=C/Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O)C(=O)O 736122056 RXXWROZDRQFHLR-KXFIGUGUSA-N 281.224 -0.114 5 20 CBBD CC[C@]1(C)NC(=O)N(NC(=O)c2c[nH]nc2[N+](=O)[O-])C1=O 801600847 JLVDRMMZCKIMIS-JTQLQIEISA-N 296.243 -0.317 5 20 CBBD CCn1ncn(NC(=O)c2ccc([N+](=O)[O-])o2)c1=O 820390611 DIYGFZPXSJNISG-UHFFFAOYSA-N 267.201 -0.050 5 20 CBBD COC[C@@H](OC)C(=O)OCCn1ccc([N+](=O)[O-])n1 850200923 LXUHJILMWOEDQK-MRVPVSSYSA-N 273.245 -0.004 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC(N2CC[C@@H](O)C2)C1 1326573734 LGZNHZYIVAFTGI-SECBINFHSA-N 295.299 -0.781 5 20 CBBD CC(C)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1327889290 QBVJZYZJDAHUIQ-QMMMGPOBSA-N 285.304 -0.409 5 20 CBBD CNC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1329483830 NKRGYJCLPWZXFV-JTQLQIEISA-N 294.311 -0.176 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@H]1CO 1338724915 XCPKFEQPBZJWPY-KOLCDFICSA-N 295.295 -0.014 5 20 CBBD COC[C@@](C)(NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1339080612 YMPPVUZWAIDECV-SNVBAGLBSA-N 286.244 -0.452 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CC[C@H]2CCN[C@H]1C2 1580578237 CBIGLAZLAOKPLE-GUBZILKMSA-N 294.315 -0.167 5 20 CBBD O=C(N[C@@H]1CCCNC1=O)c1cc([N+](=O)[O-])c[nH]1 50636300 AUSDWEVICSZGIH-SSDOTTSWSA-N 252.230 -0.069 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)NCCn1cc([N+](=O)[O-])cn1 161499966 CHLZZFJPPALJIN-MRVPVSSYSA-N 296.287 -0.679 5 20 CBBD C[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H]1CN 237702792 QLCQBBMJVAMBQO-IUCAKERBSA-N 282.304 -0.228 5 20 CBBD O=C(O)CCC(=O)NCCn1cc([N+](=O)[O-])cn1 261873111 OJJHYCVFWDFUQP-UHFFFAOYSA-N 256.218 -0.228 5 20 CBBD C[C@H](O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@@H](C)C1 275381091 PDPGNIWGUVTANI-IUCAKERBSA-N 296.331 -0.142 5 20 CBBD COCCN1CN(c2c([N+](=O)[O-])ncn2C)CC1=O 282878371 CHGZTBKXBUHUMU-UHFFFAOYSA-N 269.261 -0.419 5 20 CBBD CC(C)(C(=O)N[C@@H]1CCCNC1=O)n1cc([N+](=O)[O-])cn1 330441520 PCVCDGZIEMVBAK-SECBINFHSA-N 295.299 -0.079 5 20 CBBD O=C(NC[C@H](O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])cnc1O 347098460 ZCZVVVXJWDSFMC-XCBNKYQSSA-N 297.267 -0.177 5 20 CBBD CC[C@@]1(O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 495194069 NNGSRXUOCYYIJJ-NWDGAFQWSA-N 284.316 -0.001 5 20 CBBD Cc1noc(CN(CCO)CCOCCO)c1[N+](=O)[O-] 595543101 YFWALRRREDYPBZ-UHFFFAOYSA-N 289.288 -0.306 5 20 CBBD COC(=O)C[C@H](O)CNc1c([N+](=O)[O-])ncn1C 599163647 XBUVBERQOCPLEG-LURJTMIESA-N 258.234 -0.336 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[C@H]2CO3)n1 600777024 QZOMKKTUZSWNMK-BQBZGAKWSA-N 252.230 -0.058 5 20 CBBD O=C(CNc1nc2ccccn2c1[N+](=O)[O-])NCCO 759699040 RCIYPKYFLPSHFC-UHFFFAOYSA-N 279.256 -0.237 5 20 CBBD NC(=O)[C@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CCN1 804338127 UJTBXKZUQGUPAA-SSDOTTSWSA-N 295.255 -0.234 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C(=O)O1 808204764 PMHWODMBXCYJQR-RQJHMYQMSA-N 268.229 -0.389 5 20 CBBD O=C(NC[C@H]1CCCN1CCCO)[C@@H]1C[C@H]1[N+](=O)[O-] 839781109 IVVLHFCYZMRNAI-GMTAPVOTSA-N 271.317 -0.385 5 20 CBBD CCN1CC(n2cc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])nn2)C1 1094290709 GTRRYXMQYBTAIZ-GHMZBOCLSA-N 294.315 -0.564 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@@H]1C(=O)O 1117832913 BKJNYFLRCWVLMS-SSDOTTSWSA-N 284.228 -0.746 5 20 CBBD C[C@@H](O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1319949207 HHSWVWKPTPWNLJ-NXEZZACHSA-N 295.295 -0.014 5 20 CBBD CN(C[C@@H]1CCN1)C(=O)Cn1cc([N+](=O)[O-])cn1 1578453403 MOMQCCQSGJMLQF-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)C(=O)O 1593541618 HSGXXVHIDMJRNI-LURJTMIESA-N 298.207 -0.658 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)O 1600748367 OEPPTFHLYWXJHF-VROVMSAKSA-N 294.267 -0.111 5 20 CBBD O=[N+]([O-])c1ccc(N2C[C@H](O)[C@H](O)C2)cc1-c1nn[nH]n1 1609602297 WOBIKFSMAWGVEA-AOOOYVTPSA-N 292.255 -0.683 5 20 CBBD CNC(=O)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 45287142 TZLRWFXZDCQYPX-UHFFFAOYSA-N 277.240 -0.053 5 20 CBBD NC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 69904790 UNAXERLKOGEZJH-UHFFFAOYSA-N 288.285 -0.471 5 20 CBBD O=C(Cn1cnnn1)NCCc1cccc([N+](=O)[O-])c1 89835401 CTXMWKXPBYUBRQ-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD Cc1cc(NCC(=O)NCC(=O)O)ncc1[N+](=O)[O-] 92026341 CXMBCHCECVOJBZ-UHFFFAOYSA-N 268.229 -0.089 5 20 CBBD COC[C@@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 159482568 ZHUKHGPHNOHNNL-ZETCQYMHSA-N 269.257 -0.086 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 227866398 CGZKIWPBFKJOOL-MRVPVSSYSA-N 253.214 -0.829 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@@H](O)CC2)c1 339782178 WXKGXNOSZBQAGF-VXGBXAGGSA-N 284.316 -0.001 5 20 CBBD NS(=O)(=O)[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1 339841302 PHESPAAIZFBOKM-VIFPVBQESA-N 289.317 -0.846 5 20 CBBD COC[C@@](C)(N)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357536230 UDUYGPIMBHQQAL-NSHDSACASA-N 283.288 -0.136 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC(O)(C(F)F)C1 425272308 GCLJXBJAXMGZSB-UHFFFAOYSA-N 288.210 -0.095 5 20 CBBD CO[C@@H]1COCC[C@H]1CN=c1nc(N)c([N+](=O)[O-])c[nH]1 450694059 NQVXCUKKSYRHRE-IONNQARKSA-N 283.288 -0.148 5 20 CBBD COC[C@](C)(O)CNc1ncc([N+](=O)[O-])cc1C(N)=O 522116319 AZLQHGRVPMRGFB-LLVKDONJSA-N 284.272 -0.102 5 20 CBBD CNc1c(C(=O)N[C@@H](CO)C(N)=O)cccc1[N+](=O)[O-] 553311795 MMYPOUVLACMWCM-ZETCQYMHSA-N 282.256 -0.788 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 597654141 OVJXADGDMFGAII-QMMMGPOBSA-N 270.289 -0.414 5 20 CBBD CCn1ccc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n1 598099668 IDEZZRNTMCMHHY-UHFFFAOYSA-N 265.233 0.041 5 20 CBBD O=C(N[C@@H]1CCNC[C@H]1O)c1cc([N+](=O)[O-])c[nH]1 710372251 BMDDVJIVKYZFLU-VXNVDRBHSA-N 254.246 -0.625 5 20 CBBD Cc1cc(C(=O)N[C@@H]2CN(C)NC2=O)c(N)c([N+](=O)[O-])c1 777772237 STHZWWHKHUGECO-MRVPVSSYSA-N 293.283 -0.440 5 20 CBBD O=C(Nn1cnnc1O)c1cc([N+](=O)[O-])cnc1O 782123992 JQZBLLADJUYYCL-UHFFFAOYSA-N 266.173 -0.624 5 20 CBBD CCOC(=O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411948 RPHJQFUJPNRONZ-UHFFFAOYSA-N 283.240 -0.564 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@](C)(O)C1 1255699995 OKKQERCKAVLZMO-SNVBAGLBSA-N 254.246 -0.075 5 20 CBBD Cc1nc2n(n1)C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])CC2 1321288161 POLBDRXRWOWCBG-ZETCQYMHSA-N 291.271 -0.037 5 20 CBBD CC(=O)OC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 1325000026 ZJSOKPTUNKSJKB-QMMMGPOBSA-N 285.256 -0.413 5 20 CBBD NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1329139792 AARRHLPWBOXEPD-WCABBAIRSA-N 297.315 -0.604 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC1CCNCC1 1332157307 QVPVKJZWEMWNPX-UHFFFAOYSA-N 253.262 -0.190 5 20 CBBD NC[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332413851 RBHFKNPDJADTLZ-MRVPVSSYSA-N 268.277 -0.616 5 20 CBBD C[C@@](O)(CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 90275459 ASEWDHVWAOMRER-SECBINFHSA-N 257.202 -0.512 5 20 CBBD CCC[C@H]1C(=O)NCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 123230907 RLASPPGEQFGVFJ-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD Cc1nn(C)c(C(=O)N2CCN(C)C(=O)[C@H]2C)c1[N+](=O)[O-] 188428224 OELZFAIKFOPPDX-MRVPVSSYSA-N 295.299 -0.061 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 229974565 QRWGIXIGMITTOH-VIFPVBQESA-N 267.241 -0.900 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1(CO)CC1 331640196 JHNUFAODDYBKJQ-UHFFFAOYSA-N 254.246 -0.178 5 20 CBBD O=C(NC[C@@H](O)COCC1CC1)c1n[nH]cc1[N+](=O)[O-] 344030769 MJXIJZBSJVJDPE-MRVPVSSYSA-N 284.272 -0.165 5 20 CBBD Cn1ncn(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1=O 353199191 BPHGYBSUIOZVDH-UHFFFAOYSA-N 277.240 -0.363 5 20 CBBD CC(=O)N1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 408143694 BHJUDWJGLBATRW-UHFFFAOYSA-N 281.272 -0.069 5 20 CBBD COc1ccc(CC(=O)NC(CO)CO)cc1[N+](=O)[O-] 526946158 SZXZEGSPUSBCJA-UHFFFAOYSA-N 284.268 -0.385 5 20 CBBD COC(=O)C1(NC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 548417546 ALXIXGJRIOGCDL-UHFFFAOYSA-N 254.202 -0.247 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@H]([C@@H](C)N)C2)c1[N+](=O)[O-] 592308920 PBTBEQLXPPPXTA-SVRRBLITSA-N 283.288 -0.185 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCc1ccc(CO)cc1 592826044 LNMABGXMHVLZSS-UHFFFAOYSA-N 291.267 -0.005 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)Cn2cnc([N+](=O)[O-])c2)c1 743259325 XBONTOJYHIALCV-MRVPVSSYSA-N 282.216 -0.043 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)COc1ccccc1[N+](=O)[O-] 788182906 JMMBOYPEQMTGPK-VIFPVBQESA-N 297.267 -0.803 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NOC[C@@H]1CCOC1 788275239 UAFZGVVDVLPSBD-MRVPVSSYSA-N 270.245 -0.124 5 20 CBBD CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C(=O)N1 801937664 SIAIIUKSGJGBAR-MRVPVSSYSA-N 297.246 -0.609 5 20 CBBD COC(=O)C1(OC(=O)Cn2cnc([N+](=O)[O-])n2)CC1 810757451 LXDHXVSKVNZLFE-UHFFFAOYSA-N 270.201 -0.565 5 20 CBBD Cc1nn(C)c(C(=O)NCC(=O)N2CCCC2)c1[N+](=O)[O-] 1318311048 WJFNAWZJOQLWSB-UHFFFAOYSA-N 295.299 -0.011 5 20 CBBD O=C(NC[C@@H]1CNCCO1)c1n[nH]cc1[N+](=O)[O-] 1349271276 JRJJZNDNCVQLCV-LURJTMIESA-N 255.234 -0.964 5 20 CBBD COCCn1c(C[N+](=O)[O-])nnc1N1CC(C)(OC)C1 1355641481 VCOHFMYAOCNDQR-UHFFFAOYSA-N 285.304 -0.074 5 20 CBBD Nc1cc(N2CC(O)C2)cc(-c2nn[nH]n2)c1[N+](=O)[O-] 1592759909 KTSBFCLEUIRLJT-UHFFFAOYSA-N 277.244 -0.462 5 20 CBBD CO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](C(=O)O)C1 1606751757 ZNIPMBZFZIJGCJ-KDXUFGMBSA-N 272.257 -0.258 5 20 CBBD CN1C(=O)CN(c2nc(C(=O)O)ccc2[N+](=O)[O-])CC1=O 1610127813 LBRPNNKTCYNCPX-UHFFFAOYSA-N 294.223 -0.507 5 20 CBBD O=C(O)CN1C(=O)c2ccc([N+](=O)[O-])cc2S1(=O)=O 39155334 HLACATNEENMZSW-UHFFFAOYSA-N 286.221 -0.176 5 20 CBBD CCNC(=O)Cn1cc(C(=O)OC)cc([N+](=O)[O-])c1=O 41744382 ZCSUUPUSNSUEPI-UHFFFAOYSA-N 283.240 -0.321 5 20 CBBD CN(CC(=O)N1CCCC1)C(=O)Cn1ccc([N+](=O)[O-])n1 63682281 KWBGGCSHCAGETF-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD Cc1cc(=O)n(CCNS(C)(=O)=O)cc1[N+](=O)[O-] 128432290 HHQKKZIWXULVBE-UHFFFAOYSA-N 275.286 -0.386 5 20 CBBD C[C@@H]1NC(=S)N(CCn2cc([N+](=O)[O-])cn2)C1=O 178352324 UHSDKEVSJKXGQU-LURJTMIESA-N 269.286 -0.104 5 20 CBBD CCN(CCO)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 183933383 FCNQBMUQQNTVRW-UHFFFAOYSA-N 299.331 -0.388 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 229420287 RABDAXXCJMSRKN-MADCSZMMSA-N 297.267 -0.035 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H]1CCCNC1 238142979 BKTSQAKWFGFIQC-VIFPVBQESA-N 280.284 -0.375 5 20 CBBD CS(=O)(=O)C1(CNc2ncc([N+](=O)[O-])c(N)n2)CC1 280572395 VOCZBBPYVMVDDX-UHFFFAOYSA-N 287.301 -0.044 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 311879840 MVHSDQUIOXNRDV-UHFFFAOYSA-N 291.260 -0.160 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CC[C@@H](CO)O1 349622043 AGOMVLYHPPAHED-IUCAKERBSA-N 284.272 -0.553 5 20 CBBD COc1cc(C(=O)N[C@H](CO)C(N)=O)cc([N+](=O)[O-])c1C 352994661 WFFZCIOCCNREIO-MRVPVSSYSA-N 297.267 -0.512 5 20 CBBD O=[N+]([O-])c1ccn(CCN2C[C@@H]3CNC[C@@H]3C2)n1 359284821 VDJNDVZNZBZLJC-AOOOYVTPSA-N 251.290 -0.058 5 20 CBBD C[C@@](O)(CO)CNc1ncc([N+](=O)[O-])cc1C(N)=O 360092672 FSCFHGHUUOWUPQ-JTQLQIEISA-N 270.245 -0.756 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1C[C@H](F)CN1 368385843 RFJOQFGEWWYSCV-YUMQZZPRSA-N 271.252 -0.393 5 20 CBBD CCc1[nH]nc(C(=O)NCc2nnn(C)n2)c1[N+](=O)[O-] 428533786 DXVWTTIMXZAYRG-UHFFFAOYSA-N 280.248 -0.666 5 20 CBBD Nc1nnc(CCN=c2ccc([N+](=O)[O-])c[nH]2)o1 436424538 FQTZHUZUHJYOMA-UHFFFAOYSA-N 250.218 0.032 5 20 CBBD CC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])cn2)C1 532398742 PBAYGQLJJHQVCO-UHFFFAOYSA-N 264.241 -0.050 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])o1 600471473 SGKMPSSMYLTPRR-LURJTMIESA-N 272.213 -0.158 5 20 CBBD NC(=O)C1(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)CCC1 610976434 DMRZOFWDQMMWFM-UHFFFAOYSA-N 294.267 -0.719 5 20 CBBD C[C@H](OC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(N)=O 748918365 WFBHOGIKSBOJOT-LURJTMIESA-N 269.213 -0.827 5 20 CBBD CCO[C@H]1COCC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839726177 NVWOYOOQTUVLPR-KYXWUPHJSA-N 258.274 -0.038 5 20 CBBD CCc1[nH]nc(C(=O)NCCn2cnnn2)c1[N+](=O)[O-] 845801378 DNGJUNIWFPYEMQ-UHFFFAOYSA-N 280.248 -0.703 5 20 CBBD O=[N+]([O-])c1cnc(N2C[C@@H](O)[C@@H](CO)C2)c(F)c1 894162236 PLTPOIXYGFUOLR-HZGVNTEJSA-N 257.221 -0.082 5 20 CBBD O=C(NCCNCc1cc2n(n1)CCC2)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936446 IJMQRRNVIKMLOB-VXGBXAGGSA-N 293.327 -0.300 5 20 CBBD CCNC(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1318051221 SRPWGXXWGFASRF-SSDOTTSWSA-N 283.288 -0.109 5 20 CBBD Cn1nncc1NC(=O)Cn1cc([N+](=O)[O-])cn1 1322782302 UFAWFHZSMKBDPP-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CNCCCO1 1328331449 CIUGVDQBHWNWLS-QMMMGPOBSA-N 283.288 -0.563 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C 1329216834 PCWBMSLQFKPHBM-SSDOTTSWSA-N 299.287 -0.225 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCc1cn[nH]c1 1331189809 UVBNHPBZBZZGGO-UHFFFAOYSA-N 265.233 -0.732 5 20 CBBD O=CN1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 1347698211 FZTDLUIHIFXHMC-UHFFFAOYSA-N 295.299 -0.128 5 20 CBBD COC(=O)[C@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591230945 XKEFOMXPLVJHRP-BYPYZUCNSA-N 267.205 -0.295 5 20 CBBD O=C(NC[C@H](C(=O)O)[C@@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1608418833 TWENINXTICDJBE-RQJHMYQMSA-N 298.255 -0.215 5 20 CBBD CC(C)OC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 48603314 UDDPQDJKYYFDPP-UHFFFAOYSA-N 285.260 -0.356 5 20 CBBD O=C(c1cn(-c2cccc([N+](=O)[O-])c2)nn1)N1CC(O)C1 156370624 HEURCEVHQXPTJG-UHFFFAOYSA-N 289.251 -0.008 5 20 CBBD CNC(=O)c1ccc(N2C[C@@H](O)[C@H](O)C2)c([N+](=O)[O-])c1 234340956 XECGIVBYYORXPN-GHMZBOCLSA-N 281.268 -0.504 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](O)[C@H](O)C2)n1 234576564 AWWAOLUKAWLMKR-RKDXNWHRSA-N 283.240 -0.682 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC[C@@H](O)C1CC1 269094266 IMIQLWFBZKIMJU-SNVBAGLBSA-N 283.288 -0.139 5 20 CBBD CN1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@H]2C1 287189430 TVNGTLHZFMPMHD-OCAPTIKFSA-N 265.273 -0.049 5 20 CBBD CN1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 299613488 GQUYAESDTZDSPF-ZETCQYMHSA-N 267.245 -0.862 5 20 CBBD Nc1nc(=NC[C@H]2COCCO2)[nH]cc1[N+](=O)[O-] 341817143 OOTQIHMVCQVSGO-LURJTMIESA-N 255.234 -0.784 5 20 CBBD CCCc1[nH]nc(C(=O)N[C@H](C)C(N)=O)c1[N+](=O)[O-] 344952069 CTSOXDZPGHPBIM-RXMQYKEDSA-N 269.261 -0.126 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[C@H](CO)O1 349614902 KJAMVBXRBICCMR-NXEZZACHSA-N 284.272 -0.553 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1C=C[C@H](CO)C1 360757201 XQMWUYOHKQREAK-JGVFFNPUSA-N 266.257 -0.005 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@H](O)C[C@@H]1CO 368428164 CTLXASLJEYESDH-GHMZBOCLSA-N 296.279 -0.072 5 20 CBBD NC(=O)[C@@H]1CCCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 548735394 GSDMOGCLPWXHDV-SSDOTTSWSA-N 293.283 -0.091 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NCCN1CCCC1=O 565137228 VSQWJQWCZVTSSK-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 600469474 MZXZNZJNVHDEDG-ZETCQYMHSA-N 271.229 -0.423 5 20 CBBD CN1CC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1=O 819622619 UILRMDGAMFITKJ-DJLDLDEBSA-N 255.274 -0.364 5 20 CBBD CN(C(=O)c1cc[nH]n1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953771223 FPWSMSPWDXDNQB-PSASIEDQSA-N 293.283 -0.642 5 20 CBBD O=C(NC1CN(Cc2cnsn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030292409 HBOAMFWUZQONEB-RKDXNWHRSA-N 283.313 -0.496 5 20 CBBD Cn1cc(CN2CC(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cn1 1031662191 WNNCNSKWYHTECJ-VXGBXAGGSA-N 293.327 -0.367 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCc2nn[nH]c2C1 1329604568 PGIMSPRQSGQCKD-UHFFFAOYSA-N 291.271 -0.197 5 20 CBBD O=C(N[C@@H](C(=O)O)C1CC1)c1cc([N+](=O)[O-])n[nH]1 1601393599 WEBGUQZEQOIKAS-SSDOTTSWSA-N 254.202 -0.089 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 25199440 IGIMTEKJVRGQGX-UHFFFAOYSA-N 282.212 -0.021 5 20 CBBD COc1ccc(C(=O)NN2CC(=O)NC2=O)cc1[N+](=O)[O-] 29023505 AQUVZPYPLAQXBS-UHFFFAOYSA-N 294.223 -0.200 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CCS(=O)CC1 131942336 ZHLNKLFJVRFOFA-UHFFFAOYSA-N 285.325 -0.179 5 20 CBBD CC(C)N1C[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 263740030 QRTWAPPJPOXSRC-VIFPVBQESA-N 295.299 -0.083 5 20 CBBD O=C1NC[C@H]2CN(c3ccccc3[N+](=O)[O-])CCN2C1=O 267508911 PEMCXAYHJNBXOT-VIFPVBQESA-N 290.279 -0.258 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2CC(NC(C)=O)C2)n1 331382366 HAEZDOQMBMLAPL-UHFFFAOYSA-N 281.272 -0.228 5 20 CBBD Nc1nc(=NCCn2cc([N+](=O)[O-])cn2)nc2[nH][nH]cc1-2 354590305 UJYKHBKKCLNUHC-UHFFFAOYSA-N 289.259 -0.475 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 408051898 MCNZFPZYDODXDH-LURJTMIESA-N 267.245 -0.711 5 20 CBBD Cc1nc(N2CCO[C@@H](C(=O)O)C2)ncc1[N+](=O)[O-] 573094036 RVDUGGRKWLCUDR-MRVPVSSYSA-N 268.229 -0.017 5 20 CBBD Cn1cnc(NC(=O)Cn2ccc([N+](=O)[O-])n2)n1 576540284 RFLNUUCZOSOHKG-UHFFFAOYSA-N 251.206 -0.442 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)Nc1nnc2nc[nH]n12 590377932 OHVVFZQTSYDZIL-UHFFFAOYSA-N 291.231 -0.414 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)CNC)c([N+](=O)[O-])n1 595119072 LGAGCLMPDGRAQG-SSDOTTSWSA-N 291.333 -0.303 5 20 CBBD CN[C@H](C)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 722037152 KPDKEZMVAXRGPH-MRVPVSSYSA-N 255.278 -0.095 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])cn(CCOCCO)c1=O 740096826 RNEPYPJXMRHRSL-UHFFFAOYSA-N 272.213 -0.536 5 20 CBBD O=c1c(F)cn([C@H]2CCCO2)c(=O)n1CC[N+](=O)[O-] 899880421 LQMVDORNNWYEMG-MRVPVSSYSA-N 273.220 -0.265 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H](O)C(F)(F)F 1255700719 WRZRRHSGMAEPKC-RXMQYKEDSA-N 282.178 -0.019 5 20 CBBD CCN(C#N)CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590665665 FISWSLXWIBBERI-UHFFFAOYSA-N 277.248 -0.226 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCOC1 48978540 CJCQTCOGHBDTPG-QMMMGPOBSA-N 254.246 -0.056 5 20 CBBD CC[C@H](O)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 124699009 CAURWXJAHKHDRF-UWVGGRQHSA-N 258.278 -0.487 5 20 CBBD NC(=O)c1ccc(CNC2(C(N)=O)CC2)c([N+](=O)[O-])c1 152418965 CSODNDQDXLSOAJ-UHFFFAOYSA-N 278.268 -0.199 5 20 CBBD CC(=O)N(C)CC(=O)OCCn1cc([N+](=O)[O-])cn1 177762103 QQLMHHFRZNLKNR-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD NC(=O)[C@H]1CCCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 267298693 JNIWCJDNZRITMI-UWVGGRQHSA-N 295.299 -0.048 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@@H](OCCO)C1 269442686 DYAICTJGUFECFS-SNVBAGLBSA-N 298.299 -0.209 5 20 CBBD CN1C[C@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@H]2C1 279228723 QSMVRLMTLKCGMV-OCAPTIKFSA-N 265.273 -0.049 5 20 CBBD CNC(=O)[C@@]1(C)CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 281103210 LGEWZPUZTWMDQE-LBPRGKRZSA-N 295.299 -0.224 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCN1CCC1 337326040 VQUQMUAKEPMPNR-UHFFFAOYSA-N 267.289 -0.078 5 20 CBBD COCC[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 337564150 OZTSFLASIWARAD-ZETCQYMHSA-N 257.250 -0.273 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H](O)C1CC1 337651267 LIDFRIOMRWSADQ-JTQLQIEISA-N 281.268 -0.356 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 340490611 AMPHRULJDXHYKW-QMMMGPOBSA-N 267.245 -0.862 5 20 CBBD CN(C)CCOCCNC(=O)c1n[nH]cc1[N+](=O)[O-] 345947566 DFPQXCGMZAUAJG-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD COc1n[nH]c(NC(=O)c2cc([N+](=O)[O-])cnc2N)n1 353957703 BVKKHHDFNPRLTD-UHFFFAOYSA-N 279.216 -0.049 5 20 CBBD O=C(NC[C@@H](O)COCC1CC1)c1cc([N+](=O)[O-])n[nH]1 354066247 UKQZBOIXQJGGBE-MRVPVSSYSA-N 284.272 -0.165 5 20 CBBD NS(=O)(=O)CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356333848 GSQGQWUVZLPCBQ-UHFFFAOYSA-N 289.269 -0.681 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1n[nH]cc1[N+](=O)[O-] 362397044 QMNPXVZYWKVKIO-DTWKUNHWSA-N 295.299 -0.089 5 20 CBBD Cn1nnc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)n1 362980433 PPGKWYGVWNYXRO-UHFFFAOYSA-N 298.284 -0.403 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@@H](O)[C@@H](CO)C2)n1 567977734 KIMOUYGKRRSTRI-VXNVDRBHSA-N 297.267 -0.214 5 20 CBBD CNS(=O)(=O)CCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 600665974 VOYGVQUVGPJMOG-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD COC(=O)CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])n1C 737608765 LOUSHFZKXMQMLB-UHFFFAOYSA-N 299.239 -0.367 5 20 CBBD CNC(=O)NC(=O)COC(=O)c1cc(O)cc([N+](=O)[O-])c1 769050490 XBTYQBRNNSOARE-UHFFFAOYSA-N 297.223 -0.087 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 782879498 NEZSWHKFSBOLQR-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD CN(CC(=O)OCCn1cnc([N+](=O)[O-])n1)C(=O)O 828120604 SIKOJVICVIRODM-UHFFFAOYSA-N 273.205 -0.661 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 839800803 LAUAPGOFYQGZAJ-LHLIQPBNSA-N 294.267 -0.057 5 20 CBBD Cc1noc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030292170 WIPHATMGWMTJTG-RKDXNWHRSA-N 281.272 -0.656 5 20 CBBD CNC(=O)CCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1318500249 ZQQGVNAEPYCUKH-UHFFFAOYSA-N 269.261 -0.118 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1CCNC1 1331942944 JJAVQTYGUNQPMT-ZETCQYMHSA-N 254.250 -0.993 5 20 CBBD O=[N+]([O-])CCN1CCS(=O)(=O)[C@@H]2COCC[C@@H]21 1341532583 GUMMYIBYDDQOBS-DTWKUNHWSA-N 264.303 -0.849 5 20 CBBD O=[N+]([O-])c1cnc(N2CC[C@H](CO)[C@@H](O)C2)nc1 1343664497 APNFFIOMIIJCIX-APPZFPTMSA-N 254.246 -0.436 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC(=O)N1CCCCC1 53074739 MKGIVLZKKUDSSO-UHFFFAOYSA-N 295.299 -0.080 5 20 CBBD C[C@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])C(N)=O 264586916 NOTZWTCKCKDUSE-ZETCQYMHSA-N 295.251 -0.224 5 20 CBBD COC(=O)N1CC(Nc2ncc([N+](=O)[O-])cc2C(N)=O)C1 269383096 SPTWBDZGWQTTMY-UHFFFAOYSA-N 295.255 -0.049 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@@H](CO)O1 349577255 RUJWDSSWQHASSL-SFYZADRCSA-N 284.272 -0.402 5 20 CBBD CCNC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])n1C 351841821 FUWGNBBFCSTMLN-UHFFFAOYSA-N 283.288 -0.018 5 20 CBBD COCCCS(=O)(=O)NCCn1cnc([N+](=O)[O-])n1 356571553 XZQLCKVHEZQJOY-UHFFFAOYSA-N 293.305 -0.858 5 20 CBBD CC(CO)(CO)CNC(=O)c1cc([N+](=O)[O-])c[nH]1 393882565 KULXXQAYWUFJDA-UHFFFAOYSA-N 257.246 -0.356 5 20 CBBD Cn1nnnc1CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 437002523 YNJAUEZNBVNMPA-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD CN1C[C@@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)OC1=O 496074400 CRZBDELHDMGJTM-QMMMGPOBSA-N 284.228 -0.215 5 20 CBBD Cc1[nH]nc(C(=O)NCCOCCN(C)C)c1[N+](=O)[O-] 540848703 WNASBQSSSFZTGP-UHFFFAOYSA-N 285.304 -0.066 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N2C[C@H](O)[C@@H](CO)C2)n1 567977731 KIMOUYGKRRSTRI-APPZFPTMSA-N 297.267 -0.214 5 20 CBBD C[C@H](CCNC(=O)Cn1cnc([N+](=O)[O-])n1)N(C)C 597992944 PUGFYRGFIQTPOB-MRVPVSSYSA-N 270.293 -0.357 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC(=O)NC1CCCC1 604503110 LTRNHIIPPBICIN-UHFFFAOYSA-N 296.287 -0.639 5 20 CBBD CN1CC[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C1=O 734894467 DSCDIXBITTYFLH-VIFPVBQESA-N 282.256 -0.045 5 20 CBBD Cc1nn(C)c(C(=O)O[C@@H]2CCC(=O)NC2=O)c1[N+](=O)[O-] 798604108 PDBMVJAPOVHOBJ-ZCFIWIBFSA-N 296.239 -0.401 5 20 CBBD O=C(NN1CCS(=O)(=O)CC1)c1cc([N+](=O)[O-])c[nH]1 862737101 ALPMBTNHVYEHAM-UHFFFAOYSA-N 288.285 -0.702 5 20 CBBD CC(C)CC(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042976325 ZWQLNYCWJQALCA-NXEZZACHSA-N 299.327 -0.613 5 20 CBBD COC(=O)c1ncn(CCn2ccc([N+](=O)[O-])n2)n1 1116206257 ZJWYQTLCPCJWNG-UHFFFAOYSA-N 266.217 -0.130 5 20 CBBD CC(C)[C@@H](N)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118197026 LOUKLKQHDXRKRH-VIFPVBQESA-N 282.300 -0.144 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OCc1cc[nH]n1 1118451059 UUTLAJKJVMGRQS-UHFFFAOYSA-N 252.190 -0.347 5 20 CBBD NC(=O)NCC(=O)NCCNCc1cccc([N+](=O)[O-])c1 1123235414 LXCJNEQGJNMNDV-UHFFFAOYSA-N 295.299 -0.531 5 20 CBBD C[C@H]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C(=O)O1 1261246005 XPMVHTBAQYLOEI-WHFBIAKZSA-N 254.202 -0.248 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCn1cnnc1 1328556589 MXDLIZKACDCKQG-UHFFFAOYSA-N 293.287 -0.102 5 20 CBBD O=C(O)COCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 1608757821 GRUCJNVIPYMNFL-UHFFFAOYSA-N 258.190 -0.851 5 20 CBBD COCC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)O 1610254020 RVYGDZLELLPAIR-RXMQYKEDSA-N 272.217 -0.463 5 20 CBBD CC(C)C(=O)NCCNC(=O)Cn1ccc([N+](=O)[O-])n1 48674297 UPULQRAXUKUFQB-UHFFFAOYSA-N 283.288 -0.320 5 20 CBBD COC(=O)CN1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1 78727460 BCSWEYPOFDGACJ-UHFFFAOYSA-N 297.315 -0.068 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286007948 HZTORYGFRUMSMN-JGVFFNPUSA-N 284.272 -0.070 5 20 CBBD CO[C@H]1COC[C@@H]1NCCn1ccc([N+](=O)[O-])n1 290080621 GYQAHKNLBPSKFS-IUCAKERBSA-N 256.262 -0.205 5 20 CBBD CN1CCOC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 330585144 SDANWPHOUODGKM-SNVBAGLBSA-N 283.288 -0.762 5 20 CBBD C[C@@H]1C[C@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 330987057 GJCNMAAMGWPYSH-SCZZXKLOSA-N 281.268 -0.262 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCCC[C@H]1O 339804363 OZOZMPLFUYUVEZ-HTQZYQBOSA-N 269.261 -0.394 5 20 CBBD CCN(C)CCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 354017927 CTSRXIOFTDNCJL-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC(=O)NC1=O 354603121 HSCJQOKDOWBALF-SSDOTTSWSA-N 292.251 -0.288 5 20 CBBD Cn1nnc(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)n1 436839224 NLRTUXSDJBXSLT-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD O=[N+]([O-])c1cnn(CCNC[C@H](O)Cn2cccn2)c1 515054429 HPNPLHJLLPPWMF-NSHDSACASA-N 280.288 -0.362 5 20 CBBD O=C(N[C@H]1CCNC1)c1cc([N+](=O)[O-])cnc1O 592290200 YQWZJBWJODBIGE-LURJTMIESA-N 252.230 -0.213 5 20 CBBD Nc1nc(N[C@@H]2C[C@@H](C(=O)O)C[C@H]2O)ncc1[N+](=O)[O-] 595977566 GYJUZLISXHORIX-WYDQCIBASA-N 283.244 -0.397 5 20 CBBD NC(=O)[C@H](O)CNC(=O)CCOc1ccccc1[N+](=O)[O-] 597587602 ZNLPNSLHVDMGKP-SECBINFHSA-N 297.267 -0.674 5 20 CBBD CN[C@@H](C)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 722166232 HCADVHCPQGMDCC-QMMMGPOBSA-N 255.278 -0.095 5 20 CBBD O=[N+]([O-])c1cnn(CCc2nc(N3CCNCC3)no2)c1 823335092 QRBFYJKNHILQTP-UHFFFAOYSA-N 293.287 -0.173 5 20 CBBD COC[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 839734575 SKHHXFGGWYOEEC-ZYUZMQFOSA-N 258.274 -0.086 5 20 CBBD O=[N+]([O-])c1cnn(C/C=C\Cn2ncc([N+](=O)[O-])n2)n1 863372619 YEEQRWYUGVVSRH-UPHRSURJSA-N 280.204 -0.058 5 20 CBBD CSCC(=O)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010164400 BKCZQBCUHYNFJI-RKDXNWHRSA-N 287.341 -0.315 5 20 CBBD Cc1cc(NC/C=C\CNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1107480853 VWVCSMSLPAZVFD-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD Cc1[nH]nc(C(=O)NCCCS(C)(=O)=O)c1[N+](=O)[O-] 1115927130 LRYYHOWIJISHSS-UHFFFAOYSA-N 290.301 -0.209 5 20 CBBD CN(C)CCCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319849968 UROSEDYGQTVJOH-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCC(=O)C1(C(=O)O)CC1 1601386828 KWBQXMOAIPCZBR-UHFFFAOYSA-N 297.223 -0.232 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NC(CO)CO 87751898 DBHKXPYKUQWOLN-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD COc1ccc(S(=O)(=O)NC2CNC2)c([N+](=O)[O-])c1 90289294 QFDUTGZPBYUKLP-UHFFFAOYSA-N 287.297 -0.147 5 20 CBBD C[C@@H](CN(C)C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C(=O)O 262926628 FRADTJGWUIVVIG-QMMMGPOBSA-N 297.267 -0.064 5 20 CBBD COC[C@@]1(C)NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 269448535 VGMYQGOXLANUSE-LLVKDONJSA-N 297.271 -0.252 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 292424423 CNLMJHMQYQHIBO-BQBZGAKWSA-N 256.218 -0.539 5 20 CBBD C[C@H](O)CN(CCO)CCn1cc([N+](=O)[O-])cn1 351939902 XQZRSNRPWBOMDF-VIFPVBQESA-N 258.278 -0.534 5 20 CBBD CC(C)(C(=O)N1CC(CC(N)=O)C1)n1cc([N+](=O)[O-])cn1 358108649 GYSVNOYQLGQVND-UHFFFAOYSA-N 295.299 -0.140 5 20 CBBD N[C@H]1C[C@H]2CN(c3ccc([N+](=O)[O-])cn3)CCN2C1=O 575331431 WHJWSATYOSJZES-UWVGGRQHSA-N 277.284 -0.262 5 20 CBBD COc1ccc(CC(=O)NC2=NCC(=O)N2)cc1[N+](=O)[O-] 609044851 QEGBNDHGQDHOKR-UHFFFAOYSA-N 292.251 -0.252 5 20 CBBD C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1N)C(=O)NC(N)=O 758952612 DYCPEMORWBIEPV-RXMQYKEDSA-N 296.239 -0.083 5 20 CBBD CN1CCC(ONC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 773543731 WIAKSCXOMJPIRD-UHFFFAOYSA-N 283.288 -0.067 5 20 CBBD C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CN1CCOCC1 839688422 RIABMOYYACHQMX-HBNTYKKESA-N 271.317 -0.264 5 20 CBBD Cn1cnc([N+](=O)[O-])c1-n1cnnc1[S@@](C)=O 1318479698 JJLXYZOZIWLGKO-QGZVFWFLSA-N 256.247 -0.354 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCCC(=O)NC1CC1 1319903440 NGWAOEXHKBGBRH-UHFFFAOYSA-N 296.287 -0.639 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)c1c([N+](=O)[O-])cnn1C 22238430 PFHROZRJFDWCQJ-SECBINFHSA-N 297.315 -0.221 5 20 CBBD O=C(NCc1ccc([N+](=O)[O-])cc1)c1n[nH]c(=O)[nH]1 48737296 MHSYQNQUDIYKMM-UHFFFAOYSA-N 263.213 -0.064 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCOC[C@H]1C(=O)O 88381061 VGMLQJSFLAPECP-VIFPVBQESA-N 284.272 -0.115 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(F)(F)CN 190309582 XUERRDFCLFOQDU-UHFFFAOYSA-N 277.231 -0.190 5 20 CBBD Cn1nnnc1CNC(=O)COc1ccccc1[N+](=O)[O-] 276708289 ZGLVCHAZNMFMQG-UHFFFAOYSA-N 292.255 -0.187 5 20 CBBD CC(C)(C(=O)N[C@H](CO)C(N)=O)c1ccccc1[N+](=O)[O-] 354205158 GOZJVPFQTOEEML-SECBINFHSA-N 295.295 -0.165 5 20 CBBD O=C(NC[C@H]1CC[C@H](CO)O1)c1cnc(O)c([N+](=O)[O-])c1 356529429 URGNMPQQRULKNJ-RKDXNWHRSA-N 297.267 -0.035 5 20 CBBD CN1CC[C@](O)(CNc2ncc([N+](=O)[O-])c(N)n2)C1 358342515 SCFUJUXLAZRQKZ-JTQLQIEISA-N 268.277 -0.555 5 20 CBBD CO[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H](CN)C1 359211929 KAUDIHNENVQUEZ-VHSXEESVSA-N 297.315 -0.244 5 20 CBBD C[C@@H]1[C@@H](CO)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 488810944 WUCCSYUSPSLFCE-FOGDFJRCSA-N 284.316 -0.145 5 20 CBBD Cn1ccc(C(=O)NCCn2cc([N+](=O)[O-])cn2)cc1=O 492843980 CYEPQPYJXVOZEL-UHFFFAOYSA-N 291.267 -0.080 5 20 CBBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C)NC1=O 540881448 SMQDRDKBIZPHNP-SNVBAGLBSA-N 278.268 -0.022 5 20 CBBD C[C@H](O)[C@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 595765595 JQRKEAHDYVJREI-ZMLRMANQSA-N 284.316 -0.003 5 20 CBBD Cn1ncnc1C(=O)NCCn1cc([N+](=O)[O-])cn1 596430346 IWILYFGJUKOWKN-UHFFFAOYSA-N 265.233 -0.650 5 20 CBBD CN(CC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)C1CC1 610874548 GIIFDJBMHBSUSA-UHFFFAOYSA-N 295.299 -0.224 5 20 CBBD Nc1ccc(NC(=O)N2C[C@@H](CO)[C@@H](O)C2)cc1[N+](=O)[O-] 823926987 KACPMDUJTCDSKT-CPCISQLKSA-N 296.283 -0.006 5 20 CBBD O=C(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])N=c1cc[nH]cc1 839619327 UEZVZYMLGYQKLM-NXEZZACHSA-N 278.268 -0.387 5 20 CBBD CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)(C)C1=O 839700500 IXRMMABGKKVSJU-HTQZYQBOSA-N 255.274 -0.269 5 20 CBBD NC(=O)CC(=O)NC/C=C/CNc1ncccc1[N+](=O)[O-] 1107087698 JIQOTNUCFQHZNN-OWOJBTEDSA-N 293.283 -0.051 5 20 CBBD CCc1nncn1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319606071 DNAFEXMEQDBGRY-UHFFFAOYSA-N 279.260 -0.098 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCOC[C@@H]1CC(=O)O 1323454754 MZKWTYNQNCSGNH-ZETCQYMHSA-N 298.255 -0.356 5 20 CBBD CN(CCNCc1cncn1C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1753188102 JFKMMHJANVZGTO-GHMZBOCLSA-N 281.316 -0.367 5 20 CBBD COc1ccc(S(=O)(=O)NCCO)cc1[N+](=O)[O-] 11804449 GNRVNKIPRONSNR-UHFFFAOYSA-N 276.270 -0.126 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])n1C 110516112 OAVIDEDQQLDPOD-ZETCQYMHSA-N 266.257 -0.106 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CCOC2)c1 131563091 KGSWCONSTOOJOI-PSASIEDQSA-N 256.262 -0.469 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O 181804241 VIYCFVAWKFUPEM-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD O=C1C[C@@H](N(C(=O)c2ccc([N+](=O)[O-])[nH]2)C2CC2)C(=O)N1 263837161 QVFJISUZPMYVSY-MRVPVSSYSA-N 292.251 -0.057 5 20 CBBD NC(=O)[C@H](CO)NC(=O)CSc1ccc([N+](=O)[O-])cc1 286441637 QUWADZLFTUCGCP-VIFPVBQESA-N 299.308 -0.351 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1[C@H](CO)CC[C@@H]1CO 347354847 ZMLMSMLIBZNTOX-TXEJJXNPSA-N 297.311 -0.426 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)OC 351811568 RZMZIKBPOXTCQW-MRVPVSSYSA-N 271.229 -0.159 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@@](C)(C(N)=O)C2)c1[N+](=O)[O-] 358351539 GBSLIGMLRDWSPA-LLVKDONJSA-N 281.272 -0.036 5 20 CBBD CCc1nn(C)c(NCCn2ncnn2)c1[N+](=O)[O-] 361044376 HZWCSBDVVHQUEM-UHFFFAOYSA-N 266.265 -0.011 5 20 CBBD CN1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CCC1=O 598293838 LXOJUFLXEWMNGV-UHFFFAOYSA-N 281.272 -0.367 5 20 CBBD COc1ccc(CC(=O)N2C[C@H](O)[C@@H](O)C2)cc1[N+](=O)[O-] 600216670 ATGJTLHYJLTECX-QWRGUYRKSA-N 296.279 -0.290 5 20 CBBD CC1=NNC(=O)[C@H]1CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 609620274 DTJPPKRXCSELSF-LURJTMIESA-N 279.260 -0.687 5 20 CBBD CNS(=O)(=O)[C@H]1CCCN(CC[N+](=O)[O-])C1 929980436 FCVXMJVHAVSAPV-QMMMGPOBSA-N 251.308 -0.723 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)Cc1ccccc1[N+](=O)[O-] 35160449 YZBQGVGRTRGYBD-SECBINFHSA-N 282.252 -0.213 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1CCn1cc([N+](=O)[O-])cn1 189608600 NPZIZLIFECWEGZ-WDEREUQCSA-N 298.299 -0.210 5 20 CBBD CO[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 227264127 QQCCEDFTQUMKKW-ZETCQYMHSA-N 272.217 -0.993 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC(=O)O 237146017 WCVDYMLOFOHMTA-UHFFFAOYSA-N 256.218 -0.357 5 20 CBBD CN1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 265631026 FDWYVIHWIDQWJH-SECBINFHSA-N 281.272 -0.520 5 20 CBBD CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])[nH]n1 286010273 IEESAFKKHKVWJT-UHFFFAOYSA-N 255.234 -0.474 5 20 CBBD CN(C[C@@H](O)CO)C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 341972765 ZVBBBYRHKRNXPY-SSDOTTSWSA-N 270.245 -0.771 5 20 CBBD CN(CCC(N)=O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 343517634 DXVZUXKLUXELKZ-UHFFFAOYSA-N 282.256 -0.910 5 20 CBBD Nc1ncncc1CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 444973808 DWFJYTOJTDXEPD-UHFFFAOYSA-N 290.239 -0.002 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1COCCO1 505462957 VWJLKPQOKICMHW-JTQLQIEISA-N 297.267 -0.712 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cn1)C1(CO)CC1 588857271 UMXLYVDVJUSMTM-UHFFFAOYSA-N 254.246 -0.225 5 20 CBBD Nc1ccc(N2CCN3C(=O)[C@H](N)C[C@@H]3C2)nc1[N+](=O)[O-] 596013652 ITVYQHDBMIGKBY-VXNVDRBHSA-N 292.299 -0.680 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)c1c[nH]nc1[N+](=O)[O-] 619786040 CGMBYBUCPAJSSO-UHFFFAOYSA-N 269.261 -0.132 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CNC[C@@H]2O)c1 699891117 CQHRQCYJDDXTRO-ZJUUUORDSA-N 287.297 -0.794 5 20 CBBD CCN(CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])S(C)(=O)=O 839555713 DFQIKJXCLPKUAO-RKDXNWHRSA-N 293.345 -0.561 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCCO 921632832 MXDVTOUPJUJVMT-UHFFFAOYSA-N 268.225 -0.140 5 20 CBBD CC1(CNC(=O)Cn2cnc([N+](=O)[O-])n2)CCNCC1 1118265973 INKIOWWBVOXJMX-UHFFFAOYSA-N 282.304 -0.308 5 20 CBBD O=C(NCCCCCCNCCO)[C@@H]1C[C@H]1[N+](=O)[O-] 1178464730 ZSHNIHDJOMZNKY-GHMZBOCLSA-N 273.333 -0.090 5 20 CBBD CN(C)C(=O)CNC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1200462318 WPNXBRNJASRPAZ-GHMZBOCLSA-N 298.343 -0.680 5 20 CBBD CCN(CC(=O)NC)C(=O)c1c([N+](=O)[O-])c(C)nn1C 1318461267 LSMGIZWBEMOFAD-UHFFFAOYSA-N 283.288 -0.155 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1319752368 JHTBWRNFKYNWQE-YFKPBYRVSA-N 256.218 -0.380 5 20 CBBD CC(=O)NCCc1noc(Cn2cc([N+](=O)[O-])cn2)n1 1321122737 QOINNVQHFZKTMN-UHFFFAOYSA-N 280.244 -0.099 5 20 CBBD CNC(=O)[C@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 1326503824 WDZAYSNVSMJLRD-QWRGUYRKSA-N 283.284 -0.675 5 20 CBBD CO[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C(=O)O)C1 1606751756 ZNIPMBZFZIJGCJ-JQCXWYLXSA-N 272.257 -0.258 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN1CCn1ccc([N+](=O)[O-])n1 188610525 QLKIDKLCHYQBHB-DTWKUNHWSA-N 284.272 -0.601 5 20 CBBD CN(C[C@H](O)CO)C(=O)COc1cccc([N+](=O)[O-])c1 271260822 JOAIDJQRHYQOMM-JTQLQIEISA-N 284.268 -0.215 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2cnn(C)n2)c1 289348419 KMINHYVNPHYHJJ-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD CC(=O)NCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 339408059 PMKAPEUACLEGIG-UHFFFAOYSA-N 296.283 -0.601 5 20 CBBD O=[N+]([O-])c1cnc2ccc(NC[C@H](O)[C@@H]3CCOC3)nn12 347861302 MNASWGARGWMDOF-BDAKNGLRSA-N 293.283 0.447 5 20 CBBD C[C@]1(C(N)=O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 355493039 BAAPOOGUJUUMGU-JTQLQIEISA-N 267.245 -0.345 5 20 CBBD COCC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360738499 PKUBKEAQGPXUPC-LLVKDONJSA-N 286.288 -0.154 5 20 CBBD COC(=O)[C@H](C)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 361636570 IFRPLTLIAVRURD-WCBMZHEXSA-N 286.288 -0.355 5 20 CBBD C[C@@H](N)[C@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 428140236 FCNMLGJHISJGRW-RKDXNWHRSA-N 282.304 -0.085 5 20 CBBD O=C(CCN1C[C@H](O)[C@@H](O)C1)Nc1ccc([N+](=O)[O-])cc1 444695355 MFPUQLIGRFGQCH-RYUDHWBXSA-N 295.295 -0.039 5 20 CBBD Cn1cncc1CCNC(=O)Cn1ccc([N+](=O)[O-])n1 543409522 UFVALPWGVYNDAF-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD N[C@H]1C[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)CCN2C1=O 571702584 NMXGHLKRVDNQGH-KOLCDFICSA-N 294.315 -0.965 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1[C@@H]2CNC[C@@H]12 598917032 QIAGGXCLKFAEAU-NXEZZACHSA-N 290.279 -0.133 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CC[C@](O)(C(=O)O)C1 706461193 WRHVYYJLDIKKNK-LLVKDONJSA-N 284.272 -0.379 5 20 CBBD Nc1ccc(N2CCN(C(=O)CO)CC2)c([N+](=O)[O-])c1 804578810 REVKMIHLPUUUBL-UHFFFAOYSA-N 280.284 -0.182 5 20 CBBD O=C1CN(c2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CCN1 823535926 MNSSASVVYIWTQR-UHFFFAOYSA-N 290.243 -0.894 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)OCCN1CCOCC1 912974757 DDPWHYRIFOIBCN-UHFFFAOYSA-N 284.272 -0.333 5 20 CBBD O=[N+]([O-])CCN1CCN(S(=O)(=O)C2CC2)CC1 931169544 ULWARMUOLLHYHM-UHFFFAOYSA-N 263.319 -0.627 5 20 CBBD CNC(=O)CC(=O)NCCNc1ncc([N+](=O)[O-])cc1F 1093568052 ORDOEADSRHCZSR-UHFFFAOYSA-N 299.262 -0.207 5 20 CBBD COCC(=O)NC/C=C/CNc1ncc([N+](=O)[O-])c(N)n1 1107012863 GMCCXPYHROYROI-NSCUHMNNSA-N 296.287 -0.302 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](CO)[C@H](O)C1 1117121227 CATPCJSFKRMFOD-POYBYMJQSA-N 270.245 -0.867 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN(CCO)CC1 1323226373 RVRSICNWBOYEKZ-UHFFFAOYSA-N 283.288 -0.922 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCNC[C@H]2O)n1 1578349825 AUNJAYLLUWMKQU-VXNVDRBHSA-N 283.288 -0.736 5 20 CBBD CNC(=O)CNC(=O)[C@@](C)(N)c1cccc([N+](=O)[O-])c1 1578554886 SKSUSSYHKNWZBQ-LBPRGKRZSA-N 280.284 -0.369 5 20 CBBD O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC(CO)CO 1607085684 JYNAYSSFANBPAE-UHFFFAOYSA-N 286.273 -0.399 5 20 CBBD CNC(=O)CNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 146220871 PQVAHBCTAOFTGE-UHFFFAOYSA-N 295.251 -0.143 5 20 CBBD CCC(=O)N1CC[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 178330532 HMMUBZZHDUECIG-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CN1CCC[C@@H]1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 300688883 AKWLXJBBBVOYCL-PWSUYJOCSA-N 283.332 -0.164 5 20 CBBD C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[S@]1=O 343730767 XYEUCVAORKHODK-FWCARGHBSA-N 272.286 -0.089 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)[C@H]1CCCO1 344854764 JZWXOZUZRSMUOG-NXEZZACHSA-N 284.272 -0.553 5 20 CBBD O=C1NCCC[C@@H]1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 591735405 YYVMPAMLMHFOKS-MWLCHTKSSA-N 297.315 -0.732 5 20 CBBD Nc1nc(N2CC(N3CC[C@@H](O)C3)C2)ncc1[N+](=O)[O-] 593507523 JUFKDRISGHZMNW-MRVPVSSYSA-N 280.288 -0.778 5 20 CBBD NC(=O)[C@@H]1CN(c2c(Cl)cncc2[N+](=O)[O-])CCN1 596064917 CVKRHCKLCQCMQQ-ZETCQYMHSA-N 285.691 -0.093 5 20 CBBD CN(C[C@@H]1COCCO1)c1ncc([N+](=O)[O-])c(N)n1 596459259 LLJCEUVBHRIWBP-SSDOTTSWSA-N 269.261 -0.181 5 20 CBBD CC1(C)COC(=O)[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 808104462 YMKLCLHZRINANY-SECBINFHSA-N 282.256 -0.141 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 863703579 RYWRMYIDLLYOAR-SSDOTTSWSA-N 285.260 -0.684 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2COCCO2)c1[N+](=O)[O-] 1115983917 DGQPPFQMLDMCMC-SSDOTTSWSA-N 270.245 -0.228 5 20 CBBD O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])n[nH]1 1117102173 CVFLHRDMQKUBRK-ZCFIWIBFSA-N 288.285 -0.518 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCc1nn[nH]n1 1318497099 WTZYCEOLSPGKOE-UHFFFAOYSA-N 296.218 -0.058 5 20 CBBD O=[N+]([O-])c1ncccc1CN1C[C@H](O)[C@@H](CO)C1 1331704530 XORPYKNMBPWODE-ZJUUUORDSA-N 253.258 -0.225 5 20 CBBD C[C@H](CC(N)=O)Nc1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1603463355 ILOSHZKMERNQKN-RXMQYKEDSA-N 292.259 -0.154 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)NCC2CC2)c1=O 27055999 PRTLENFFOJVKPN-UHFFFAOYSA-N 294.267 -0.618 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@@H]1CO 42434129 QXFOMDQUVRXAJF-MRVPVSSYSA-N 254.246 -0.225 5 20 CBBD C[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 49098046 XFIBXYMKNIVVIT-PSASIEDQSA-N 285.304 -0.782 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@@H]1CO 50469798 BJPJKJIFXKXCQG-MRVPVSSYSA-N 254.246 -0.225 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccc(F)cc1[N+](=O)[O-] 227051970 PTVSKZIREABWRR-SECBINFHSA-N 286.215 -0.002 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 227872720 UYFILNUQAVMDPZ-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CN(C)CCO2)n1 331150241 AMIVRDJPELNMKW-SECBINFHSA-N 297.315 -0.128 5 20 CBBD C[C@H]1NC(=O)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337797509 XDNALHFKPRHDLB-RQJHMYQMSA-N 281.272 -0.275 5 20 CBBD COC(=O)[C@@H](C)CNC(=O)Cn1cc([N+](=O)[O-])cn1 338439341 XHKQRZGSVCSNCA-ZETCQYMHSA-N 270.245 -0.283 5 20 CBBD Cn1c(C(=O)Nc2cnn(CC(N)=O)c2)ccc1[N+](=O)[O-] 339370488 YSXARLTYQXCZPH-UHFFFAOYSA-N 292.255 -0.133 5 20 CBBD CCC[C@@H](NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 343476799 NVCAICVFODXXMR-SECBINFHSA-N 283.288 -0.048 5 20 CBBD CNC(=O)CCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 354887959 QTHAEOHBKSICPB-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCNC(=O)C1(C)C 408051317 JIAFTRLIBGUEAA-UHFFFAOYSA-N 281.272 -0.321 5 20 CBBD COC(=O)CNC(=O)CNC(=O)c1ccccc1[N+](=O)[O-] 538832705 FNCJKBOZFWBRFR-UHFFFAOYSA-N 295.251 -0.386 5 20 CBBD Nc1cc(N2C[C@H](O)C[C@H]2CO)cc(CO)c1[N+](=O)[O-] 588008412 RNOBPNXODHKSAC-VHSXEESVSA-N 283.284 -0.399 5 20 CBBD Nc1ccc(N2C[C@H](O)C[C@@H]2CO)nc1[N+](=O)[O-] 596178833 LRSZSKVDNXIPNJ-RNFRBKRXSA-N 254.246 -0.496 5 20 CBBD CC(=O)NC[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CCO1 609802877 XJUURDUWLREELP-JTQLQIEISA-N 297.315 -0.022 5 20 CBBD COC[C@H](NC(=O)c1ccccc1[N+](=O)[O-])C(N)=O 760043556 DESXRRVVILQCFI-QMMMGPOBSA-N 267.241 -0.175 5 20 CBBD CC(=O)OCCNC(=O)Cn1cc([N+](=O)[O-])cn1 798256582 KJBZAUPYFVBXAQ-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD C[C@H]1CN[C@H](C)CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 923362403 SMOJBSPALHTUBF-JFGNBEQYSA-N 283.332 -0.166 5 20 CBBD O=C(NC1CN(C(=O)Cc2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991276375 CZJWDDUJULLSRU-NXEZZACHSA-N 294.267 -0.791 5 20 CBBD O=C(NC[C@H]1C[C@H]1C(=O)O)c1n[nH]cc1[N+](=O)[O-] 1601529428 VJHNRHPYUQSJHA-RFZPGFLSSA-N 254.202 -0.232 5 20 CBBD NC(=O)[C@@H]1CN(c2ncccc2[N+](=O)[O-])CCN1 11174004 CPFKWUMDYMOUAS-ZETCQYMHSA-N 251.246 -0.747 5 20 CBBD CN(CCC(=O)O)C(=O)Cn1cc([N+](=O)[O-])cn1 37931723 VZIIADQQEKXLPQ-UHFFFAOYSA-N 256.218 -0.276 5 20 CBBD CNC(=O)C(C)(C)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 230396133 DQFLBSRNRQGPAP-JTQLQIEISA-N 299.331 -0.486 5 20 CBBD Nc1ccc(C(=O)NCCN2CCNCC2)cc1[N+](=O)[O-] 238108031 STVYGQQJRDEBGC-UHFFFAOYSA-N 293.327 -0.188 5 20 CBBD O=C(NN1CCCNC1=O)c1ccc([N+](=O)[O-])[nH]1 272911816 HXBASGDWAXLNLZ-UHFFFAOYSA-N 253.218 -0.017 5 20 CBBD C[C@H](O)CN1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 275124654 INJQVYKKTAUNGK-JTQLQIEISA-N 297.315 -0.684 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCN(C)C1=O 330877250 XMTTWTQFZFAKCI-MRVPVSSYSA-N 281.272 -0.553 5 20 CBBD COC[C@@](C)(CCO)NC(=O)c1cc([N+](=O)[O-])nn1C 360670718 YZYYFQAASMRQGU-LLVKDONJSA-N 286.288 -0.154 5 20 CBBD CO[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@H]1OC 487042704 HDCUMNRUNBTKQY-NXEZZACHSA-N 296.283 -0.061 5 20 CBBD CC(=O)N1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1 548711526 JYZUSXZTHFSWAO-UHFFFAOYSA-N 293.283 -0.124 5 20 CBBD CN(C)CCOCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 554863487 KCTSNDSNENJWQG-UHFFFAOYSA-N 271.277 -0.374 5 20 CBBD CO[C@@H]1COC[C@H]1Nc1nccc(C(N)=O)c1[N+](=O)[O-] 574985253 PXLQILOQXKEHNC-HTQZYQBOSA-N 282.256 -0.086 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCOCCN1 597708175 YHJQSXZXDUXCSQ-UHFFFAOYSA-N 255.234 -0.845 5 20 CBBD Cn1ccnc1CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 839663679 UQYDJKAHHFCISK-GHMZBOCLSA-N 293.327 -0.271 5 20 CBBD NC(=O)C1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCC1 839682242 BEAYDLYZVBPMKR-HTQZYQBOSA-N 255.274 -0.187 5 20 CBBD CC(C)(COC(=O)CN1CCCS1(=O)=O)[N+](=O)[O-] 851124902 PDFDPPCSLYKVHU-UHFFFAOYSA-N 280.302 -0.380 5 20 CBBD Cc1[nH]nc(C(=O)NOCCN(C)C)c1[N+](=O)[O-] 854945143 CNYCNPMNDAYSIL-UHFFFAOYSA-N 257.250 -0.151 5 20 CBBD CS(=O)(=O)NC[C@@H]1CCCCN1CC[N+](=O)[O-] 929257732 VPBBPFNLLFSVRA-VIFPVBQESA-N 265.335 -0.333 5 20 CBBD CCC(=O)N1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1 959768951 FTKBHGWZUHOQEJ-LMLFDSFASA-N 281.312 -0.022 5 20 CBBD CNC(=O)NCC(=O)NCCNc1ncccc1[N+](=O)[O-] 1094204450 QJOJONKLQKIKCO-UHFFFAOYSA-N 296.287 -0.553 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@](F)(C(=O)O)C1 1116789148 RMJPKHYWUONKIH-SNVBAGLBSA-N 286.219 -0.033 5 20 CBBD CC(=O)NCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1317978773 KAGRVMNECMYQQD-UHFFFAOYSA-N 269.261 -0.497 5 20 CBBD C[C@@H](CCCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1327121770 RBOLYYKSTPDXLD-ZETCQYMHSA-N 256.266 -0.570 5 20 CBBD O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H](CO)C(=O)O 1601283266 UPTQFORVBKQSBM-QMMMGPOBSA-N 298.251 -0.075 5 20 CBBD COC(=O)[C@H](CO)NC(=O)Cc1ccccc1[N+](=O)[O-] 35160450 YZBQGVGRTRGYBD-VIFPVBQESA-N 282.252 -0.213 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1c1ncc([N+](=O)[O-])cn1 40454167 ZPZLFBLCBYOCBN-RNFRBKRXSA-N 254.202 -0.591 5 20 CBBD CCCCNC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 42650110 QZDKKIOFJNFHBA-UHFFFAOYSA-N 296.283 -0.228 5 20 CBBD NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CC(O)C1 78774333 MXDNGGQGDVKUAA-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD C[C@H](CO)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 86631477 SVJSQCXZWBDCHG-WCBMZHEXSA-N 258.278 -0.630 5 20 CBBD C[C@H]1C(=O)N(C)CCN1CCn1cc([N+](=O)[O-])ccc1=O 186991869 IZLRNPBRRGMSDE-JTQLQIEISA-N 294.311 -0.081 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN(CCO)C2CC2)c1 266543055 QWHIJIVGYOCZKV-NSHDSACASA-N 270.289 -0.391 5 20 CBBD CC[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1O 271011002 ZTRCZUQHSIEYRD-USWWRNFRSA-N 284.316 -0.145 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 276609501 MZLPNEJOYKRJNQ-MRVPVSSYSA-N 283.288 -0.226 5 20 CBBD Cc1[nH]nc(C(=O)N(C)C[C@H](O)CO)c1[N+](=O)[O-] 353976930 SGKAHFWYMVKLBP-LURJTMIESA-N 258.234 -0.948 5 20 CBBD CCN(C)C(=O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 360971883 XDLUPVKDRBCBKE-UHFFFAOYSA-N 269.261 -0.166 5 20 CBBD CN1CCC[C@H](N2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 365334303 ISIWMHYSQCINBC-YNEHKIRRSA-N 296.371 -0.110 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OC[C@@H]1CNC(=O)O1 495714460 AZULBHJPYFBOJE-YFKPBYRVSA-N 270.201 -0.407 5 20 CBBD Cc1nc2n(n1)CCN(C(=O)c1c[nH]nc1[N+](=O)[O-])C2 548954815 SGGDJCFQDUICMN-UHFFFAOYSA-N 277.244 -0.126 5 20 CBBD CN1C(=O)C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1=O 563399855 WNRSAOMVJDAYQO-VIFPVBQESA-N 293.235 -0.213 5 20 CBBD CC(=O)CNC(=O)[C@@H](C)Sc1ncc([N+](=O)[O-])c(N)n1 573863349 OTVZWLQCWXTVJZ-ZCFIWIBFSA-N 299.312 0.153 5 20 CBBD CCNCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 592459632 OIWXWISQFJHECQ-UHFFFAOYSA-N 255.278 -0.093 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 763712253 VCXOYYASBFVUQJ-SECBINFHSA-N 297.267 -0.560 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC=CCN2)c1 923429517 WFMLKGVBEIKLRA-SNVBAGLBSA-N 253.262 -0.471 5 20 CBBD CCc1nnc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1157766908 BOHGPDRVILRMFZ-RKDXNWHRSA-N 297.315 -0.107 5 20 CBBD NC(=O)N1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 1328355186 BRCXRHLKWXZGKD-MRVPVSSYSA-N 296.287 -0.549 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC([C@@H](O)C(=O)O)CC1 1610611389 RGZPZYPAHHXNIZ-MRVPVSSYSA-N 284.272 -0.010 5 20 CBBD Cc1noc(CNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)n1 38034835 HWBKIACPBJWDKT-SECBINFHSA-N 282.260 -0.367 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1ccc([N+](=O)[O-])[nH]1 40507977 JKFOIGPUSWFUAZ-UHFFFAOYSA-N 281.272 -0.916 5 20 CBBD CC(CO)(CO)NC(=O)COc1ccccc1[N+](=O)[O-] 126211002 ZGQQDPWHLOHUEQ-UHFFFAOYSA-N 284.268 -0.167 5 20 CBBD NC(=O)Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O 130631971 LNYOTPAREVKRKU-UHFFFAOYSA-N 264.197 -0.103 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCCC[C@H]2CO)c1 247450789 HLLCNTBHELPHFV-CMPLNLGQSA-N 284.316 -0.001 5 20 CBBD Cc1nc(N2CCN[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-] 268521861 VEJLSXYJLNFPKB-MRVPVSSYSA-N 265.273 -0.438 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)[C@@]1(CO)CCOC1 330910532 VLTRLOUEYRYOGX-LLVKDONJSA-N 270.289 -0.126 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@H](O)C(=O)OC)c1[N+](=O)[O-] 345312374 YUMMPGONKWWLPT-LURJTMIESA-N 286.244 -0.856 5 20 CBBD C[C@H](N)[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 351829395 BDSDGIPHAGDOFA-DTWKUNHWSA-N 267.289 -0.013 5 20 CBBD O=C(CNC(=O)C1CC1)NCCn1cc([N+](=O)[O-])cn1 532681444 QGXSVERUADJGTN-UHFFFAOYSA-N 281.272 -0.566 5 20 CBBD CN1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C(=O)N1 537579723 BQPUCIRYDRRIHD-SNVBAGLBSA-N 278.268 -0.401 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NCCCN1CCNC(=O)C1 611100910 QNPDIKMIADGXAU-UHFFFAOYSA-N 282.304 -0.438 5 20 CBBD CNC(=O)NC(=O)[C@@H](C)OC(=O)c1c([N+](=O)[O-])cnn1C 766966625 NDPNQMNNUZPIOQ-RXMQYKEDSA-N 299.243 -0.671 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 793899459 WOOFIBAPRPVSCU-LURJTMIESA-N 281.228 -0.717 5 20 CBBD CC(C)[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(=O)O 820043615 BHDAZIZSHAAVNW-VHSXEESVSA-N 286.288 -0.149 5 20 CBBD Cc1nnc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)n1C 1116469142 YJJLCUGXJAOROD-UHFFFAOYSA-N 279.260 -0.455 5 20 CBBD NCCCCNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1118269912 PJTOFEVTOFYOEG-UHFFFAOYSA-N 268.273 -0.388 5 20 CBBD CCn1c(C)nnc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126932019 FIILYHZOEFMGKE-NXEZZACHSA-N 296.331 -0.523 5 20 CBBD O=C(O)[C@@H](CO)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1574817382 BPOOJTNRCFGWLC-RKDXNWHRSA-N 284.224 -0.810 5 20 CBBD NC(=O)[C@H]1CN(c2cc(C(=O)O)ccc2[N+](=O)[O-])CCO1 1601145259 BIEBLBFIVLFKHA-SNVBAGLBSA-N 295.251 -0.017 5 20 CBBD Cc1nn(C)c(N2CC[C@@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1608002077 QRQVQXQOQKGICE-JTQLQIEISA-N 270.245 -0.337 5 20 CBBD Cn1cnnc1CNC(=O)c1cc([N+](=O)[O-])cnc1O 127907362 FBBJYNFHLBDDQY-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)O1 268430546 ZBYIVYYKXDPQFA-HTRCEHHLSA-N 282.256 -0.314 5 20 CBBD CC(C)(C(=O)N1CC(CO)C1)n1cc([N+](=O)[O-])cn1 331833587 YMIYHYXNKIFIOO-UHFFFAOYSA-N 268.273 -0.023 5 20 CBBD NC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1Cl 353000155 BUSYHCZIFZLFMO-MRVPVSSYSA-N 287.659 -0.176 5 20 CBBD Nc1nc(N2CC[C@@H]3NC(=O)OC[C@H]3C2)ncc1[N+](=O)[O-] 495281977 QZDOZEBRWGDCDO-RQJHMYQMSA-N 294.271 -0.098 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 565195031 LSGMXKVFVVUHII-LLVKDONJSA-N 298.255 -0.774 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H](CO)C2CC2)c1 565422054 LCMQNVNIFKNXAX-JQWIXIFHSA-N 284.316 -0.240 5 20 CBBD Cc1[nH]nc(C(=O)N2CC[C@H](CC(N)=O)C2)c1[N+](=O)[O-] 588805590 NYOIQAVDBLPAGQ-SSDOTTSWSA-N 281.272 -0.036 5 20 CBBD Cc1csc(=NCCN=c2nc(N)c([N+](=O)[O-])c[nH]2)[nH]1 596265770 MBPHKZWRJADSIG-UHFFFAOYSA-N 295.328 0.100 5 20 CBBD O=C(O)COCCNC(=O)CCn1cc([N+](=O)[O-])cn1 600877547 SSPCFSVFFOMLFK-UHFFFAOYSA-N 286.244 -0.601 5 20 CBBD C[C@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)S(C)(=O)=O 748116125 LXMCRZHMAWULRR-SSDOTTSWSA-N 291.285 -0.232 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCN1CCNC1=O 766627477 CSGCTBDGBMHOMS-UHFFFAOYSA-N 283.244 -0.490 5 20 CBBD O=C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CN1CC1CC1 839749336 RAHYTYYDAVNVLQ-RKDXNWHRSA-N 253.258 -0.310 5 20 CBBD COC(=O)c1cnn(CC(=O)OCCC[N+](=O)[O-])c1 860922372 OYXWOSHZYCNOHH-UHFFFAOYSA-N 271.229 -0.120 5 20 CBBD CCCCC(=O)N1CC(O)(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1042974476 GFVMBAZGIMHNQL-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD O=C1C[C@H](Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])CN1 1346828028 IMXZBSUOKBELJF-YFKPBYRVSA-N 255.190 -0.164 5 20 CBBD O=C(O)CN1CCC(NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1595079920 XXWSIVWVLOTKMG-UHFFFAOYSA-N 297.271 -0.403 5 20 CBBD O=C(O)[C@@H](C[C@@H]1CCCO1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608534541 ZOIIRBFREXZWET-JQCXWYLXSA-N 272.257 -0.210 5 20 CBBD C[C@H](NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1)C(N)=O 35149041 DPGLKEPLFUQTKY-YFKPBYRVSA-N 289.269 -0.548 5 20 CBBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)CNC(=O)CN 37810275 OAWHNLHXEMRHNJ-UHFFFAOYSA-N 280.284 -0.372 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[C@@H](O)C1 48439777 UBIQYUAKYTYGGY-MRVPVSSYSA-N 254.246 -0.225 5 20 CBBD COCCNC(=O)NCCn1cc([N+](=O)[O-])cn1 128405653 XAKYPYMIKUGFRL-UHFFFAOYSA-N 257.250 -0.263 5 20 CBBD COCCN(CCOC)C(=O)Cn1ccc([N+](=O)[O-])n1 128568843 ODAVBSPYZHDOMO-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)Cn1ccc([N+](=O)[O-])n1 154278277 OMNMJIUYFMIMEO-UHFFFAOYSA-N 283.288 -0.320 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](CN)C1CC1 159113044 SSTARJRCWNGEQV-SECBINFHSA-N 267.289 -0.047 5 20 CBBD C[C@@H](NC(=O)NCCn1cc([N+](=O)[O-])cn1)C(=O)N(C)C 178436507 SRVBPIHMGNBQSY-MRVPVSSYSA-N 298.303 -0.433 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@]1(O)CCOC1 229690403 BQPANIVAIQFKHH-JTQLQIEISA-N 270.245 -0.941 5 20 CBBD CCN(C[C@@H](C)O)C(=O)Cn1cnc([N+](=O)[O-])n1 341341507 DHTTVHGBYWNHBU-SSDOTTSWSA-N 257.250 -0.584 5 20 CBBD CNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 344273555 KLCMAHJQVBZFOM-UHFFFAOYSA-N 268.229 -0.487 5 20 CBBD CC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 346445509 MVSZJKANXMNQQC-UHFFFAOYSA-N 252.230 -0.117 5 20 CBBD C[C@@H]1CCN[C@H](C)[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 357295159 JTWOCKPBKPGEJD-MRTMQBJTSA-N 282.304 -0.311 5 20 CBBD O=[N+]([O-])c1ccnn1CCN1CCCS1(=O)=O 448107843 NFHQAAHZEBMQRJ-UHFFFAOYSA-N 260.275 -0.173 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H]2C[C@H](N)C2)c([N+](=O)[O-])n1 479771852 NMVHJRBDTNHTQJ-LJGSYFOKSA-N 289.317 -0.421 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CCNC1=O 535497151 SZIMNVAWHFDAEC-MRVPVSSYSA-N 266.257 -0.106 5 20 CBBD Nc1nccc(C(=O)N2CC(=O)N(C3CC3)C2)c1[N+](=O)[O-] 553239538 PYTNPVIRUROLFD-UHFFFAOYSA-N 291.267 -0.024 5 20 CBBD NC[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CCO1 570515231 JWJAFOTWYFTTGC-MRVPVSSYSA-N 280.284 -0.023 5 20 CBBD CNC(=O)C[C@@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-] 576171687 UECMETBKLRVWLM-SSDOTTSWSA-N 295.299 0.286 5 20 CBBD O=C(CCNc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 600216741 DLGZWSXQJTXDNB-RYUDHWBXSA-N 295.295 -0.039 5 20 CBBD CCOC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCO1 862956469 XROUPDUHCMBDFY-IVZWLZJFSA-N 258.274 -0.085 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1=COCCC1 990431098 JTGQCEGZWOKHDU-GHMZBOCLSA-N 295.295 -0.327 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCc1nc[nH]n1 1141333313 PZJDJHHNNVCEKC-UHFFFAOYSA-N 293.287 -0.033 5 20 CBBD COC[C@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319847902 QGXIBEHJZYHJBC-SECBINFHSA-N 258.234 -0.555 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)c1c([N+](=O)[O-])cnn1C 1324732358 MFOHLCITCPTEPL-JGVFFNPUSA-N 284.272 -0.450 5 20 CBBD O=C(NC[C@H](O)CN1CCCC1=O)c1ccc([N+](=O)[O-])o1 1334171085 GMCFITVHNKEBEP-QMMMGPOBSA-N 297.267 -0.099 5 20 CBBD NC(=O)c1ccnc(N2C[C@@H]3CNC[C@H]3C2)c1[N+](=O)[O-] 1347396318 SHEQRWOIWTXDTA-YUMQZZPRSA-N 277.284 -0.256 5 20 CBBD CON(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@@H](C)C(=O)O 1594038576 XICKBWNWJRGLES-ZETCQYMHSA-N 299.239 -0.380 5 20 CBBD Cn1c(CCC[N+](=O)[O-])nnc1N1CC[C@H](C(=O)O)C1 1600913109 IIYBFLGFHJBRAG-QMMMGPOBSA-N 283.288 -0.065 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1C[C@@H](C(=O)O)C[C@@H](O)C1 1608159403 QSMVLVIPCHDPNU-NKWVEPMBSA-N 270.245 -0.400 5 20 CBBD Nc1c(C(=O)N2CCNC(=O)C2)cc(F)cc1[N+](=O)[O-] 48754992 WPJZDMHPGVXHDJ-UHFFFAOYSA-N 282.231 -0.112 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 48812614 GEGODZZOCQZWRB-ZCFIWIBFSA-N 255.234 -0.958 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCC(C)(C)C(N)=O 68217093 WGSLQYVONAOCNH-UHFFFAOYSA-N 283.288 -0.273 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C[C@@H](CO)O1 229997273 PVWLNXBPDSLTPV-CBAPKCEASA-N 297.267 -0.083 5 20 CBBD O=C(NCCN1C(=O)CNC1=O)c1csc([N+](=O)[O-])c1 265009024 UIPBXZAASDORLP-UHFFFAOYSA-N 298.280 -0.062 5 20 CBBD COCCN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1=O 271120403 HWDNTSGQTRRFIW-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H](C)O 276029702 UDCMFDHCGGBSSU-LHLIQPBNSA-N 298.251 -0.047 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)Nc1nn[nH]n1 350099044 MMHNZQIAFAXXLO-UHFFFAOYSA-N 250.178 -0.663 5 20 CBBD CNC(=O)CCN(C)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] 354890164 TYTSGKQTSAHMLM-UHFFFAOYSA-N 269.261 -0.166 5 20 CBBD CC(=O)N1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 408310140 QMKZQLATRQSWPB-UHFFFAOYSA-N 267.289 -0.008 5 20 CBBD COC(=O)C1(C)CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 424141989 XYZAJFAAJABYAI-JTQLQIEISA-N 298.299 -0.353 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 554876051 DOTIZQOKESQCRA-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD COCCN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])n[nH]1 592366995 YATZNFLVJCHSNT-UHFFFAOYSA-N 272.217 -0.509 5 20 CBBD CC1(C)CNCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 592473465 QSZIOHXLXRMQOZ-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD O=[N+]([O-])c1cnn(CCN2CCC(NCCO)CC2)c1 601328019 DRPQBYSLSHSFGJ-UHFFFAOYSA-N 283.332 -0.162 5 20 CBBD NS(=O)(=O)c1c(N2CC(O)C2)cccc1[N+](=O)[O-] 609797248 ZZXXSBUVYDDTFG-UHFFFAOYSA-N 273.270 -0.577 5 20 CBBD CNC(=O)[C@H](O)CNc1ncc(C)cc1[N+](=O)[O-] 758127559 WODJXZUUEVTGME-MRVPVSSYSA-N 254.246 -0.183 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC)C(N)=O 760060819 QDXALBRYFHXUDY-VIFPVBQESA-N 297.267 -0.167 5 20 CBBD CCc1ccc(C(=O)NC[C@H](O)C(=O)NC)cc1[N+](=O)[O-] 763726782 TYMWJXKZZAAMNH-NSHDSACASA-N 295.295 -0.006 5 20 CBBD NC(=O)CCOC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 824673089 DVMMKPZIZIVASU-UHFFFAOYSA-N 295.251 -0.257 5 20 CBBD O=C(O)[C@@H]1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 833188898 JTBLLPQIBMAMPA-MWLCHTKSSA-N 298.299 -0.051 5 20 CBBD C[C@H]1CN(C(=O)COC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 840673049 XDTBDZDMPSDHJV-UTINFBMNSA-N 286.284 -0.169 5 20 CBBD O=C(NS(=O)(=O)c1ccc(F)cn1)[C@@H]1C[C@H]1[N+](=O)[O-] 842375856 PNWLBUNJWZHMAR-RNFRBKRXSA-N 289.244 -0.309 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1 1118835563 QNJVYAUIWMYRRS-MRVPVSSYSA-N 281.272 -0.023 5 20 CBBD Cc1noc(CN2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1333591561 MKOIXKZTVJSWLK-JGVFFNPUSA-N 257.246 -0.181 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)NCC1(N)CCOCC1 1579877552 SSHCGADDAVSMJD-UHFFFAOYSA-N 297.315 -0.276 5 20 CBBD NC(=O)c1ccc(CN2CCNC[C@@H]2CO)c([N+](=O)[O-])c1 1580103195 UXRSVAVYPVNGQO-LLVKDONJSA-N 294.311 -0.540 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC(O)(C(=O)O)CC1 1602624323 YQLITFKODQWYBT-UHFFFAOYSA-N 284.228 -0.630 5 20 CBBD C[C@@](NCC(N)=O)(C(=O)O)c1cccc([N+](=O)[O-])c1 1604332971 NDNUADDSIPLAQL-NSHDSACASA-N 267.241 -0.031 5 20 CBBD C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(N)=O 10518386 XGEXXTIMWDQJTL-LURJTMIESA-N 273.270 -0.253 5 20 CBBD CN(C)C(C)(C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 48771201 JAFCBWKJDFSDNA-UHFFFAOYSA-N 270.293 -0.357 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)NC(CO)CO 73900342 ZKRAMYWSZFKNPP-UHFFFAOYSA-N 269.257 -0.253 5 20 CBBD CC(C)[C@@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 119271901 VGRJWLFLAHBPGS-SECBINFHSA-N 295.299 -0.075 5 20 CBBD CC[C@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 123781660 AQGDIILZGLOQSF-MRVPVSSYSA-N 256.262 -0.013 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@@H](O)C[C@H]1CO 274777145 CTLXASLJEYESDH-QWRGUYRKSA-N 296.279 -0.072 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCCOC1 288553884 ZCHAUVHKCIXGKT-UHFFFAOYSA-N 267.241 -0.037 5 20 CBBD CNC(=O)[C@@H](C)CN(C)C(=O)c1n[nH]cc1[N+](=O)[O-] 343933969 BJMXXKWXPLHXRJ-LURJTMIESA-N 269.261 -0.228 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@@H](O)C1 361894628 XKVMFRJESAQEIA-SSDOTTSWSA-N 253.214 -0.098 5 20 CBBD O=[N+]([O-])c1cnc2ccc(N3C[C@H](O)[C@@H](O)C3)nn12 433806047 OQJRABFTYCVENB-BQBZGAKWSA-N 265.229 -0.821 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CNCCO1 519763151 GCDJATABUJCCQA-JTQLQIEISA-N 283.288 -0.714 5 20 CBBD Cc1nc(N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)ncc1[N+](=O)[O-] 581380850 HGWCRSKCBLGCBF-BDAKNGLRSA-N 292.299 -0.559 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@H]1O 594334603 DEYSARYADLQBBS-POYBYMJQSA-N 266.257 0.025 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)c1ccnc(N)c1[N+](=O)[O-] 598225754 MHLSGQMSFIQGQU-UHFFFAOYSA-N 291.271 -0.027 5 20 CBBD CNC(=O)CC(=O)NCCN(C)c1ncccc1[N+](=O)[O-] 1100067064 XPPWXOXFPLUROV-UHFFFAOYSA-N 295.299 -0.322 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1NC/C=C\CNC(=O)C(N)=O 1107480711 RMWKCWQPXSJTNC-IHWYPQMZSA-N 293.283 -0.132 5 20 CBBD COc1cc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ccn1 1126932211 MIYBTSFVGREXBA-GHMZBOCLSA-N 294.311 -0.039 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])c1)NCC(=O)N1CCCC1 1317772398 WUIATFQNCKHQJO-UHFFFAOYSA-N 281.272 -0.470 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCOC[C@@H]2CC(=O)O)n1 1323454812 NVCBBPJLEIMMGO-ZETCQYMHSA-N 298.255 -0.356 5 20 CBBD COC(=O)NC1CN(c2ncc([N+](=O)[O-])cn2)C1 1324014879 CTEYZNQZCNQHCL-UHFFFAOYSA-N 253.218 -0.071 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CC12CCNCC2 1326131928 CDXYDROJAJNTMC-QMMMGPOBSA-N 280.288 -0.555 5 20 CBBD C[C@H](CC(=O)O)NC(=O)Cn1cnc([N+](=O)[O-])n1 1603124743 OLUGONCMTUFUEJ-RXMQYKEDSA-N 257.206 -0.834 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]2C(=O)O)n1 1608122902 YJWYQWWXJBLWRX-RXMQYKEDSA-N 254.202 -0.373 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CCOC2)c1 131563490 KGSWCONSTOOJOI-WCBMZHEXSA-N 256.262 -0.469 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CCCS(=O)(=O)CC1 220361620 RNHWRVLXEQAGLT-UHFFFAOYSA-N 274.302 -0.047 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1N 276017024 APWOZPRTAVYZFG-VIFPVBQESA-N 283.240 -0.559 5 20 CBBD CN1CCC[C@H](CN(C)C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330804729 LFEKFESFSDJNKC-JTQLQIEISA-N 296.331 -0.014 5 20 CBBD CC(C)(CC(N)=O)NC(=O)Cn1ccc([N+](=O)[O-])n1 348434736 IVHNTWQBBAOYAT-UHFFFAOYSA-N 269.261 -0.439 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCn1ncnn1 352053166 QXFQMFBXUCLWGN-UHFFFAOYSA-N 278.232 -0.813 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC1[C@@H]2CNC[C@@H]12 366532941 SRMOKVRKGGATKE-RKDXNWHRSA-N 265.273 -0.485 5 20 CBBD O=C1OC[C@H]2CN(CCn3ccc([N+](=O)[O-])n3)CCN12 370570843 WUYLMGCIRGSMJZ-SECBINFHSA-N 281.272 -0.072 5 20 CBBD CCC[C@@H](O)[C@H](CO)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 412514777 FBDVKAJTBHLXDO-WCBMZHEXSA-N 299.283 -0.053 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 583947873 ISKJNXTWUBUFAL-YFKPBYRVSA-N 281.228 -0.887 5 20 CBBD C[C@H](O)[C@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 595765591 JQRKEAHDYVJREI-MVWJERBFSA-N 284.316 -0.003 5 20 CBBD Cn1nnnc1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1 596183637 YMLNBDDHNOKBJF-UHFFFAOYSA-N 291.271 -0.128 5 20 CBBD O=C1NCC[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc12 597445597 DXVFSQWXWCNQLF-ZETCQYMHSA-N 289.251 0.546 5 20 CBBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NC(CO)CO 755685193 AMPNIWAABDIDBK-UHFFFAOYSA-N 294.267 -0.586 5 20 CBBD C[C@H]1CN(C)C(=O)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 782866976 HWCIDJAQWJWHJA-VIFPVBQESA-N 295.299 -0.130 5 20 CBBD O=C(CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Nc1cccnc1 839622573 FDAHUWAEMRAIDR-RKDXNWHRSA-N 264.241 -0.199 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H]2CN(C)CCN2C)c1[N+](=O)[O-] 1321717858 HIKGMOIRUNNGAD-VIFPVBQESA-N 296.331 -0.398 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2[C@@H](CO)[C@@H]2C1 1330435200 AQYBYALHMNJZRQ-MYJAWHEDSA-N 278.268 -0.118 5 20 CBBD C[C@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CO1 1349444890 YCHBWEUTLOVERP-BQBZGAKWSA-N 255.234 -0.520 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(C)(C)OCCO 1351705298 IVAYHNWBAYTHEW-UHFFFAOYSA-N 286.288 -0.154 5 20 CBBD COC[C@H]1CN(c2nnc(C[N+](=O)[O-])n2C)CCO1 1355419253 FVIASLUEFODCER-MRVPVSSYSA-N 271.277 -0.557 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC([C@H](O)C(=O)O)CC1 1610611390 RGZPZYPAHHXNIZ-QMMMGPOBSA-N 284.272 -0.010 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])s1 35160521 IWUFYUWQPZQVNW-RXMQYKEDSA-N 274.254 -0.080 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCCO)c1 73528064 WETIIRNUDOSVCZ-UHFFFAOYSA-N 256.214 -0.075 5 20 CBBD CNC(=O)CN(C)C(=O)CCn1cc([N+](=O)[O-])nc1C 299475220 CZDDFPMMYYXZCC-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD CN1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 351157843 AGDQDKQLJUOMLV-VIFPVBQESA-N 293.283 -0.077 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 362425545 ZYFUATDGJJNCBO-GFCCVEGCSA-N 298.251 -0.046 5 20 CBBD CCc1[nH]nc(C(=O)NN2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 776249112 QZIZEZUZCSJUSW-UHFFFAOYSA-N 296.243 -0.581 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnon2)C1 1042710442 CKCXBDPAGZUSFM-NXEZZACHSA-N 281.272 -0.623 5 20 CBBD C[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1O 1324663481 XKHMBRTZHMCQQL-HTRCEHHLSA-N 266.257 -0.094 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC[C@H](c2nc[nH]n2)C1 1335582706 CJJIDNLSSJIWPN-QMMMGPOBSA-N 291.271 -0.075 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[C@](O)(C(=O)O)C1 1601299674 FUVZVIPTAQMUAC-LLVKDONJSA-N 298.255 -0.771 5 20 CBBD O=C(O)[C@@H]1[C@@H](O)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1601752036 OGRMOQGDOKOUHU-BQBZGAKWSA-N 284.228 -0.632 5 20 CBBD O=C(O)[C@H]1[C@H](O)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1601752038 OGRMOQGDOKOUHU-RNFRBKRXSA-N 284.228 -0.632 5 20 CBBD CC(C)(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 171813195 AQZICQMLQRTXJY-VIFPVBQESA-N 283.288 -0.193 5 20 CBBD COC(=O)[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H](C)O 274729575 CLIRSRPYLUEOIM-WKEGUHRASA-N 298.251 -0.047 5 20 CBBD C[C@](O)(CNc1ncc([N+](=O)[O-])cn1)CN1CCOCC1 302155842 MQWGUULQSYPCBX-LBPRGKRZSA-N 297.315 -0.120 5 20 CBBD CNC(=O)N[C@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)C1 332610587 DBBSIDHDJYJZNL-QMMMGPOBSA-N 282.304 -0.168 5 20 CBBD Nc1nc(=NC[C@H](CO)c2cccnc2)[nH]cc1[N+](=O)[O-] 340945298 XRIVSWBBPCGVDG-SECBINFHSA-N 290.283 -0.028 5 20 CBBD CC1(C(N)=O)CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 577222996 VICTZCAQRGMYSP-UHFFFAOYSA-N 279.256 -0.481 5 20 CBBD O=C(O)C1(C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 592992128 WNUHGQLYZKUTTA-UHFFFAOYSA-N 268.229 -0.228 5 20 CBBD O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc12)C1(O)CNC1 595953220 XQCKRSLLHJPHDJ-UHFFFAOYSA-N 277.240 -0.256 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2C[C@H](O)C2)c1 596067399 MDDMCLFZYYKAAL-HGNGGELXSA-N 256.262 -0.735 5 20 CBBD CN1C[C@H](C(=O)OCCn2ccc([N+](=O)[O-])n2)CC1=O 748117856 KNMBTNWUHCROQS-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2nncs2)C1 1042711590 YBPPGHBYOOJTQL-RKDXNWHRSA-N 297.340 -0.154 5 20 CBBD CC1(C(=O)N(CCO)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1057835576 DCDRONXMEBGGPX-NXEZZACHSA-N 299.327 -0.611 5 20 CBBD Cc1[nH]nc(C(=O)NCC[S@@](C)=O)c1[N+](=O)[O-] 1116083410 BYKFOVDJLBYVLF-QGZVFWFLSA-N 260.275 -0.265 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2C(=O)NC[C@@H]2C1 1324604362 HXMFLJGHWJFFKE-ZCFIWIBFSA-N 280.244 -0.833 5 20 CBBD COCc1noc(CN2CCN(CC[N+](=O)[O-])CC2)n1 1332980353 LFZGWECMDABLTJ-UHFFFAOYSA-N 285.304 -0.390 5 20 CBBD CC[S@@](=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 132754093 MJODRRAHPYPXCL-OVWNDWIMSA-N 290.345 -0.490 5 20 CBBD C[C@H](CS(C)(=O)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285562626 RRAHKXDRAKAECH-RXMQYKEDSA-N 276.274 -0.519 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H](CO)[C@@H]1CCCO1 344883223 SMOGOUZOOGPECW-APPZFPTMSA-N 284.272 -0.402 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccnn1 346046383 ZNWGFDWXDLRCFN-UHFFFAOYSA-N 262.229 0.528 5 20 CBBD CN1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])cnc2O)C1 358427195 VJFFTIBGWHCPTQ-GFCCVEGCSA-N 296.283 -0.508 5 20 CBBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1C[C@H](O)C[C@H]1CO 364363687 MREAXHRFDKPDHI-DTWKUNHWSA-N 282.252 -0.132 5 20 CBBD CN(C(=O)Cn1ncn(C)c1=O)c1ccc([N+](=O)[O-])nc1 439296911 NRWQQRJZGHCOKG-UHFFFAOYSA-N 292.255 -0.452 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)OCc1nc(O)n[nH]1 774940262 WYITYMODSCWEBD-UHFFFAOYSA-N 295.211 -0.676 5 20 CBBD C[C@@H](COC(=O)Cc1nc2ncccn2n1)[N+](=O)[O-] 813108716 KZENEOVZRYNUKA-ZETCQYMHSA-N 265.229 -0.125 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1C[C@@H](O)C[C@H]1CO 1320398685 VNMUQZYKUPLNHC-WPRPVWTQSA-N 284.272 -0.865 5 20 CBBD Cn1cc(CN2CCC[C@@](N)(CO)C2)c([N+](=O)[O-])n1 1579961069 AGPWIKIRGIXYOR-NSHDSACASA-N 269.305 -0.386 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(OC2CNC2)CC1 1580806946 KOHOOWZXZYLBLX-GHMZBOCLSA-N 269.301 -0.369 5 20 CBBD CCOC(=O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590766095 NOACLWHYQNHWHL-UHFFFAOYSA-N 267.205 -0.466 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 42319436 OGWDLJCSFURZRV-RXMQYKEDSA-N 269.213 -0.426 5 20 CBBD C[C@@H](N)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 237359317 FCNMLGJHISJGRW-BDAKNGLRSA-N 282.304 -0.085 5 20 CBBD COC[C@](C)(N)CNc1ncc([N+](=O)[O-])cc1C(N)=O 265283704 ZWALFRSZSFSSSA-LLVKDONJSA-N 283.288 -0.136 5 20 CBBD CC1(CNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)OCCO1 269651887 MLTQJEXGQGIPDD-UHFFFAOYSA-N 297.267 -0.364 5 20 CBBD CN1CCN(C(=O)CCn2nccc2[N+](=O)[O-])CC1 286782449 ZBISKFYLYPCCKE-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD CN1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1=O 311237722 XFJVWXXZNQNGMP-UHFFFAOYSA-N 251.246 -0.150 5 20 CBBD COC(=O)c1cc(C)nc(N[C@@H](CO)C(N)=O)c1[N+](=O)[O-] 343248232 IYUGKLAXWGCLBE-ZETCQYMHSA-N 298.255 -0.657 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 345790300 YKJBDBJQYSYHBB-ZCFIWIBFSA-N 281.272 -0.172 5 20 CBBD COCCN(CC(=O)N(C)C)Cc1c([N+](=O)[O-])ncn1C 355791934 UTUPJCDPDHBRFD-UHFFFAOYSA-N 299.331 -0.135 5 20 CBBD Cc1nc(=NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)s[nH]1 362140122 RTSJOJASQXDXNO-UHFFFAOYSA-N 295.280 -0.023 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCc1nc(=O)o[nH]1 447633611 COBUINMUWNVDOD-UHFFFAOYSA-N 293.239 -0.174 5 20 CBBD CNc1nc(C(=O)N2CC(=O)N[C@H](C)C2)ccc1[N+](=O)[O-] 456188107 LCKZKSVXDIPMAY-SSDOTTSWSA-N 293.283 -0.008 5 20 CBBD C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[S@]1=O 558743469 OFINZPUZAQSAHG-AHGSNSTDSA-N 272.286 -0.089 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)c1ccnc(N)c1[N+](=O)[O-] 598179308 YYECZSAPKLBQFE-QMMMGPOBSA-N 296.283 0.059 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H]1C(=O)O 828349914 VLUGYAZGBAPHDR-RQJHMYQMSA-N 283.244 -0.635 5 20 CBBD CON1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1 854861304 ITVUQCCCDPESRN-UHFFFAOYSA-N 283.288 -0.113 5 20 CBBD Cc1nonc1CNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126931841 BKTVTXMGNQEJLR-VXNVDRBHSA-N 269.261 -0.751 5 20 CBBD O=C(C[C@@H]1CC(=O)N1)NCCn1cc([N+](=O)[O-])cn1 1261730814 IIQGIXUSIVKQQK-SSDOTTSWSA-N 267.245 -0.814 5 20 CBBD Cc1nc(Cn2cc(C(=O)OC[C@@H](C)[N+](=O)[O-])nn2)no1 1263475451 IZYVKZYQULBSPK-ZCFIWIBFSA-N 296.243 -0.160 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCN2CCC[C@@H]2C1 1317997159 SSIZHSYTGCGMIM-NXEZZACHSA-N 294.315 -0.071 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NOCCCC(=O)O)n1 1600970044 XVVNLRMHRIFAHF-UHFFFAOYSA-N 272.217 -0.146 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cn1)N1CC(O)(C(=O)O)C1 1602625367 DOCGEYMFPHHKJY-UHFFFAOYSA-N 267.197 -0.739 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](C(=O)O)C[C@@H](O)C2)c1[N+](=O)[O-] 1610404463 UCDJFPGXARPCRH-NKWVEPMBSA-N 298.255 -0.466 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])cn(CC(=O)N(C)C)c1=O 43928802 MQNXCBGFMDHPET-UHFFFAOYSA-N 283.240 -0.369 5 20 CBBD COCCCNC(=O)CN(C)Cn1cc([N+](=O)[O-])cn1 68960090 XVOBHKZIHOPWFO-UHFFFAOYSA-N 285.304 -0.167 5 20 CBBD NC(=O)c1ccc(NC[C@H](O)CO)c([N+](=O)[O-])c1 90281663 HQBRNWYVZHXCKI-ZETCQYMHSA-N 255.230 -0.541 5 20 CBBD O=c1c(Br)cn(C[C@@H](O)CO)cc1[N+](=O)[O-] 128110093 LTTFXGJRZULHSU-RXMQYKEDSA-N 293.073 -0.128 5 20 CBBD COc1nc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 129435988 RKDJVZPBBIPGBQ-UHFFFAOYSA-N 267.205 -0.443 5 20 CBBD CN(C)CCN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 162119593 QOADZFQESKCGBR-UHFFFAOYSA-N 284.320 -0.006 5 20 CBBD Cn1cnn(CC(=O)NCc2ccccc2[N+](=O)[O-])c1=O 178952442 UIIIGHHXAMTSFX-UHFFFAOYSA-N 291.267 -0.194 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 227872714 UYFILNUQAVMDPZ-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD COc1cc(NC[C@@H](O)C(N)=O)c([N+](=O)[O-])cc1OC 228597412 LVMVYRBGLKWWMH-MRVPVSSYSA-N 285.256 -0.130 5 20 CBBD O=C(CN1CSCC1=O)NCCn1cc([N+](=O)[O-])cn1 269072333 FRPZUUUGWLIQPK-UHFFFAOYSA-N 299.312 -0.560 5 20 CBBD Cc1[nH]nc(C(=O)N(C)CC(C)(CO)CO)c1[N+](=O)[O-] 272769446 RXFZDOAJBAABDP-UHFFFAOYSA-N 286.288 -0.311 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)[C@@H]1CO 276024986 SXXGIMLHFJSWIL-MWLCHTKSSA-N 295.295 -0.014 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)[C@H](C)O 276027624 TYAJYEZVEONCMM-WKEGUHRASA-N 298.251 -0.047 5 20 CBBD COCC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 284966978 CVJNZKIBHMHSIX-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])[nH]n1)c1ncn(C)n1 286876821 WGBZURAQICUVKR-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD O=[N+]([O-])c1ccn(CCN2CCn3ncnc3C2)n1 352272078 CHWGFMUWBLQDRO-UHFFFAOYSA-N 263.261 -0.101 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCN1CCC1 356733842 ULDUUYPPAUYWGL-UHFFFAOYSA-N 253.262 -0.236 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1=O 517391496 LNPLGRJUZLEXQQ-ZCFIWIBFSA-N 266.213 -0.590 5 20 CBBD CN1CC[C@@H](OC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 734890179 JPOORBQIHLDVBB-SSDOTTSWSA-N 268.229 -0.435 5 20 CBBD Cn1nccc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020138995 LVFASTPXVUTQAU-CNVPUSNMSA-N 293.327 -0.178 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](S(N)(=O)=O)C1 1318420348 FQQZEHKLSIQQIN-ZCFIWIBFSA-N 275.290 -0.805 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 1319613023 ZYUJOXXMBDBSEQ-MRVPVSSYSA-N 282.304 -0.707 5 20 CBBD COC[C@@H](O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1319656935 HQNIRMPVAHVSTG-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1320689702 KWYNKSDMLWFYSY-ZETCQYMHSA-N 283.288 -0.075 5 20 CBBD COCCNCCNC(=O)c1c([N+](=O)[O-])cnn1C 1328237540 ZDZFDQYUPJGXCO-UHFFFAOYSA-N 271.277 -0.706 5 20 CBBD Cc1cc(F)cc(C(=O)N[C@@H](CO)C(N)=O)c1[N+](=O)[O-] 1328506997 DTVORDMCQOIPOY-QMMMGPOBSA-N 285.231 -0.382 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1c1nnc(CCC[N+](=O)[O-])n1C 1338015512 ODHTVWPDJNIMPA-SECBINFHSA-N 296.331 -0.309 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1n[nH]cc1[N+](=O)[O-] 1344578681 FPFMNGOGFVGHHP-SECBINFHSA-N 256.218 -0.801 5 20 CBBD Cn1c(Cn2cnc([N+](=O)[O-])n2)nnc1N1CCOCC1 1345646550 GOPMMBXUQLAFPK-UHFFFAOYSA-N 294.275 -0.800 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](C(=O)O)C1CC1 54501680 YWLCQNHZBIFYRP-VIFPVBQESA-N 268.229 -0.229 5 20 CBBD O=[N+]([O-])c1cnn(CCN2C[C@@H](O)C[C@H]2CO)c1 186531010 HYFHKAKOLMQRPL-WPRPVWTQSA-N 256.262 -0.781 5 20 CBBD CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H]1OC 332645107 JYVIYLFHWKUPTE-HTQZYQBOSA-N 270.245 -0.196 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CC[C@@H](CO)O1 349622041 AGOMVLYHPPAHED-BDAKNGLRSA-N 284.272 -0.553 5 20 CBBD CNc1c(C(=O)NCC(=O)NCCO)cccc1[N+](=O)[O-] 360941755 GKMYMWXIESZZSO-UHFFFAOYSA-N 296.283 -0.525 5 20 CBBD CCN1C[C@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1=O 391568003 BYGOBVWWGMJEMN-MWLCHTKSSA-N 297.315 -0.637 5 20 CBBD C[C@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)S(C)(=O)=O 533128516 KRBNKOUXQANWMI-RXMQYKEDSA-N 275.290 -0.766 5 20 CBBD Cc1nc(CC(=O)NCCn2cc([N+](=O)[O-])cn2)n[nH]1 597410446 MXWRJCBVRXNUNI-UHFFFAOYSA-N 279.260 -0.423 5 20 CBBD O=[N+]([O-])c1ccc([C@@H](O)CN2C[C@H](O)[C@H](O)C2)cc1 776588661 AJOVJWJPFDTTKD-SDDRHHMPSA-N 268.269 -0.334 5 20 CBBD CON(C)C(=O)CNc1ncc([N+](=O)[O-])c(N)n1 817124791 IEFDDRYEPFBGMS-UHFFFAOYSA-N 256.222 -0.601 5 20 CBBD CC(C)N(CC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 820015363 NRBFJLFEUKTQFA-SNVBAGLBSA-N 286.288 -0.053 5 20 CBBD CC(=O)N1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1017440470 IEZCUWJRICAQFY-GHMZBOCLSA-N 267.285 -0.054 5 20 CBBD COCCN1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 1025775317 OSWCFDBAWWXFDQ-NZFPMDFQSA-N 269.301 -0.656 5 20 CBBD CN(C)C(=O)NCCN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1320110673 VXEZVUMYNSOASM-UHFFFAOYSA-N 298.303 -0.329 5 20 CBBD C[S@@](=O)C1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1321325380 OUHDOHXLSGFJPX-GOSISDBHSA-N 272.286 -0.041 5 20 CBBD CC[C@H](CO)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590448001 HPWBGFMYJAUGAR-RXMQYKEDSA-N 253.222 -0.085 5 20 CBBD NC(=O)[C@H]1CN(c2ncccc2[N+](=O)[O-])CCN1 11174023 CPFKWUMDYMOUAS-SSDOTTSWSA-N 251.246 -0.747 5 20 CBBD C[C@H](CC(=O)O)NC(=O)Cn1cc([N+](=O)[O-])cn1 36981184 DSYHGTIMQIJNFB-ZCFIWIBFSA-N 256.218 -0.229 5 20 CBBD NC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C1CC1 178167886 AWUPAWXSGZJLHW-VIFPVBQESA-N 253.262 -0.355 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@H](CO)O1 191870284 GRCBINWFKFDXNU-NKWVEPMBSA-N 270.245 -0.460 5 20 CBBD CCC(CC)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 195180686 RDIACXKZBHHEGS-UHFFFAOYSA-N 283.288 -0.048 5 20 CBBD C[C@H]1CN[C@H](C)CN1C(=O)Cn1cnc([N+](=O)[O-])n1 237443394 HJLYDTPTBZYAMO-SFYZADRCSA-N 268.277 -0.605 5 20 CBBD NC(=O)COCCNC(=O)c1cc(O)cc([N+](=O)[O-])c1 272655145 FZAKKGWOWHFJDL-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])[nH]n2)O1 285624199 JZQRFFNRSVZSLA-FSPLSTOPSA-N 283.244 -0.919 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CC[C@@H](O)C2)c1 330403383 BYJJXERTCMSEHA-NXEZZACHSA-N 256.262 -0.781 5 20 CBBD COC[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)OC 352093228 NQCPVQCRNPVGMA-QMMMGPOBSA-N 298.255 -0.510 5 20 CBBD COC(=O)[C@@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357434679 CFZIBKPYAJJTHR-NSHDSACASA-N 298.255 -0.575 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCCOCC(N)=O)c1[N+](=O)[O-] 434385165 QDXJRDWTINFJNQ-UHFFFAOYSA-N 299.287 -0.327 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H](N2CCNCC2)C1 563087522 UGWMQIVKCUAHBO-SECBINFHSA-N 294.315 -0.562 5 20 CBBD Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC(C)(C)C(=O)O)n1 600664747 GXAHEMMUHMKWRG-UHFFFAOYSA-N 292.273 -0.530 5 20 CBBD Cn1nncc1C(=O)OCCn1ccc([N+](=O)[O-])n1 798795223 OUZNXEDFPVQRFC-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD CC(C)(CCC(=O)NCCc1nc(N)n[nH]1)[N+](=O)[O-] 854517349 WPUCNLSIJSQNPU-UHFFFAOYSA-N 270.293 -0.119 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H]3CNC[C@H]32)c1 923360884 BMUZJTVFHBEEEO-WCFLWFBJSA-N 295.343 -0.164 5 20 CBBD CSC[C@@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1116667303 MKWXGPWVAIJYBG-ZETCQYMHSA-N 287.297 -0.421 5 20 CBBD NC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCCO1 1118228612 VLQPRVMYSVPSFV-SSDOTTSWSA-N 269.261 -0.492 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1319888546 STKGTKPGEPGECB-YUMQZZPRSA-N 295.299 -0.027 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCN(C=O)CC1 1327914272 UQKFSFAJKOHLAK-UHFFFAOYSA-N 295.299 -0.210 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN[C@@H]3C[C@H]32)nc1 1580876076 ZSVLWUOPANIHGD-RKDXNWHRSA-N 284.297 -0.275 5 20 CBBD O=C(O)[C@H](C(=O)OCCn1cnc([N+](=O)[O-])n1)C1CC1 1594836956 ARCRLSFJMYMMBP-SSDOTTSWSA-N 284.228 -0.160 5 20 CBBD CN(CCO)c1ccc(C(=O)NCC(=O)O)cc1[N+](=O)[O-] 1610118488 OFTRWHQUEIMGDY-UHFFFAOYSA-N 297.267 -0.162 5 20 CBBD O=C(O)Cn1cc(CCn2cnc([N+](=O)[O-])n2)nn1 1610800104 HPHQZECYRFMITB-UHFFFAOYSA-N 267.205 -0.895 5 20 CBBD O=c1[nH]cnc2cc(NC[C@@H](O)CO)c([N+](=O)[O-])cc12 90281616 FHAUKUAPSLFWPS-ZCFIWIBFSA-N 280.240 -0.404 5 20 CBBD C[C@@H](C(=O)NC[C@@H](O)C(N)=O)c1cccc([N+](=O)[O-])c1 228493131 CSRSYQQTVLCPDU-GMSGAONNSA-N 281.268 -0.339 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCOC1 266564197 YXLBUENQGHFVFL-KOLCDFICSA-N 270.289 -0.127 5 20 CBBD NC(=O)CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 338106371 KYRROILPJDVVBY-UHFFFAOYSA-N 281.224 -0.419 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)c1nncn1C 349792198 UJAGCUXZOFXCRM-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 353976716 SBLBFOWMPSHCKO-QMMMGPOBSA-N 298.255 -0.774 5 20 CBBD CCOC(=O)[C@@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 358864899 VVESWVAUTBWJNF-JTQLQIEISA-N 285.260 -0.307 5 20 CBBD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)[C@@H]1C[C@H]1[N+](=O)[O-] 363269611 JCZRKHNBUPKMLK-GWOFURMSSA-N 269.301 -0.369 5 20 CBBD COCC1(O)CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 456090020 VLGNUAILYASHLQ-UHFFFAOYSA-N 298.299 -0.254 5 20 CBBD COC(=O)N1CC(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 496420231 SJQJERDGWLIVGI-JTQLQIEISA-N 299.287 -0.808 5 20 CBBD CNc1nccc(C(=O)NC[C@]2(O)CCOC2)c1[N+](=O)[O-] 553196872 INXRKMPGBSCDBS-GFCCVEGCSA-N 296.283 -0.087 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN1Cc1onc(C)c1[N+](=O)[O-] 595310942 FYFPWRDJWYICQP-SFYZADRCSA-N 285.256 -0.001 5 20 CBBD Nc1nc(N2C[C@H]3CNC[C@@H]3C2)ncc1[N+](=O)[O-] 609075044 MWSUZMIZTRGYGX-RNFRBKRXSA-N 250.262 -0.377 5 20 CBBD CON(C)C(=O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 773752909 RIJRFKMTXCQXEP-UHFFFAOYSA-N 289.269 -0.124 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCc1cnn[nH]1 823624959 MKOQTXLXZMDWGM-UHFFFAOYSA-N 288.231 -0.100 5 20 CBBD CC1(C(=O)NCC2(O)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)CC1 1043375292 LTSSDGATRNGSEO-RKDXNWHRSA-N 297.311 -0.859 5 20 CBBD Cc1nc(NCCNC(=O)CNC(N)=O)ccc1[N+](=O)[O-] 1093500726 IRNRGFWSILBFCQ-UHFFFAOYSA-N 296.287 -0.505 5 20 CBBD O=C(Cn1cncn1)NCCNc1ccc([N+](=O)[O-])cn1 1093621475 LWVRBDGUCAGVSC-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@](C)(C(N)=O)C2)c1[N+](=O)[O-] 1116891759 VIGPUFWMDHKFHO-LBPRGKRZSA-N 295.299 -0.026 5 20 CBBD O=C1C[C@@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)CCN1 1122712355 OLOBQBSRSSBUIJ-ZETCQYMHSA-N 283.244 -0.744 5 20 CBBD Cn1ncnc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767564 QUFNAEFLUUNUGI-RKDXNWHRSA-N 282.304 -0.924 5 20 CBBD CN(C)C(=O)CCNC(=O)c1c([N+](=O)[O-])cnn1C 1253913337 QHLWRISJUFCNBW-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD O=[N+]([O-])c1ncccc1N1CCN2CCOC[C@]2(CO)C1 1339840391 JPVPKFKMKUDNSE-CYBMUJFWSA-N 294.311 -0.127 5 20 CBBD O=C(NCCOCc1cnn[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 1578011134 CJOFZJNESLJPME-HTQZYQBOSA-N 255.234 -0.897 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCNC1 1579877577 UKDBNSREIWISAU-GFCCVEGCSA-N 280.284 -0.248 5 20 CBBD C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1589269180 RPYHTZRDGMDTBJ-HTQZYQBOSA-N 297.271 -0.245 5 20 CBBD O=C(O)[C@@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CCO1 1601846858 XIMDXJXGIXLEAB-QMMMGPOBSA-N 297.223 -0.379 5 20 CBBD O=C1CCC(=O)N1CCn1cc([N+](=O)[O-])ccc1=O 31672673 NPTNKOJNHXHEDF-UHFFFAOYSA-N 265.225 -0.095 5 20 CBBD O=[N+]([O-])c1ccc(CNC(CO)CO)c([N+](=O)[O-])c1 90359877 HZUYKAUQRUEPED-UHFFFAOYSA-N 271.229 -0.054 5 20 CBBD NC(=O)[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCN1 148180513 DEFJPFQHQSZIFC-ZCFIWIBFSA-N 296.312 -0.433 5 20 CBBD COC(=O)[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCO1 157334480 XSAZRFOSTMCJMO-QMMMGPOBSA-N 268.229 -0.237 5 20 CBBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(CCO)CCO 170347986 OXEBGVISRFNURC-UHFFFAOYSA-N 297.267 -0.654 5 20 CBBD CN(C)S(=O)(=O)CCn1cc([N+](=O)[O-])ccc1=O 285279618 UGPOFFXJNYLSNQ-UHFFFAOYSA-N 275.286 -0.352 5 20 CBBD CN(C[C@@H]1CCC[C@H]1O)C(=O)Cn1cnc([N+](=O)[O-])n1 330460486 QXOWMNNTVSUGFX-DTWKUNHWSA-N 283.288 -0.194 5 20 CBBD CNC(=O)N[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 344961373 CMZRLFXQDDVMQH-QMMMGPOBSA-N 296.287 -0.679 5 20 CBBD CCc1[nH]nc(C(=O)NCCNC(C)=O)c1[N+](=O)[O-] 345006679 COFFCRXUIHQYCX-UHFFFAOYSA-N 269.261 -0.254 5 20 CBBD Nc1nc(NC[C@H](O)[C@@H]2CCOC2)ncc1[N+](=O)[O-] 346435954 WHKYLJARYQFQJL-SVRRBLITSA-N 269.261 -0.224 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 354068165 LOMHOSOZZPWIKV-LURJTMIESA-N 269.261 -0.119 5 20 CBBD C[C@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])cn1C 577808618 ZELCBNUTVGFTPE-ZCFIWIBFSA-N 254.246 -0.073 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC[C@@]1(O)CCCOC1 593881494 HRYSDPPGPOYELE-LBPRGKRZSA-N 298.299 -0.161 5 20 CBBD NC[C@@H](O)CCc1cn(-c2ccc([N+](=O)[O-])cn2)nn1 594649833 OAEJRFYHEJJTKC-JTQLQIEISA-N 278.272 -0.177 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN2CC[C@H]1C2 597708706 OYEPWIIDJDTYQW-ZETCQYMHSA-N 251.246 -0.152 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCCNC(N)=O 736110157 IFINWUCNAXGGDG-UHFFFAOYSA-N 267.245 -0.304 5 20 CBBD COCC1(O)CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 836801390 SBAYTUUNLBNMEB-LLVKDONJSA-N 296.279 -0.152 5 20 CBBD CN(C)C(=O)COC1CN(c2c([N+](=O)[O-])cnn2C)C1 892813969 UJHBLNVYNAULJU-UHFFFAOYSA-N 283.288 -0.378 5 20 CBBD NC(=O)CC(=O)NCCCNc1ncccc1[N+](=O)[O-] 1094345668 DSVOBYFPGDRMSB-UHFFFAOYSA-N 281.272 -0.217 5 20 CBBD NC(=O)CC1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 1116894430 KLQQMJCAGYXZJY-UHFFFAOYSA-N 280.240 -0.357 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@@H](CO)[C@H](CO)C1 1118942507 FQFAVUKWIIIQCI-IUCAKERBSA-N 296.279 -0.027 5 20 CBBD NC(=O)C[C@@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1318872570 OBDNEVVRRPWWRB-VIFPVBQESA-N 295.299 -0.095 5 20 CBBD COCCONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1321142524 BQONBQVAMFDKNL-UHFFFAOYSA-N 271.229 -0.549 5 20 CBBD COC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(=O)OC 1323543222 FKNDOZUEQHBONZ-YFKPBYRVSA-N 272.217 -0.764 5 20 CBBD CN(CC(=O)N1CCCC1)c1nnc(C[N+](=O)[O-])n1C 1338837642 HCRQLKBGAVUKDT-UHFFFAOYSA-N 282.304 -0.350 5 20 CBBD O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@]1(O)CCNC1 1580562315 OWBIVVIAVSYJDR-CYBMUJFWSA-N 295.295 -0.186 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1CCN1 1580579112 XHTQCIHSZACPAM-QMMMGPOBSA-N 266.257 -0.765 5 20 CBBD CCOC[C@@H](C(=O)O)N(C)C(=O)c1c[nH]nc1[N+](=O)[O-] 1596876085 SVJKBWKIWYIYPG-ZETCQYMHSA-N 286.244 -0.120 5 20 CBBD CN(CCCN)C(=O)CCn1cc([N+](=O)[O-])cn1 158792992 OPDSRIKWPYMJDS-UHFFFAOYSA-N 255.278 -0.011 5 20 CBBD C[C@@H]1CS(=O)(=O)CCN1CCn1cc([N+](=O)[O-])cn1 174871170 CHYOXCBEYRFMBO-SECBINFHSA-N 288.329 -0.090 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(F)(F)CO 231902598 CBUFDDMMMIGJNJ-UHFFFAOYSA-N 264.188 -0.465 5 20 CBBD NC(=O)c1ccc(NCCn2cc([N+](=O)[O-])cn2)nn1 301701534 DRDYXLZSLTWKTM-UHFFFAOYSA-N 277.244 -0.208 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H](C(=O)O)C1CC1 347404825 BCKFXRZPLFVMRP-SSDOTTSWSA-N 269.217 -0.834 5 20 CBBD Cn1cc([C@H](CO)NC(=O)c2cc([N+](=O)[O-])n[nH]2)cn1 354510401 ZLDCREKDDKBVLV-QMMMGPOBSA-N 280.244 -0.485 5 20 CBBD C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 356613719 YMORPXNEEAOWEF-VDTYLAMSSA-N 288.285 -0.519 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N1CCN[C@@H](C(N)=O)C1 360879341 FJDJMVXLMVKXLJ-MRVPVSSYSA-N 282.304 -0.617 5 20 CBBD CN1C(=O)CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1=O 550161032 ZYCANBQHLBTMFO-UHFFFAOYSA-N 291.263 -0.036 5 20 CBBD CC(=O)NCCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 576277138 QPMJWYGMCIIXDQ-LLVKDONJSA-N 285.304 -0.780 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)N1 593424540 JUIDIYBFIBXCKV-SNVBAGLBSA-N 299.308 -0.097 5 20 CBBD C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cn1)C(N)=O 593532283 ZVYUPQYLYWNFSA-YFKPBYRVSA-N 274.258 -0.858 5 20 CBBD CN1CC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])CC1=O 594343351 PDOHNXDBZUVVFF-SSDOTTSWSA-N 293.283 -0.077 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1C[C@@H]2CC[C@H](C1)N2 602588468 AGXYXCVMOQMKPA-DTORHVGOSA-N 265.273 -0.246 5 20 CBBD O=C1NC(=O)N2CCN(c3cccnc3[N+](=O)[O-])C[C@@H]12 611509905 YCHYCRDGDCGYDX-QMMMGPOBSA-N 277.240 -0.270 5 20 CBBD NC1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1 702046018 DYFHPQSIIAVIQG-UHFFFAOYSA-N 253.262 -0.259 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1CN(C(=O)O)C1 740388599 OFWJRNGVANQHOD-UHFFFAOYSA-N 296.239 -0.765 5 20 CBBD O=C(NCC(=O)OCCO)NCc1ccc([N+](=O)[O-])cc1 748378455 GMLCCAOCGATBKG-UHFFFAOYSA-N 297.267 -0.071 5 20 CBBD CON1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1 854856175 VCRXPVKLECDMJF-UHFFFAOYSA-N 281.272 -0.109 5 20 CBBD CON(C)C(=O)[C@@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-] 858843395 AYOVTMRYDBBQDB-ZCFIWIBFSA-N 297.271 -0.091 5 20 CBBD CN(CCNc1ccnc(O)c1[N+](=O)[O-])C(=O)C(N)=O 1101935370 OHQIUHKCVFKHBS-UHFFFAOYSA-N 283.244 -0.949 5 20 CBBD C[C@@H](CC(N)=O)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1117845723 VUCRXLOBAPRIOO-ZETCQYMHSA-N 282.256 -0.863 5 20 CBBD CO[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])CCO1 1324238423 ZBGHOZAQRUUFKX-QMMMGPOBSA-N 282.256 -0.102 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CNCCCO2)c1[N+](=O)[O-] 1326170436 VTQZQOWLWZEHEY-QMMMGPOBSA-N 283.288 -0.265 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1nnnn1C 1337497061 ZJASUKDPQOTXFV-LURJTMIESA-N 279.260 -0.052 5 20 CBBD CC(C)(CCC(=O)N1CC(O)(C(=O)O)C1)[N+](=O)[O-] 1590656131 JSPWWEXGJMDUJP-UHFFFAOYSA-N 260.246 -0.520 5 20 CBBD CN(CCC(N)=O)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1604737671 HWQCSULIWSCKBL-UHFFFAOYSA-N 292.259 -0.519 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCNC[C@H]1C(=O)O 1610607043 DGUHMXSUKPOSLO-JTQLQIEISA-N 296.283 -0.178 5 20 CBBD CN(C(=O)CN1CCNC(=O)C1)c1ccc([N+](=O)[O-])cc1 28932816 NGEDWYHSJDJCJF-UHFFFAOYSA-N 292.295 -0.011 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H]1C 245915037 WACHDGSPHCGNIB-IUCAKERBSA-N 297.315 -0.155 5 20 CBBD CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 274882760 GCCHHWQRSKPNKD-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD CN(C)C[C@@](C)(O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 274985108 QKVXFJZCKSVQRD-LBPRGKRZSA-N 298.299 -0.262 5 20 CBBD COC(=O)c1cnc(N(C)C[C@H](O)CO)c([N+](=O)[O-])c1 276688867 GVSABHHMZMZLCM-QMMMGPOBSA-N 285.256 -0.434 5 20 CBBD CNC(=O)C[C@@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 322770512 IEDBZPUPXZPFFM-SCZZXKLOSA-N 285.304 -0.734 5 20 CBBD C[C@H](C(=O)O)N(C)C(=O)c1c([N+](=O)[O-])cnn1C 342562035 IQVOXWAQPFXZQS-RXMQYKEDSA-N 256.218 -0.127 5 20 CBBD O=C(NC[C@]1(O)CCSC1)c1n[nH]cc1[N+](=O)[O-] 344000139 FNOOXOZJKAZXRT-SECBINFHSA-N 272.286 -0.084 5 20 CBBD CCCN(CC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 351540556 OKWUDSMBPOAXOU-UHFFFAOYSA-N 271.233 -0.491 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O 351853797 MPSNWCXLUFCQAY-WPRPVWTQSA-N 281.268 -0.404 5 20 CBBD O=C1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CN1 353907921 IFBFCYPFOYJDIY-ZETCQYMHSA-N 267.245 -0.814 5 20 CBBD CC[C@@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 354308609 QWNFMZKLBHYWDD-SNVBAGLBSA-N 285.260 -0.356 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@@H](O)C[C@H]1CO 360187883 CUCAMNRGWWHKRO-YUMQZZPRSA-N 282.256 -0.629 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC[C@@](C)(O)CN1CCOCC1 361090638 YXZBNPBHWIHYHL-GFCCVEGCSA-N 299.331 -0.177 5 20 CBBD CNc1nccc(C(=O)N(C)CC(=O)N(C)C)c1[N+](=O)[O-] 561092315 UNGMQYJWAYADOU-UHFFFAOYSA-N 295.299 0.192 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H](CO)CN2CCCC2)c1[N+](=O)[O-] 588867576 XLEWPKZLXYROJP-VIFPVBQESA-N 297.315 -0.187 5 20 CBBD COc1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)nn1C 774138768 PHROHZFVPXVIQX-UHFFFAOYSA-N 296.243 -0.215 5 20 CBBD CS(=O)(=O)N[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839528349 QLBVOSUOQITRLH-IWSPIJDZSA-N 291.329 -0.808 5 20 CBBD COC(=O)c1cn(CCn2cnc([N+](=O)[O-])n2)nn1 1324243268 QCCHAVIXQKSKOL-UHFFFAOYSA-N 267.205 -0.735 5 20 CBBD C[C@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1O 1324663488 XKHMBRTZHMCQQL-XPUUQOCRSA-N 266.257 -0.094 5 20 CBBD Cn1cc(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 48794206 ZRUQNFMGFQVPPF-UHFFFAOYSA-N 278.272 -0.116 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C(N)=O 65720903 NVXHWKJUUSPGAQ-YFKPBYRVSA-N 255.234 -0.910 5 20 CBBD O=C(NN1CCCNC1=O)c1cc([N+](=O)[O-])cnc1O 273090733 NVTQCRRRTQPAHC-UHFFFAOYSA-N 281.228 -0.245 5 20 CBBD O=C(NCCCOCCO)c1cnc(O)c([N+](=O)[O-])c1 277956310 DHAIMXLSZNWJIQ-UHFFFAOYSA-N 285.256 -0.176 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@H]1C 285820544 WJXDPPKRODUBKK-BDAKNGLRSA-N 297.315 -0.155 5 20 CBBD CO[C@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330513449 CEIGGNTUXRBNOM-QMMMGPOBSA-N 269.261 -0.176 5 20 CBBD CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 331761348 JGZDPHGHMUSBRR-UHFFFAOYSA-N 252.230 -0.117 5 20 CBBD O=C1C[C@H](N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)C(=O)N1 363595178 LZSSZGLCSCEOLQ-PRJMDXOYSA-N 267.241 -0.942 5 20 CBBD Cc1nc(NC[C@H]2CNCCN2C)ncc1[N+](=O)[O-] 420272228 LCKKTWSXMLYOBB-SECBINFHSA-N 266.305 0.009 5 20 CBBD O=C(NCc1cccc([N+](=O)[O-])c1)C(=O)N1CCNCC1 514591282 TWEWZSSYBHBJGP-UHFFFAOYSA-N 292.295 -0.357 5 20 CBBD COC(=O)c1nc[nH]c1NC(=O)Cn1cc([N+](=O)[O-])cn1 550084896 CKZMKUDDXRSMBD-UHFFFAOYSA-N 294.227 -0.060 5 20 CBBD C[C@H](N)[C@@H](C)C(=O)NCCn1cc([N+](=O)[O-])cn1 562978114 WVNOVWIAHJUKJF-SFYZADRCSA-N 255.278 -0.109 5 20 CBBD O=C1NC[C@H]2CN(c3ccc([N+](=O)[O-])nc3)CCN2C1=O 572312293 QBSUITQDAWJSSH-VIFPVBQESA-N 291.267 -0.863 5 20 CBBD CNC(=O)CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 608932604 OGSZCUFODULERO-UHFFFAOYSA-N 295.251 -0.158 5 20 CBBD COC(=O)COCC(=O)OCCn1cc([N+](=O)[O-])cn1 803804452 UBIZFNJTSQXCSG-UHFFFAOYSA-N 287.228 -0.476 5 20 CBBD CN(CCn1cc([N+](=O)[O-])ccc1=O)CC(=O)O 820597496 UVOOKWIOJLLIDX-UHFFFAOYSA-N 255.230 -0.227 5 20 CBBD CN(C)C(=O)OCCNC(=O)c1cc([N+](=O)[O-])cnc1N 855647517 GDBBTFCXLUNTEH-UHFFFAOYSA-N 297.271 0.000 5 20 CBBD C[C@@H]1NCCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1C 923344764 IIYNARTXNAMHSO-UMNHJUIQSA-N 283.332 -0.166 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC[C@@H](C(N)=O)C1 1263483499 PWBUEEUZDHZBJV-SSDOTTSWSA-N 268.277 -0.707 5 20 CBBD C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)S(C)(=O)=O 1320158762 YYONIUMBSHHCSY-SSDOTTSWSA-N 290.301 -0.659 5 20 CBBD Cc1nc2n(n1)CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)C2 1322397817 QDHDKUAYXSBTSQ-UHFFFAOYSA-N 291.271 -0.266 5 20 CBBD NC(=O)[C@H](O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1 1326236789 NZUHRFVQWGAZKI-VHSXEESVSA-N 269.257 -0.936 5 20 CBBD COC(=O)NC1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1338164817 YRBGIFZCQMPTNK-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@@]2(C(=O)O)CCOC2)n1 1339863007 WZKCEALFHMJKMI-JTQLQIEISA-N 284.228 -0.698 5 20 CBBD C[C@@]1(CO)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@]1(C)CO 1348408997 BTDSIVNNDDVAJM-TXEJJXNPSA-N 298.299 -0.229 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCO[C@H]2C(=O)O)n1 1600970050 YPQWMVIEDSCTSK-YLWLKBPMSA-N 284.228 -0.700 5 20 CBBD CCNC(=O)CNC(=O)CCn1cc([N+](=O)[O-])nc1C 61133084 BIXRLRVICPXKOL-UHFFFAOYSA-N 283.288 -0.258 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H](O)[C@H](O)C2)c1 93091779 HNMSJWOGLJXCLW-AOOOYVTPSA-N 288.281 -0.679 5 20 CBBD NC(=O)CNC(=O)CCOc1ccccc1[N+](=O)[O-] 171753621 RAENAFRAHGSFMC-UHFFFAOYSA-N 267.241 -0.035 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 229975177 FCGZASSLAWOCAE-SSDOTTSWSA-N 287.659 -0.176 5 20 CBBD O=C(CO)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 273296547 AGKKYRLSAWXVTF-UHFFFAOYSA-N 288.281 -0.523 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285127960 PYZKUUFGOGZXKK-LURJTMIESA-N 268.229 -0.047 5 20 CBBD CCN(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286439810 HXRSVIHCYCWOCN-ZCFIWIBFSA-N 269.261 -0.086 5 20 CBBD C[C@H]1C(=O)N(C)CCN1c1ncc([N+](=O)[O-])c(N)n1 302419715 MVORXCDQUZRFAM-LURJTMIESA-N 266.261 -0.366 5 20 CBBD COCC(=O)N1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1 331058510 MMOWEYMJCJZYME-UHFFFAOYSA-N 297.315 -0.381 5 20 CBBD Nc1nc(N2[C@H]3CC[C@H]2CC(=O)NC3)ncc1[N+](=O)[O-] 359015484 ODIPCGFOMOXMJH-BQBZGAKWSA-N 278.272 -0.176 5 20 CBBD CN(C)C(=O)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 390031529 DKKVZPZRQJLONM-LLVKDONJSA-N 299.331 -0.390 5 20 CBBD Nc1nc(=NC[C@H]2CCCN2CCCO)[nH]cc1[N+](=O)[O-] 450600279 VGTOFNJDQSSTFA-SECBINFHSA-N 296.331 -0.352 5 20 CBBD CN(C)C1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1 569353789 YYVLVKMPKNAKDW-UHFFFAOYSA-N 265.273 -0.042 5 20 CBBD O=C(O)Cc1n[nH]c(NC(=O)c2cc([N+](=O)[O-])c[nH]2)n1 739908522 DFUQVOBBFIGCCT-UHFFFAOYSA-N 280.200 -0.080 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 770429180 AFVXSRMJEXCMQG-SECBINFHSA-N 297.267 -0.169 5 20 CBBD CNc1ccc(C(=O)NOCC(N)=O)cc1[N+](=O)[O-] 772933976 UFQRWOBQSASLOM-UHFFFAOYSA-N 268.229 -0.217 5 20 CBBD O=C1C[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CN1 780838089 XXCLDLPPXQZWMS-RXMQYKEDSA-N 291.310 -0.177 5 20 CBBD COC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1OC)C(N)=O 793736676 AOIWXNIYAZMFPT-QMMMGPOBSA-N 297.267 -0.167 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1cccc[n+]1[O-] 1116309806 UMOVDGKXXAHWRT-UHFFFAOYSA-N 277.240 -0.145 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1[C@@H]2CNC[C@@H]21 1332241888 HBYVBAISNIZUKY-BDINMYNLSA-N 251.246 -0.724 5 20 CBBD CNC[C@H](C)NC(=O)C(=O)NCc1cccc([N+](=O)[O-])c1 1350332310 ROXZPOBIGYQODI-VIFPVBQESA-N 294.311 -0.065 5 20 CBBD CC(=O)NCCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H](C)C(=O)O 1588507983 XSIQZWCSVQRFSX-NBEYISGCSA-N 287.272 -0.911 5 20 CBBD O=C(Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O)NC1CC1 1601381172 MKNLSKHLHHYOPP-UHFFFAOYSA-N 281.224 -0.267 5 20 CBBD CO[C@@](C)(C(=O)O)C(=O)OCCn1cc([N+](=O)[O-])cn1 1604461638 LLQVNNVJJBNNNN-JTQLQIEISA-N 287.228 -0.176 5 20 CBBD CCS(=O)(=O)NCCn1cc([N+](=O)[O-])ccc1=O 68043064 NWXCXAHLMJYIJC-UHFFFAOYSA-N 275.286 -0.304 5 20 CBBD CCS(=O)(=O)CCNc1ncc([N+](=O)[O-])c(N)n1 76270194 SDQBUDQSLAUQPX-UHFFFAOYSA-N 275.290 -0.186 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCc1ncc[nH]1 135480408 SCDXRCFMLBDTIJ-UHFFFAOYSA-N 264.245 -0.127 5 20 CBBD NC(=O)C1(NC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 183845640 VRJGEKQYLJBPHL-VIFPVBQESA-N 295.295 -0.058 5 20 CBBD COC[C@@H](CO)NS(=O)(=O)c1ccccc1[N+](=O)[O-] 234886339 UWLYAVMHGGSONA-MRVPVSSYSA-N 290.297 -0.120 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 268451621 MWZQARNGAHATPR-RXMQYKEDSA-N 256.218 -0.082 5 20 CBBD COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)[C@H](C)O 274512964 HLDFDWSBGLYHFM-YLWLKBPMSA-N 272.213 -0.160 5 20 CBBD C[C@@H](CN(C)C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 287353941 ZXBDWHCJTLLIEU-VIFPVBQESA-N 282.300 -0.177 5 20 CBBD CNC(=O)[C@@H]1CCCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 298776489 UTNZMQDFDKMBTJ-VIFPVBQESA-N 295.299 -0.082 5 20 CBBD CCN1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 331496046 RQAHZMXCWTYYGS-UHFFFAOYSA-N 282.304 -0.260 5 20 CBBD O=C([C@H]1COCCN1)N1CCc2ncc([N+](=O)[O-])cc2C1 424177446 UJUIRWUXRHBPDO-GFCCVEGCSA-N 292.295 -0.137 5 20 CBBD Nc1nc(=NCCC2(CO)CC2)[nH]cc1[N+](=O)[O-] 450820354 IWKIFHQPQZOHAG-UHFFFAOYSA-N 253.262 -0.037 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2[C@@H]3CNC[C@@H]32)n1 563119218 SQDBQYGAKVMTAO-QMSLJYSESA-N 265.273 -0.241 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1C[C@@H]2CNC[C@@H]2C1 571879949 DFGPCMAMSUVPNM-KNVOCYPGSA-N 251.246 -0.391 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 576946442 NDTIHHKZVMAILO-RNFRBKRXSA-N 256.218 -0.539 5 20 CBBD CO[C@@H]1COC[C@H]1Nc1ncc([N+](=O)[O-])c(N)n1 584526779 HVKQIACTBCCMGY-IYSWYEEDSA-N 255.234 -0.207 5 20 CBBD NC(=O)[C@]1(NC(=O)Cc2ccccc2[N+](=O)[O-])CCOC1 594404906 QKVQNDAAUWHPCL-ZDUSSCGKSA-N 293.279 -0.102 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H]1C[C@@H](C(=O)O)C1 595247555 HBGKUMNWTHEMKW-KNVOCYPGSA-N 283.244 -0.492 5 20 CBBD CNS(=O)(=O)CCNc1ccnc(O)c1[N+](=O)[O-] 596204775 XOIISPXUVWVCKJ-UHFFFAOYSA-N 276.274 -0.344 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nnnn1C1CC1 821667728 XLQPZAGJDONNJE-UHFFFAOYSA-N 278.232 -0.249 5 20 CBBD CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C(C)(C)C(=O)O 830713513 HCKAMYKEJSCDIS-SECBINFHSA-N 286.288 -0.053 5 20 CBBD CN(C)CCONC(=O)CCn1cc([N+](=O)[O-])cn1 854947305 POOWDDYUSPFGEF-UHFFFAOYSA-N 271.277 -0.209 5 20 CBBD COC[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 886876610 KGQGZCYXWVMCLR-JTQLQIEISA-N 284.272 -0.335 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NCCS(C)(=O)=O 919700791 UECZAJWYDGYTPW-UHFFFAOYSA-N 275.286 -0.292 5 20 CBBD CN1CC[C@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1 928569605 NJZNIEQRNOCUDE-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD O=C(NC1CN(C(=O)c2ncc[nH]2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991295843 JZDOQHJHTRWACS-HTQZYQBOSA-N 279.256 -0.985 5 20 CBBD CCc1nnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1 1126936886 WCYGMUIMRHVWIY-HTQZYQBOSA-N 299.356 -0.029 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@](F)(CO)C1 1256719429 IPTAVNNZOVFVBJ-VIFPVBQESA-N 258.209 -0.136 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)c1nnnn1C 1339236181 BMYWHGIVSGWVJS-ZCFIWIBFSA-N 294.275 -0.499 5 20 CBBD NC(=O)[C@H](CO)NC[C@H](O)c1cccc([N+](=O)[O-])c1 1349319590 OTKVMNBICHQMKG-UWVGGRQHSA-N 269.257 -0.936 5 20 CBBD COCC1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 1350755024 AJWMTWPXZZQEND-UHFFFAOYSA-N 254.246 -0.104 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@]2(C(=O)O)CCOC2)c1[N+](=O)[O-] 1597399690 KUKXACURYRXBPF-NSHDSACASA-N 298.255 -0.146 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C(=O)O)O1 1599918395 HFOYPKKJZBGKSF-CBAPKCEASA-N 298.255 -0.508 5 20 CBBD O=C(O)[C@@H](F)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 1602170635 LVLUIYSNFRHTTO-YFKPBYRVSA-N 293.232 -0.309 5 20 CBBD NC(=O)Cn1cc(Nc2ncc([N+](=O)[O-])c(N)n2)cn1 76268610 YTHGLAWCXAOPJC-UHFFFAOYSA-N 278.232 -0.608 5 20 CBBD CN(CCn1cc([N+](=O)[O-])cn1)CCS(C)(=O)=O 174844507 VDRFTSLPAUNNLC-UHFFFAOYSA-N 276.318 -0.232 5 20 CBBD NC(=O)[C@H](O)CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 229973969 UCVKKLGYOHXBNX-QLCVYAKKSA-N 279.252 -0.430 5 20 CBBD COC(=O)[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](C)O 274520396 SDFACWXUOQKARI-LDWIPMOCSA-N 297.267 -0.171 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])cn1 276643570 RFQMJELDFNMJJD-QMMMGPOBSA-N 283.288 -0.226 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@@H]2COC[C@@H]2O)c1[N+](=O)[O-] 342448819 UDRVJXSEXFSNKC-SFYZADRCSA-N 284.272 -0.532 5 20 CBBD C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[S@]1=O 352312263 DYIMLFDQFJGCEC-WPCRTTGESA-N 286.313 -0.229 5 20 CBBD C[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)Cn1cccn1 357934248 KTAHTIKUECEFHZ-VIFPVBQESA-N 293.287 -0.165 5 20 CBBD CCO[C@@H]1COC[C@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 456792419 KMLKTEUTDYCSKS-RKDXNWHRSA-N 284.272 -0.289 5 20 CBBD C[C@H](CO)CNS(=O)(=O)c1ccc([N+](=O)[O-])cn1 593550243 RUJDGECBDSALDT-ZETCQYMHSA-N 275.286 -0.104 5 20 CBBD CC(C)[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 594467941 ORSQKHVCMIKCDP-ZETCQYMHSA-N 285.260 -0.341 5 20 CBBD Cc1noc(CN2CCN(CC(N)=O)CC2)c1[N+](=O)[O-] 595286640 JBIUTCAIDIRFNG-UHFFFAOYSA-N 283.288 -0.506 5 20 CBBD CC(=O)N1CC(C(=O)OCCn2ccc([N+](=O)[O-])n2)C1 788160838 BBJJOUKSBJIANY-UHFFFAOYSA-N 282.256 -0.187 5 20 CBBD CC(=O)NC1CN(Cc2c([N+](=O)[O-])ncn2C)C1 1030036224 MOKFDSRZXFDKHZ-UHFFFAOYSA-N 253.262 -0.351 5 20 CBBD C[C@@H]1CNCCN1C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118195581 ODXWZEAGNSWALH-SECBINFHSA-N 280.284 -0.423 5 20 CBBD Cc1cnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc1 1126936695 QXZZGWRCCZSSKC-NXEZZACHSA-N 279.300 -0.344 5 20 CBBD Cc1nn(C)c(C(=O)N2CCC[C@H](C(N)=O)C2)c1[N+](=O)[O-] 1318011217 OBFBCCLAWDXJFD-QMMMGPOBSA-N 295.299 -0.026 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)O 1589144625 SELHEPZCZYZLLF-SNVBAGLBSA-N 269.213 -0.445 5 20 CBBD Cn1cnc([N+](=O)[O-])c1NC(=O)COCC(=O)O 1594557880 OUXNMVUWMWEEOK-UHFFFAOYSA-N 258.190 -0.632 5 20 CBBD C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C(N)=O 46176659 ADFWATSDLXJERB-ZETCQYMHSA-N 267.241 -0.036 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H](O)C(=O)O 90261911 DZGPVKQOEYVSSI-VIFPVBQESA-N 284.224 -0.465 5 20 CBBD CNC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285404549 BBUJLAGUDNBSPO-SSDOTTSWSA-N 281.272 -0.084 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CCNC1=O 340100764 IJPBHNIRPAUOLZ-QMMMGPOBSA-N 252.230 -0.117 5 20 CBBD CN(CCNC(=O)N(C)C)CCn1cc([N+](=O)[O-])cn1 348917359 HMKDYJALGXFPKA-UHFFFAOYSA-N 284.320 -0.006 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CO)C1CCOCC1 360741144 VQUNYWRXZNNKNS-SNVBAGLBSA-N 298.299 -0.305 5 20 CBBD C[C@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 385054516 WQUXHXXPMFQREJ-IONNQARKSA-N 254.246 -0.227 5 20 CBBD CN1C[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C(=O)N1 538681464 RTXXOCIMLCCTFH-SECBINFHSA-N 278.268 -0.401 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 592195156 JKKBIOBMKWRSQW-MWLCHTKSSA-N 298.299 -0.353 5 20 CBBD O=C(O)[C@@H]1C[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 592467068 HLIHFKKXPJGQIU-HTQZYQBOSA-N 268.229 -0.372 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)O[C@@H]1CCOC1=O 748918036 STIWSXAEKHJBGP-MRVPVSSYSA-N 282.208 -0.385 5 20 CBBD O=C(Nn1cnnc1O)c1ccc([N+](=O)[O-])cc1O 776185207 PWJMJSVOTXBSEM-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD Nc1nc(N2C[C@@H]3C[C@]3(CO)C2)ncc1[N+](=O)[O-] 782407569 PCGKFETZGLKKKE-QUBYGPBYSA-N 251.246 -0.214 5 20 CBBD CC(C)(Cn1cc(CN2CCNCC2)nn1)[N+](=O)[O-] 864642650 UIOMUNSACIHILD-UHFFFAOYSA-N 268.321 -0.261 5 20 CBBD CNS(=O)(=O)[C@@H]1CCCN(CC[N+](=O)[O-])C1 929980434 FCVXMJVHAVSAPV-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCCO)C1 1042711601 YZRDDULKJIWNQS-NXEZZACHSA-N 257.290 -0.823 5 20 CBBD Cc1nc(NCC(=O)N2CCN(C)CC2)ncc1[N+](=O)[O-] 1333650873 NZPRBQJCKBAVSR-UHFFFAOYSA-N 294.315 -0.121 5 20 CBBD NCC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(F)F 1346055732 DEFSMFDMTWLHMB-YFKPBYRVSA-N 278.219 -0.715 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCOCCCN 1580008904 GDAQIXGPLUSVCS-UHFFFAOYSA-N 271.277 -0.577 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@]12CCC[C@@H]1NCC2 1580578799 LNZCPIBSVOVNJR-KWQFWETISA-N 280.288 -0.413 5 20 CBBD COCCN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])cnc1N 1604591947 WXFGCVKBZUQLAV-UHFFFAOYSA-N 298.255 -0.255 5 20 CBBD CCOC[C@@H](C(=O)O)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1605620035 AHUPFBUNIBDACE-PRJMDXOYSA-N 260.246 -0.400 5 20 CBBD CS(=O)(=O)NCCNC(=O)c1ccccc1[N+](=O)[O-] 8169521 DHPFLDIAEGLINX-UHFFFAOYSA-N 287.297 -0.126 5 20 CBBD C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C(N)=O 33615463 OQHDAIGDUWOSHR-ZETCQYMHSA-N 267.241 -0.036 5 20 CBBD Cn1cc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)cn1 48944801 CBFPTPIVKPIONY-UHFFFAOYSA-N 264.245 -0.159 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc(O)c([N+](=O)[O-])c1)C(=O)O 262691096 CIORPPUSOXOIPW-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD CC(=O)NCCCNC(=O)c1cc([N+](=O)[O-])[nH]n1 285607886 WJBKWPUBOKZRLH-UHFFFAOYSA-N 255.234 -0.426 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H]1C(N)=O 286088893 HRKSPRAKWRHOLO-PSASIEDQSA-N 267.289 -0.156 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1COC[C@H]1O 287263850 KXDCWBVZGSGUJL-RKDXNWHRSA-N 284.272 -0.682 5 20 CBBD CC(C)(O)CN1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 301182004 ZYQUNYHYRCDJCL-UHFFFAOYSA-N 296.331 -0.140 5 20 CBBD C[C@@H]1CC(=O)N(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 331247872 UCCJMWFFCWPAAU-VXNVDRBHSA-N 282.256 -0.453 5 20 CBBD CCNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1 351119947 VOTAJIJGAKHNQR-UHFFFAOYSA-N 293.283 -0.220 5 20 CBBD O=C1NCCN1CCn1cccc([N+](=O)[O-])c1=O 361084339 BUNREFCKVBAWMG-UHFFFAOYSA-N 252.230 -0.218 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CC(N2CC[C@@H](O)C2)C1 593853872 HAKZSOVUBKOUFF-SNVBAGLBSA-N 295.299 -0.931 5 20 CBBD CN1C(=O)C[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1=O 596138261 SVKNKMRXQHRCLB-MRVPVSSYSA-N 292.251 -0.137 5 20 CBBD O=C(NCCN1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])[nH]1 600530517 HPSVCSDIFGLSFQ-MRVPVSSYSA-N 268.273 -0.281 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CCN1CCNC(=O)[C@@H]1C 602772777 KEBXUHBBJUNCOG-QMMMGPOBSA-N 267.289 -0.080 5 20 CBBD O=C(O)CN1CC[C@H](n2cnc([N+](=O)[O-])n2)C1=O 694926014 JJVVOMGHDMELPH-YFKPBYRVSA-N 255.190 -0.956 5 20 CBBD Nc1nonc1C(=O)OCCn1cc([N+](=O)[O-])cn1 748124366 ZZLGOEHVDHFTLS-UHFFFAOYSA-N 268.189 -0.387 5 20 CBBD O=C1CC[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C(=O)N1 798606140 OCHKLLQSVXSYEM-QMMMGPOBSA-N 296.239 -0.470 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)c1cnn[nH]1 805605650 LYVVMFAVYRKYAP-UHFFFAOYSA-N 252.190 -0.234 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nnnn1C1CC1 821667410 IYHFELWMUWYBHL-UHFFFAOYSA-N 278.232 -0.249 5 20 CBBD C/C=C(/C)C(=O)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543781 XQTIVIQJVJEZRU-GIGCTMKZSA-N 299.327 -0.445 5 20 CBBD CSCC(=O)NCCNc1ncc([N+](=O)[O-])c(N)n1 1093498334 FLXWFIAWXALZKB-UHFFFAOYSA-N 286.317 -0.142 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)c1c[nH]nc1[N+](=O)[O-] 1321809057 DKNGMMRUZIQGCZ-UHFFFAOYSA-N 251.206 -0.292 5 20 CBBD NC(=O)C[C@@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 1324141729 NBKJLHYCLBNFQS-JTQLQIEISA-N 294.311 -0.046 5 20 CBBD CNC(=O)[C@@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CCO1 1325151931 ZAQKTXJQKXGIRP-ZETCQYMHSA-N 297.271 -0.787 5 20 CBBD CN(C)CC1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 1329322388 SZHDZBBNBOSDDU-UHFFFAOYSA-N 253.262 -0.049 5 20 CBBD COC[C@](C)(NC(=O)c1c([N+](=O)[O-])cnn1C)C(=O)O 1339080610 YMPPVUZWAIDECV-JTQLQIEISA-N 286.244 -0.452 5 20 CBBD O=C(O)C1=NO[C@@H](Cn2cc([N+](=O)[O-])ccc2=O)C1 1608591490 OIKVIIQOWGFIMK-SSDOTTSWSA-N 267.197 -0.014 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cn1 1608823198 DDOWAQXHNSMVKV-VXNVDRBHSA-N 281.224 -0.350 5 20 CBBD NC(=O)[C@H]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)O1 268543792 SIDBWJSEHKAXLD-RNFRBKRXSA-N 283.240 -0.050 5 20 CBBD CO[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330513448 CEIGGNTUXRBNOM-MRVPVSSYSA-N 269.261 -0.176 5 20 CBBD CNC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CCO1 330827003 QRQVHWLVHMQGMU-SECBINFHSA-N 296.283 -0.480 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCCC(=O)NC(N)=O 343692608 BLHJBGIRHAJFBH-UHFFFAOYSA-N 295.255 -0.387 5 20 CBBD O=C(C[C@@H]1NC(=O)NC1=O)Nc1ccc(O)c([N+](=O)[O-])c1 361657017 VFFTVJWBRBMJDH-LURJTMIESA-N 294.223 -0.163 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@]1(CCO)CCOC1 447064665 ZOUWBVFHZXEFJO-GFCCVEGCSA-N 296.283 -0.157 5 20 CBBD CNc1nc(C(=O)N[C@@H]2CN(C)NC2=O)ccc1[N+](=O)[O-] 455987916 DBOPTKKYYQKMDT-SSDOTTSWSA-N 294.271 -0.894 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H](CO)CN(C)C)c1[N+](=O)[O-] 597654995 XBVNWBCWAIMDIJ-ZETCQYMHSA-N 285.304 -0.467 5 20 CBBD CN(C[C@H]1COCCO1)C(=O)Cn1cc([N+](=O)[O-])cn1 598180387 FFKYHUKFPPBHRI-JTQLQIEISA-N 284.272 -0.335 5 20 CBBD COC(=O)[C@H]1C[C@H](OC)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 857330645 LAMFZQMDXKCTCC-ZYUZMQFOSA-N 286.284 -0.169 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CN(C)CCN1C 896536501 VGPCPSHTCSGTNA-ZDCRXTMVSA-N 270.333 -0.598 5 20 CBBD NC(=O)C(=O)N[C@H]1[C@@H]2CN(c3ccccc3[N+](=O)[O-])C[C@@H]21 1060468505 BKBYEBVOVHQWLS-VROVMSAKSA-N 290.279 -0.369 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](CN)C1 1118141220 VBGCFTXDOLEITJ-SSDOTTSWSA-N 253.262 -0.251 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1c1nccc(C(N)=O)c1[N+](=O)[O-] 1323961118 XYPSVZTZTGDXEH-SFYZADRCSA-N 296.283 -0.325 5 20 CBBD O=[N+]([O-])c1c(N2CC[C@H](CO)[C@H](O)C2)ccnc1O 1333710854 XISDAIODZXVHNN-VXNVDRBHSA-N 269.257 -0.125 5 20 CBBD O=C(O)CN(CC1CC1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1339749754 YHIVOXSIEMIRLT-NSHDSACASA-N 298.299 -0.051 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(=O)n(C)n1 1342840803 GLOVKUDXUFZPNF-UHFFFAOYSA-N 278.228 -0.326 5 20 CBBD C[C@H](c1nnc(N(C)CCS(C)(=O)=O)n1C)[N+](=O)[O-] 1343689702 VHWBHUZJEUELEW-SSDOTTSWSA-N 291.333 -0.366 5 20 CBBD NC(=O)c1ccnc(N2C[C@@H]3CNC[C@@H]3C2)c1[N+](=O)[O-] 1347396315 SHEQRWOIWTXDTA-OCAPTIKFSA-N 277.284 -0.256 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCNC[C@@H]2O)n1 1578349815 AUNJAYLLUWMKQU-APPZFPTMSA-N 283.288 -0.736 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1CN2 1580788664 IYFIRRPMBMVMNN-YUMQZZPRSA-N 263.257 -0.010 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])n1C 35174864 VJEDHDAAKFWVTK-ZCFIWIBFSA-N 271.229 -0.803 5 20 CBBD NC(=O)[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1 50858789 VGNHYGHZTXCPLL-LLVKDONJSA-N 293.279 -0.150 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC[C@H]2CO)c1 266561543 XSIBUVVPAZYNGT-GXSJLCMTSA-N 270.289 -0.391 5 20 CBBD COCCN1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 363375179 QAZMLQCCDCGHQA-GHMZBOCLSA-N 271.317 -0.168 5 20 CBBD C[C@@H]1[C@@H](CO)CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 427831247 XAOIXYVSYLCOBJ-NXEZZACHSA-N 295.295 -0.014 5 20 CBBD NC[C@H]1CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 429184475 BQCIJSPHEHAHPP-HTQZYQBOSA-N 268.277 -0.570 5 20 CBBD CCN(CCOCCO)C(=O)c1c[nH]nc1[N+](=O)[O-] 559051393 GDLGFZKIBPHQRN-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD CC(C)(C)[C@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 564841251 SBBCWHDHQGAXCL-ZETCQYMHSA-N 270.293 -0.324 5 20 CBBD C[C@H]1CN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C[C@H](CO)O1 566805365 HMMZANSHNZMHSO-JGVFFNPUSA-N 296.283 -0.206 5 20 CBBD CNc1nccc(C(=O)N2CCC[C@@H]2C(N)=O)c1[N+](=O)[O-] 572377541 HUCDBKFAOFXATR-MRVPVSSYSA-N 293.283 0.121 5 20 CBBD O=C(O)c1cnc(N2CC[C@@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1 592972991 NPXIVZZVZGLDHC-XVKPBYJWSA-N 297.267 -0.133 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)Cn1cc([N+](=O)[O-])cn1 593814770 DURJFOAPOOIKLQ-PSASIEDQSA-N 284.272 -0.601 5 20 CBBD CN(CCOCCN)CCn1ccc([N+](=O)[O-])n1 600736166 QRLZVVXAONRVPP-UHFFFAOYSA-N 257.294 -0.302 5 20 CBBD CNC(=O)[C@H](O)CNc1nc2sccn2c1[N+](=O)[O-] 757693950 WRLUGRJSXYYNON-RXMQYKEDSA-N 285.285 -0.177 5 20 CBBD O=C1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)CCCN1 770391848 ZEPBUARTPQTFNU-UHFFFAOYSA-N 280.240 -0.343 5 20 CBBD CC[C@H](CO)C(=O)NCCn1cc([N+](=O)[O-])cn1 779813729 URJFQKKXDQANCM-MRVPVSSYSA-N 256.262 -0.074 5 20 CBBD C[C@H](CN1CCOCC1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839531819 OOXDHCVDKIZKEY-OPRDCNLKSA-N 257.290 -0.512 5 20 CBBD CCS(=O)(=O)C[C@H](C)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839683247 DWSANYFLCMECER-DJLDLDEBSA-N 278.330 -0.067 5 20 CBBD Cc1cc(NCCCNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1094742441 YMAWUYMKDPPTQS-UHFFFAOYSA-N 281.272 -0.298 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(C[C@@]2(O)CCCOC2)c1=O 1327016523 FVERWQKGXFSUEW-LBPRGKRZSA-N 297.267 -0.603 5 20 CBBD O=C(N[C@H]1CCNC[C@@H]1F)c1n[nH]cc1[N+](=O)[O-] 1580617233 OHGZVTOVVAMYOM-WDSKDSINSA-N 257.225 -0.252 5 20 CBBD CCN1CC[C@H](n2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)C1=O 1590731115 IDALGZZYMNBGIO-LURJTMIESA-N 292.259 -0.235 5 20 CBBD CC(C)(CCC(=O)N1CC[C@@](O)(C(=O)O)C1)[N+](=O)[O-] 1603592346 ZBEJYYFWEFDNCT-NSHDSACASA-N 274.273 -0.130 5 20 CBBD CC(C)NC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 65769729 LVWCPNGLOMPZFM-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD CC1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])OCCO1 179191677 MZVPWYGPNAJODQ-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD COCCNCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 212806555 XAPUSUHXPDQULM-UHFFFAOYSA-N 256.262 -0.111 5 20 CBBD CC(C)(C(=O)NCC1CNC1)n1cc([N+](=O)[O-])cn1 261987138 XOQHWDFTFBUXTM-UHFFFAOYSA-N 267.289 -0.138 5 20 CBBD COc1ccc([N+](=O)[O-])c(C(=O)NC(CO)CO)c1 271425397 ZOCWLQQFABVPJN-UHFFFAOYSA-N 270.241 -0.314 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 275855424 HXIAVNJGUIZUTO-UHFFFAOYSA-N 276.274 -0.798 5 20 CBBD NC(=O)[C@H]1CN(c2ccccc2[N+](=O)[O-])CCN1 296495739 NVLGQIQSLPMYGM-MRVPVSSYSA-N 250.258 -0.142 5 20 CBBD COC1(C)CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 331766015 KLKILPQXIVHVLK-UHFFFAOYSA-N 255.234 -0.566 5 20 CBBD NS(=O)(=O)CCCCNC(=O)c1ccc([N+](=O)[O-])o1 336816683 MZBOANHPHSFCLM-UHFFFAOYSA-N 291.285 -0.014 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)OC 351789003 UBPXBRYWAWXDHO-SSDOTTSWSA-N 285.256 -0.149 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H]2CNC[C@@H]2C1 353763166 SRSGTWUQIXNVMF-JGVFFNPUSA-N 265.273 -0.001 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CCC1 364492183 FSVZYNMLCGEUAQ-NXEZZACHSA-N 267.285 -0.221 5 20 CBBD CN1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 438796708 XHAHHXKNSSGKJJ-GFCCVEGCSA-N 283.332 -0.210 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCn2ncnc2C1 445216877 TYZOJGDOLBLOPX-UHFFFAOYSA-N 290.239 -0.057 5 20 CBBD CC(C)[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CCN1C 490298647 KTSKFNLLSKROKU-JTQLQIEISA-N 296.331 -0.015 5 20 CBBD COCCS(=O)(=O)N=c1cc[nH]cc1[N+](=O)[O-] 544405108 VEGNYLZMDYNMLV-UHFFFAOYSA-N 261.259 -0.200 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 547759868 CXZHXVSNAMDUSP-RXMQYKEDSA-N 268.229 -0.137 5 20 CBBD Cc1nn(C)c(C(=O)N[C@H]2CC(=O)N(C)C2=O)c1[N+](=O)[O-] 550161725 VALXTMLCSKZWAO-LURJTMIESA-N 295.255 -0.876 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H](C(=O)O)C1 565430022 BTWXESIVUQJPAG-LJGSYFOKSA-N 268.229 -0.229 5 20 CBBD CN1CC[C@@H](N(C)C(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 573980325 URBBKFNHDRCMEO-MRVPVSSYSA-N 293.283 -0.125 5 20 CBBD Cn1ncc(C(=O)OCCn2cc([N+](=O)[O-])cn2)n1 792532849 BJECUKVMVGAYJW-UHFFFAOYSA-N 266.217 -0.223 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCCn1cnnn1 807920362 HEDAAUZESSLMNM-UHFFFAOYSA-N 295.234 -0.267 5 20 CBBD CC1(C)COC(=O)[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 808105253 ALIFDBMCURYQTA-VIFPVBQESA-N 282.256 -0.141 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] 816327627 MKPYUBCFPDVUJH-ZCFIWIBFSA-N 299.287 -0.722 5 20 CBBD CN(CCNC(=O)c1cnn[nH]1)c1ccc([N+](=O)[O-])cn1 1100400684 LOWKMOPXRJJLTA-UHFFFAOYSA-N 291.271 -0.026 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCCS(=O)(=O)CC1 1116412967 RQGFTINWDCIUEU-UHFFFAOYSA-N 288.285 -0.421 5 20 CBBD CCN(Cc1cnn(C)c1)C(=O)Cn1cnc([N+](=O)[O-])n1 1318243544 YUWFFKQSSPBTTL-UHFFFAOYSA-N 293.287 -0.032 5 20 CBBD Cn1cc([N+](=O)[O-])c(N2CCC(O)(C(=O)O)CC2)n1 1600970271 FFOOSFCAQBYGDT-UHFFFAOYSA-N 270.245 -0.256 5 20 CBBD O=C(O)[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cccnc1 1601664319 GAEJIBFZGMNDAH-HLTSFMKQSA-N 265.225 -0.011 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC(=O)N(C)C 68998338 ZMRXCYCPAJNRPK-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD CC[C@@H](CCO)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 134393150 XPJKEZZCBWIREF-GXSJLCMTSA-N 272.305 -0.097 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 165550067 KXJUBVGXICHTDR-QMMMGPOBSA-N 254.246 -0.277 5 20 CBBD C[C@@H](CO)N(CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O 190919038 NDNZQPUZEQHOCY-VHSXEESVSA-N 272.305 -0.145 5 20 CBBD COCCCONC(=O)Cn1cc([N+](=O)[O-])ccc1=O 287822449 NCKHVHDVHTYWAP-UHFFFAOYSA-N 285.256 -0.159 5 20 CBBD CN(C)S(=O)(=O)NCCNc1ccc([N+](=O)[O-])cn1 289210664 VVYCTPFVYHMTIB-UHFFFAOYSA-N 289.317 -0.202 5 20 CBBD CN(C)[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 330675915 STGDUNHMBBDHRL-SECBINFHSA-N 282.304 -0.261 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NCc1c([N+](=O)[O-])ncn1C 331274963 PXINDFVFSSVFCG-CBAPKCEASA-N 267.289 -0.058 5 20 CBBD CN1CCO[C@@H]2CN(CCn3cc([N+](=O)[O-])cn3)C[C@H]21 331755627 HOZBFMHIENUTSA-VXGBXAGGSA-N 281.316 -0.194 5 20 CBBD CCc1[nH]nc(C(=O)N(C)[C@H]2CCNC2=O)c1[N+](=O)[O-] 340718452 VQDPYUNCIFOHHR-ZETCQYMHSA-N 281.272 -0.159 5 20 CBBD NC(=O)N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 358041321 KIXAHTOOOUQJMF-LURJTMIESA-N 267.245 -0.194 5 20 CBBD CC[C@](C)(NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 362340807 UKVQIMPXXIXYIY-VIFPVBQESA-N 271.233 -0.444 5 20 CBBD NC(=O)[C@H]1[C@H]2CCC[C@H]2CN1c1ncc([N+](=O)[O-])c(N)n1 365003091 XPDARSHMNRIBRX-ACLDMZEESA-N 292.299 0.057 5 20 CBBD Nc1nccc(C(=O)N2CC[C@H](O)C2)c1[N+](=O)[O-] 548713080 UZIFCXSDWHMODO-LURJTMIESA-N 252.230 -0.221 5 20 CBBD O=[N+]([O-])c1c(N2CCOCC2)ncnc1N1CC(O)C1 598593950 YKKMDPYBZVZFSW-UHFFFAOYSA-N 281.272 -0.598 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2C[C@H]1CO2 600778486 ZXZFUUQSPPYXGA-UWVGGRQHSA-N 279.252 -0.244 5 20 CBBD CCC1(O)CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 619876686 KMLNNIHUZXGELZ-UHFFFAOYSA-N 281.268 -0.260 5 20 CBBD C[C@@H](O)C[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840418052 DQQCKJUTAPLPJH-ZYUZMQFOSA-N 258.274 -0.350 5 20 CBBD Nc1ccc(C(=O)NCCN2CC[C@H](O)C2)cc1[N+](=O)[O-] 863830857 YDVBJFTWUQWYLT-JTQLQIEISA-N 294.311 -0.027 5 20 CBBD Cn1ccnc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022061559 OCZVDOLBSBLCTQ-LMLFDSFASA-N 293.327 -0.178 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H]2CNC[C@H]21 1580812222 SDUBUDQYGMQQET-POYBYMJQSA-N 251.246 -0.248 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C)C(=O)O 1594469815 NNVDHKUOSJPZCM-YFKPBYRVSA-N 256.218 -0.311 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@]1(O)CCSC1 267024780 XHJVHFYRQRGICB-SNVBAGLBSA-N 286.313 -0.225 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)(C)CO 270384112 DJUDMKNMRACQTQ-UHFFFAOYSA-N 256.262 -0.013 5 20 CBBD Cn1c(S)nnc1CNC(=O)c1cc([N+](=O)[O-])[nH]n1 285529902 HIRLGDBYSOOGLV-UHFFFAOYSA-N 283.273 -0.335 5 20 CBBD C[C@@H](O)CN(CCO)c1ncc([N+](=O)[O-])c(N)n1 291140207 NUAIZRWGARONEI-ZCFIWIBFSA-N 257.250 -0.854 5 20 CBBD CC(=O)NCCCN(C)c1ncc([N+](=O)[O-])c(N)n1 301304113 XBODAEOKPFNOAZ-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD O=C(NCCn1ncnn1)c1ccc([N+](=O)[O-])c(O)c1 338960382 GEOBGHSXROIUBC-UHFFFAOYSA-N 278.228 -0.283 5 20 CBBD CC(C)(C)NC(=O)CCN=c1nc(N)c([N+](=O)[O-])c[nH]1 341822617 XZTGXMWPUQNPBF-UHFFFAOYSA-N 282.304 0.106 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCCOCCO 354346599 UWSZYGHFLAABKN-UHFFFAOYSA-N 269.257 -0.084 5 20 CBBD CN1CCN(CCCNc2ncc([N+](=O)[O-])cn2)CC1 354515275 XSDJHPLUFQCLHH-UHFFFAOYSA-N 280.332 0.434 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 356008061 PWLZPJVZWDLQHY-RXMQYKEDSA-N 268.229 -0.440 5 20 CBBD Cn1nnnc1CNC(=O)c1ccc([N+](=O)[O-])n1C 357110129 YDYPTHZNLNOBEF-UHFFFAOYSA-N 265.233 -0.613 5 20 CBBD CNCCN(C)S(=O)(=O)c1cccnc1[N+](=O)[O-] 519767038 GOFPZTIZNDXJRS-UHFFFAOYSA-N 274.302 -0.170 5 20 CBBD O=C(CN1C(=O)CCC1=O)OCCn1cc([N+](=O)[O-])cn1 748103469 XYQZPZOSDCDBKQ-UHFFFAOYSA-N 296.239 -0.517 5 20 CBBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cn1)C(=O)NC(N)=O 761977683 ZHQXDCKWFOZWGK-YFKPBYRVSA-N 282.212 -0.270 5 20 CBBD O=C(O)CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 833247717 VIQPVGUNLCNFEL-JTQLQIEISA-N 284.272 -0.299 5 20 CBBD CO[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1O 836961998 MXDJPEVFIWNPPX-IJLUTSLNSA-N 296.279 -0.154 5 20 CBBD O=C(N[C@@H](CO)Cc1ccncc1)[C@@H]1C[C@H]1[N+](=O)[O-] 848374311 FSQYOVHYTZOELD-GMTAPVOTSA-N 265.269 -0.234 5 20 CBBD COC[C@@H]1CCCN1NC(=O)Cn1ccc([N+](=O)[O-])n1 862603745 UBWRTQFOZBQTMY-VIFPVBQESA-N 283.288 -0.067 5 20 CBBD CCN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)C(N)=O 1106943444 JORQUYUMNOCQHL-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD C[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ncnn1C 1118090537 LQRIYBBHAQYWCF-WCBMZHEXSA-N 295.303 -0.369 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](O)C1 1261527588 VYVOBCAETKKNKY-SSDOTTSWSA-N 254.246 -0.075 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1CCN2CCC[C@@H]2C1 1317997161 SSIZHSYTGCGMIM-VHSXEESVSA-N 294.315 -0.071 5 20 CBBD C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])S(C)(=O)=O 1336532540 UOTLSIRPZLKYJC-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD NC[C@H](O)C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 1580325775 NKDKAENTIZOZAR-LBPRGKRZSA-N 294.311 -0.437 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](F)C(=O)O 1600720160 GIMRRFVEXQTBKF-LURJTMIESA-N 274.208 -0.361 5 20 CBBD O=C(O)[C@H]1C[C@@H](O)CN1CCn1ccc([N+](=O)[O-])n1 1601774095 WOVFSBSGMGRJID-HTQZYQBOSA-N 270.245 -0.689 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCNc1cnccn1 47492820 QHVSHAAQLHLSHV-UHFFFAOYSA-N 291.271 -0.190 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCn2ccnc2)c1 49076857 SSIYMKOQVORSCR-NSHDSACASA-N 280.288 -0.362 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H](O)[C@H](O)C1 93091852 BHYMSWXKJLYIEP-DTORHVGOSA-N 288.281 -0.679 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 110683442 MHLDTHSZZCEBIV-VIFPVBQESA-N 281.272 -0.472 5 20 CBBD NCCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 122456875 LZXNHULSHRPOEA-UHFFFAOYSA-N 263.250 -0.029 5 20 CBBD CS(=O)(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1N 122786926 LQJBSVHQTLESPY-UHFFFAOYSA-N 287.297 -0.049 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCNC1 178485133 DIGRMWRHPOZVGE-SECBINFHSA-N 267.289 -0.093 5 20 CBBD COC(=O)[C@@H]1[C@H](O)CCCN1CCn1ccc([N+](=O)[O-])n1 189565108 CLINGQDELMIGSP-KOLCDFICSA-N 298.299 -0.210 5 20 CBBD CN1CC[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)C1=O 267108757 WXDSTGVIMJULJJ-VIFPVBQESA-N 267.289 -0.046 5 20 CBBD CC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 292493384 WSXMLYULIUCSHH-QMMMGPOBSA-N 256.262 -0.013 5 20 CBBD CNC(=O)[C@@H](CO)Nc1nc2sccn2c1[N+](=O)[O-] 302160985 PMNOMBRSSPUULU-RXMQYKEDSA-N 285.285 -0.177 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCNC1 342761028 RHYMMOWCSJHJEB-SECBINFHSA-N 267.289 -0.093 5 20 CBBD CC[C@H](C)NC(=O)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 343497706 RLZXYMOIODVJKK-QMMMGPOBSA-N 298.303 -0.393 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CC(=O)N(C2CC2)C1 344894610 RPMZYMQPENCSRW-UHFFFAOYSA-N 291.267 -0.024 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)OC 347822546 PMJGMJNGVFWEQF-SSDOTTSWSA-N 286.244 -0.754 5 20 CBBD COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)OC 347822550 PMJGMJNGVFWEQF-ZETCQYMHSA-N 286.244 -0.754 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-])OC 347858704 YSQMGHPNWCIKQY-ZCFIWIBFSA-N 286.244 -0.456 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 436992382 VFOHJGSPJWKJQX-SECBINFHSA-N 298.251 -0.046 5 20 CBBD COCC(COC)Nc1ncc([N+](=O)[O-])c(N)n1 450791541 MEUARSCQWOMUMU-UHFFFAOYSA-N 257.250 0.040 5 20 CBBD CC(C)C(=O)NCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548057546 DKPGPORZHORCNS-UHFFFAOYSA-N 295.299 0.074 5 20 CBBD CNC(=O)[C@@H](CO)Nc1ccc([N+](=O)[O-])c(OC(C)C)n1 563424830 FFAKJLRFBIUWPD-MRVPVSSYSA-N 298.299 0.296 5 20 CBBD N[C@H]1C[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 567909562 GVSCTPUECKWECI-OCAPTIKFSA-N 253.262 -0.355 5 20 CBBD CCNC(=O)NCCNC(=O)c1ccnc(N)c1[N+](=O)[O-] 569744075 QVWBYPINNBTOFZ-UHFFFAOYSA-N 296.287 -0.379 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])o1 600471491 SGKMPSSMYLTPRR-ZCFIWIBFSA-N 272.213 -0.158 5 20 CBBD CCN(CC(=O)N(C)C)C(=O)c1c([N+](=O)[O-])cnn1C 611235250 OSRSGPHZMAXOMZ-UHFFFAOYSA-N 283.288 -0.121 5 20 CBBD COC(=O)[C@H]1CSCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 895095316 IHUNXOKSRCOYTR-BWZBUEFSSA-N 274.298 -0.231 5 20 CBBD COCCOc1ccc(CNCC[N+](=O)[O-])nn1 1120603607 QRLAZHMTKRTMAA-UHFFFAOYSA-N 256.262 -0.132 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nccn(C)c1=O 1252421581 ZKSVPMXFHLCOSH-UHFFFAOYSA-N 292.255 -0.168 5 20 CBBD CCS(=O)(=O)C[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1324934193 SIMIPPSYTHGBGX-ZCFIWIBFSA-N 290.301 -0.129 5 20 CBBD C[C@]1(NC(=O)Cn2cnc([N+](=O)[O-])n2)CCNC1 1350422925 LCHBWFHVEPWPEY-VIFPVBQESA-N 254.250 -0.946 5 20 CBBD CN1C[C@@H](C(=O)O)N(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1=O 1606198952 BTJYRMOYNHSXDG-ZETCQYMHSA-N 296.239 -0.710 5 20 CBBD O=C1CN(CC(=O)NCc2ccccc2[N+](=O)[O-])CCN1 51380272 PVIDYEKUEZRGMR-UHFFFAOYSA-N 292.295 -0.357 5 20 CBBD COC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 71267822 AFFFFWCSMYCZET-ZETCQYMHSA-N 257.246 -0.330 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)Cn1ncc([N+](=O)[O-])c1N 161006254 FXZQFHSIEBPGHR-UHFFFAOYSA-N 298.303 -0.596 5 20 CBBD C[C@@H](CS(C)(=O)=O)Nc1ncc([N+](=O)[O-])c(N)n1 264905934 CXXXCEAAMLUPMQ-YFKPBYRVSA-N 275.290 -0.188 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 273500641 QPXBVBJMRTWSBR-ZETCQYMHSA-N 283.240 -0.559 5 20 CBBD CCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CCNC1=O 283053315 RHQAUSMTEKTRSQ-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD O=C(NC[C@H](O)COCC1CC1)c1n[nH]cc1[N+](=O)[O-] 344030774 MJXIJZBSJVJDPE-QMMMGPOBSA-N 284.272 -0.165 5 20 CBBD NC(=O)Cn1cc(Nc2ncc([N+](=O)[O-])cn2)cn1 354526335 MXLVRHLBIKRCBR-UHFFFAOYSA-N 263.217 -0.190 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)C[C@@H]1C 371049178 NQSQXRYAFMEXGG-QMMMGPOBSA-N 295.299 -0.163 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)N1 436884958 BTCLOSMEFKFACM-MRVPVSSYSA-N 280.240 -0.625 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1[C@H]2CC[C@H]1CNC2 595993122 VVWVJOOMFANHCE-BQBZGAKWSA-N 251.246 -0.106 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCNC1=O 619867892 LNGATKKLHCAMBU-SECBINFHSA-N 295.299 -0.176 5 20 CBBD O=C(COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])NC(=O)NC1CC1 840672352 JUXMRZMKCUAIIN-RNFRBKRXSA-N 271.229 -0.817 5 20 CBBD Nc1nccc(C(=O)N2CC(n3ccnn3)C2)c1[N+](=O)[O-] 847684994 CUFKRRVQASKUCE-UHFFFAOYSA-N 289.255 -0.139 5 20 CBBD C/C=C(\C)C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991278451 HRWJMSGCWNNJAX-ZCZHLORFSA-N 267.285 -0.055 5 20 CBBD COCCNC(=O)CNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1251779412 PUSSESTYDDLNBN-UHFFFAOYSA-N 299.287 -0.871 5 20 CBBD C[C@@H]1C[C@H](N)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1326702505 MCGZHRHPFDFFFQ-HTQZYQBOSA-N 268.277 -0.476 5 20 CBBD Cc1nc(N2C[C@@H](CO)[C@H](CO)C2)ncc1[N+](=O)[O-] 1328718094 HLZNVBKYLMDLFK-IUCAKERBSA-N 268.273 -0.270 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(CO)CCOCC1 1335030013 CRVIXHVNBDYSKR-UHFFFAOYSA-N 298.299 -0.303 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NN1CCCC1=O 1337932383 OVTQDVVWISNMEV-UHFFFAOYSA-N 253.218 -0.555 5 20 CBBD O=C(N[C@@H](CO)c1cnn[nH]1)c1cnc(O)c([N+](=O)[O-])c1 1577973001 PUORMADGSXFIDP-ZETCQYMHSA-N 294.227 -0.723 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@@H]1CCNC[C@H]1F 1580579153 ZFSMHYAVJVHNMJ-RKDXNWHRSA-N 298.274 -0.427 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[C@@H](O)C1 35200693 OJEYQUVLYHRGAK-SECBINFHSA-N 254.246 -0.225 5 20 CBBD Cc1nn(C)c(NCCN2C(=O)CNC2=O)c1[N+](=O)[O-] 264896247 ANXZAJOCFGXJED-UHFFFAOYSA-N 282.260 -0.400 5 20 CBBD O=[N+]([O-])c1cnn(CCN(CCO)CCCO)c1 266935158 NWWAMPBFKCQMAL-UHFFFAOYSA-N 258.278 -0.532 5 20 CBBD CCNC(=O)N1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1 269393909 XUUDCBXFBDLXJG-UHFFFAOYSA-N 295.303 -0.182 5 20 CBBD CN(C)C1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1 271329926 AWFDFVRYGAWMMB-UHFFFAOYSA-N 253.262 -0.286 5 20 CBBD CC(=O)N1CCN(CCNc2ncc([N+](=O)[O-])cn2)CC1 273242495 YWISVAARCTZNAF-UHFFFAOYSA-N 294.315 -0.039 5 20 CBBD CCOC1CC(O)(CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 277840923 WYVDIVOMDSHFEA-UHFFFAOYSA-N 298.299 -0.163 5 20 CBBD CN(C)C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CCO1 330554248 DERGVNAMQLBHQR-SECBINFHSA-N 297.315 -0.269 5 20 CBBD O=c1c([N+](=O)[O-])cccn1CCN1CCCS1(=O)=O 331303201 CRXCAPUITJLVGP-UHFFFAOYSA-N 287.297 -0.208 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 343565954 KEQRXWXRZWMPJP-ZETCQYMHSA-N 281.272 -0.084 5 20 CBBD COC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)OC 351793058 MNZRFUYTXSLWJU-ZETCQYMHSA-N 286.244 -0.905 5 20 CBBD COC(=O)C1(C)CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 424142373 XYZAJFAAJABYAI-SNVBAGLBSA-N 298.299 -0.353 5 20 CBBD CNC(=O)N[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 549724723 ZUOUAKRHZXPKJX-ZCFIWIBFSA-N 282.260 -0.539 5 20 CBBD NC(=O)COCCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] 593529441 DTANPMGFHRPQHV-UHFFFAOYSA-N 299.258 -0.106 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748714996 OJLFHMNAXZNQKZ-MRVPVSSYSA-N 297.267 -0.176 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCn1ccnn1 782491708 SEQMNEXGJFJVIL-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD O=[N+]([O-])CCN1CCC(N2CCCS2(=O)=O)CC1 930708927 FQQFQLUDMPXXJV-UHFFFAOYSA-N 277.346 -0.237 5 20 CBBD Cn1ncnc1CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1022063670 GGEPSVBMMQYKOR-UTINFBMNSA-N 294.315 -0.783 5 20 CBBD Cc1noc(CN2CC(N(C)C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1042705838 ZFSMKCPIEWSHNL-NXEZZACHSA-N 295.299 -0.314 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N(C)CCNC(=O)CC(N)=O 1099970679 DCMZDLDMFSDJNY-UHFFFAOYSA-N 295.299 -0.274 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H](C(N)=O)C1 1115994839 HQUDXAFFWRNCFY-MRVPVSSYSA-N 281.272 -0.566 5 20 CBBD C[C@@H]1C[C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)CCN1 1261494989 MUZGEULUIKTVGE-HTQZYQBOSA-N 268.277 -0.557 5 20 CBBD Cc1[nH]nc(C(=O)N2CCS(=O)CC2)c1[N+](=O)[O-] 1318607745 KVSITBKWJRDXTO-UHFFFAOYSA-N 272.286 -0.169 5 20 CBBD CC[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1590475986 BXFADPKQRWIQEH-RXMQYKEDSA-N 253.222 -0.258 5 20 CBBD O=C(O)[C@H]1[C@@H](O)CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-] 1601752037 OGRMOQGDOKOUHU-NKWVEPMBSA-N 284.228 -0.632 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1ccc([N+](=O)[O-])cc1F 43570383 CFWYQBJAQSLDOA-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H](C(=O)O)C1 43700693 PVOWAVQHNZMPSC-SECBINFHSA-N 283.240 -0.141 5 20 CBBD C[C@@H](Cn1cccn1)NC(=O)Cn1cnc([N+](=O)[O-])n1 48777501 FIAOAXSBXCGCEW-QMMMGPOBSA-N 279.260 -0.412 5 20 CBBD CCCN(CC(=O)N(C)C)C(=O)Cn1cnc([N+](=O)[O-])n1 128450833 LFZDPPHQQQYLHT-UHFFFAOYSA-N 298.303 -0.487 5 20 CBBD NCC(F)(F)CNC(=O)CCn1cc([N+](=O)[O-])cn1 190314855 AUPJDOIOAPZEAL-UHFFFAOYSA-N 277.231 -0.108 5 20 CBBD COC(=O)[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1 270731383 POBMURHOSNUUIK-LURJTMIESA-N 268.229 -0.047 5 20 CBBD COCCNC(=O)CNC(=O)Nc1ccncc1[N+](=O)[O-] 272768172 WXPGGSZTZWSNBW-UHFFFAOYSA-N 297.271 -0.126 5 20 CBBD CN1CCN(CCNC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 330473546 HQPYWGDQYSSOIQ-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD COC[C@@H](O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 338912014 IWTYOJDYIWEMJX-JTQLQIEISA-N 297.267 -0.343 5 20 CBBD CCCCN(CCO)C(=O)Cn1cnc([N+](=O)[O-])n1 343049308 UDPLVCNNGZQRJG-UHFFFAOYSA-N 271.277 -0.193 5 20 CBBD NC(=O)N[C@@H](CO)C(=O)NCCc1ccc([N+](=O)[O-])cc1 345237023 DATPYNBNDYBJGD-JTQLQIEISA-N 296.283 -0.717 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCC[C@H]2CCO)c1 426257371 VPZJLVZWIISJRA-JQWIXIFHSA-N 284.316 -0.001 5 20 CBBD CC(CO)(CO)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 593621679 RMGAFGZHMJQSQQ-UHFFFAOYSA-N 297.267 -0.607 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])s1 763698857 NIJLZUWIYPJCPH-RXMQYKEDSA-N 273.270 -0.507 5 20 CBBD CNC(=O)[C@@H](O)CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 843109838 HFVUUXZECYCNJO-MNOVXSKESA-N 283.284 -0.675 5 20 CBBD CO[C@@H](C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cn1 847892862 INVSNTZWNSLNLT-LURJTMIESA-N 289.269 -0.170 5 20 CBBD CN(CCc1ccccn1)C(=O)CNCC[N+](=O)[O-] 905087642 FTCRCVZJUWCJCO-UHFFFAOYSA-N 266.301 -0.051 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@H]1CO 934015803 BWSSTEVYNMWISB-JTQLQIEISA-N 253.258 -0.177 5 20 CBBD NC(=O)C1(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)CC1 1094079717 YNHKCYZCCQDIIC-UHFFFAOYSA-N 293.283 -0.217 5 20 CBBD Cc1cc(NC/C=C/CNC(=O)C(N)=O)ncc1[N+](=O)[O-] 1107480854 VWVCSMSLPAZVFD-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1COCO1 1118934442 BXXWTBOLFOPPDW-ZCFIWIBFSA-N 256.218 -0.569 5 20 CBBD CC(C)[C@@H](NC(=O)c1c([N+](=O)[O-])cnn1C)C(N)=O 1342800567 NRQVSRGHKSCFQI-SSDOTTSWSA-N 269.261 -0.432 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCO[C@H](C(=O)O)C1 1594664872 CSLHYDYMJXLOAU-QMMMGPOBSA-N 296.239 -0.502 5 20 CBBD C[C@@H](CO)CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 86623545 GABAKSCAFCMGER-ZCFIWIBFSA-N 255.230 -0.359 5 20 CBBD CN(CC(=O)NC1CC1)C(=O)CCn1cc([N+](=O)[O-])cn1 97681484 BNFIZFJXYOIYOO-UHFFFAOYSA-N 295.299 -0.082 5 20 CBBD CCCNC(=O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 132792988 JPHRNYQQHLZMPI-UHFFFAOYSA-N 298.303 -0.383 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)Cc1cccc([N+](=O)[O-])c1 135861773 VFKMWTNVGDRPJV-SNVBAGLBSA-N 282.252 -0.213 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(C(=O)O)CC1 138924021 RMBGZOLMTXEPQH-UHFFFAOYSA-N 268.229 -0.228 5 20 CBBD CNC(=O)NC(=O)Cn1cc(Cl)cc([N+](=O)[O-])c1=O 153578520 QTZHCFPRHNYVED-UHFFFAOYSA-N 288.647 -0.135 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCCn1ccnn1 230725474 QONFOGDYEAVXNK-UHFFFAOYSA-N 291.271 -0.016 5 20 CBBD CNC(=O)[C@H]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 264814396 WFOHHPHCMBUWOH-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD CN1CCO[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])[nH]n3)C[C@H]21 284646722 FXQDGYNOOVLIOE-ZJUUUORDSA-N 295.299 -0.137 5 20 CBBD CCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 286223281 DCUXHDKPNDYRKR-QMMMGPOBSA-N 269.261 -0.439 5 20 CBBD Nc1nc(=NCc2ncccc2O)[nH]cc1[N+](=O)[O-] 359894641 CRNQOJPAQAZJKV-UHFFFAOYSA-N 262.229 0.102 5 20 CBBD O=C(NCc1nc(O)n[nH]1)c1ccc([N+](=O)[O-])[nH]1 443514848 YYEKVGLYTXTDAZ-UHFFFAOYSA-N 252.190 -0.323 5 20 CBBD C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)N1 599102359 DLRPSHBJNZZJPT-KNVOCYPGSA-N 252.278 0.154 5 20 CBBD COC(=O)C[C@@H](O)Cn1cccc([N+](=O)[O-])c1=O 610510103 SRAYLNCGSZDNJB-SSDOTTSWSA-N 256.214 -0.320 5 20 CBBD O=[N+]([O-])c1c(-c2nn[nH]n2)ccnc1NCCO 823624716 FZVJBLDCYYWACY-UHFFFAOYSA-N 251.206 -0.426 5 20 CBBD CC(CO)(CO)CNC(=O)CCC(C)(C)[N+](=O)[O-] 846224645 WMJURVWDPARLJO-UHFFFAOYSA-N 262.306 -0.071 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 863015521 CLJPCSBWHHPULO-QMMMGPOBSA-N 297.267 -0.169 5 20 CBBD CN(C(=O)c1cnco1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 954870328 NQISTCGGIKFQFW-RKDXNWHRSA-N 294.267 -0.377 5 20 CBBD Cn1nncc1C(=O)NCCNc1ccc([N+](=O)[O-])cn1 1093593098 BGBGTFKPLLKECV-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)Cc1cn(C)nn1 1118787995 IVWWDDDXTVGHAB-UHFFFAOYSA-N 293.287 -0.113 5 20 CBBD C[C@@H](c1nnc(N2CCN3CCOC[C@H]3C2)n1C)[N+](=O)[O-] 1338207305 AHTXJCXBPIZFFV-VHSXEESVSA-N 296.331 -0.326 5 20 CBBD CCNC(=O)NCCNC(=O)c1c([N+](=O)[O-])cnn1C 1343999183 VXPQDWPKESBNRI-UHFFFAOYSA-N 284.276 -0.623 5 20 CBBD O=C(O)C[C@H](O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1601908123 AKEDCXJRHITRJF-GXSJLCMTSA-N 298.251 -0.420 5 20 CBBD O=C1C[C@@H](Cn2cc(C(=O)O)cc([N+](=O)[O-])c2=O)CN1 1602637547 QVTWIWSWACPOCY-ZCFIWIBFSA-N 281.224 -0.409 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)NC(CO)CO 73818168 XHDZMGAYXOYYBQ-UHFFFAOYSA-N 283.284 -0.210 5 20 CBBD C[C@H](CCO)NC(=O)NCCn1cc([N+](=O)[O-])cn1 121582950 SJJXSBHJPWLROR-MRVPVSSYSA-N 271.277 -0.139 5 20 CBBD COC(=O)[C@H]1C[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1 122256281 LZNRYVDBWMXEHA-IUCAKERBSA-N 282.256 -0.283 5 20 CBBD C[C@@H](O)C(=O)N1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 152767458 DNDJKBYORIGQTJ-SNVBAGLBSA-N 297.315 -0.684 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N1CCC[C@H]1CO 161466737 QAGMKJQSCFSTJN-VIFPVBQESA-N 283.288 -0.042 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CNC(=O)C1 230724364 VBKDKXFBYXPEJE-YFKPBYRVSA-N 265.229 -0.810 5 20 CBBD CCOC(=O)c1ccnc(NC[C@@H](O)CO)c1[N+](=O)[O-] 269101160 AEKWLWYDGCWOLA-SSDOTTSWSA-N 285.256 -0.068 5 20 CBBD CNC(=O)[C@H]1CN(c2ncccc2[N+](=O)[O-])CCO1 273168471 KATUNAXNDJOLGQ-SECBINFHSA-N 266.257 -0.059 5 20 CBBD COC(=O)c1cnc(N2C[C@H](O)[C@@H](O)C2)c([N+](=O)[O-])c1 277519029 UYWKJUZVRSSMCP-IUCAKERBSA-N 283.240 -0.682 5 20 CBBD O=C(NCCCOCCO)c1cc([N+](=O)[O-])[nH]n1 285890912 UCEGZUVSCIFRNJ-UHFFFAOYSA-N 258.234 -0.553 5 20 CBBD Nc1nc(=NCCn2ccccc2=O)[nH]cc1[N+](=O)[O-] 354084209 DKZXWOISPSXIAT-UHFFFAOYSA-N 276.256 -0.337 5 20 CBBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])nn1C)C(=O)N(C)C 356160013 REONTOCZEHRPFY-ZCFIWIBFSA-N 269.261 -0.465 5 20 CBBD CC[C@](NC(=O)Cn1cnc([N+](=O)[O-])n1)(C(N)=O)C(C)C 359175447 IZRUYGWHACRDMR-LLVKDONJSA-N 298.303 -0.407 5 20 CBBD Cn1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)n1 436833534 JVSKQSYIAIYSHD-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cc(Cl)c1=O)Nc1nn[nH]n1 439266273 BBCMUGRAERFLAV-UHFFFAOYSA-N 299.634 -0.438 5 20 CBBD CCn1cc(S(=O)(=O)N(C)CCNC)c([N+](=O)[O-])n1 440828543 UQJSDMQMIINABM-UHFFFAOYSA-N 291.333 -0.349 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc(O)c([N+](=O)[O-])c1 447635950 FHHFYGXZGGIRTK-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD Nc1nc(N[C@H]2C[C@H](C(N)=O)C2)ncc1[N+](=O)[O-] 599143323 IJAGEDARRDGMSJ-SYDPRGILSA-N 252.234 -0.357 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN2C(=O)NC[C@H]2C1 610588896 DFWHOKDIBJBFPE-ZETCQYMHSA-N 266.261 -0.458 5 20 CBBD NC(=O)[C@H](O)CNC(=O)CCc1cccc([N+](=O)[O-])c1 618924020 OKDBWBRDRNYHHQ-SNVBAGLBSA-N 281.268 -0.510 5 20 CBBD O=C(O)[C@@H]1CCN(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 819258227 WTTGVOMSINLLHD-MRVPVSSYSA-N 297.271 -0.093 5 20 CBBD CC[C@@](COC)(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)OC 840474256 FGMPLNUGODJLKR-XLDPMVHQSA-N 274.273 -0.264 5 20 CBBD CN1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](CO)C1 912736983 DOUVCMZQVPNALQ-SNVBAGLBSA-N 273.333 -0.043 5 20 CBBD O=C(N[C@H]1C[C@@H](NCc2ncccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022064100 WIBNIKPRJHTQCI-LMLFDSFASA-N 291.311 -0.121 5 20 CBBD NC(=O)CC(=O)NCCNc1ccnc(O)c1[N+](=O)[O-] 1093539070 SWXCBGFMXHMKPP-UHFFFAOYSA-N 283.244 -0.901 5 20 CBBD COC(=O)CN(C)CCNC(=O)c1ccc([N+](=O)[O-])[nH]1 1116454119 IGJXGUOEFGDXHQ-UHFFFAOYSA-N 284.272 -0.243 5 20 CBBD Cc1c([N+](=O)[O-])ccc(=O)n1Cc1noc(CN)n1 1118199541 NEGJWKMIPJAKJT-UHFFFAOYSA-N 265.229 -0.045 5 20 CBBD COCCN(CCOC)c1nnc(C[N+](=O)[O-])n1C 1121392105 PDTOYJVQYGMOEE-UHFFFAOYSA-N 273.293 -0.309 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nn1cnnc1 1320127445 KLUNURRYJQAXGK-UHFFFAOYSA-N 265.233 -0.148 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nn1cnnc1 1320356341 ABHJNCGGVIMNLF-UHFFFAOYSA-N 290.239 -0.314 5 20 CBBD CNc1nccc(C(=O)N=c2nc[nH]n2C)c1[N+](=O)[O-] 1327884947 BPMNZBOHXLHWPY-UHFFFAOYSA-N 277.244 -0.166 5 20 CBBD CC(=O)N1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 1329606850 WCXQIDZYPRSNHH-SNVBAGLBSA-N 295.299 -0.082 5 20 CBBD CN(C)CCN(CC(=O)O)C(=O)c1cc([N+](=O)[O-])n[nH]1 1349308802 ZFUMJEHRNAYDEX-UHFFFAOYSA-N 285.260 -0.594 5 20 CBBD C[C@@H](O)CN(C)c1ncc(-c2nn[nH]n2)cc1[N+](=O)[O-] 1591731412 GNAHMPLHAYBKGZ-ZCFIWIBFSA-N 279.260 -0.013 5 20 CBBD O=C(O)CCCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 1601992392 FSYKPEVKEVDTBZ-VIFPVBQESA-N 272.261 -0.393 5 20 CBBD COC(=O)[C@@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 50469846 FPIAFXNOEZSGLA-ZCFIWIBFSA-N 256.218 -0.531 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1csc([N+](=O)[O-])c1 90261696 BUCJEZDFVZOIHV-YFKPBYRVSA-N 260.227 -0.168 5 20 CBBD CN(CCS(C)(=O)=O)Cn1nccc1[N+](=O)[O-] 102765451 GTSZXVDIFMYBLF-UHFFFAOYSA-N 262.291 -0.275 5 20 CBBD NCC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 169191196 BQIRGXSQIGVWGV-QMMMGPOBSA-N 265.273 -0.039 5 20 CBBD O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H](O)[C@@H](O)C2)cc1 212422611 ALCIZAAAINKCRK-UWVGGRQHSA-N 288.281 -0.679 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1csc([N+](=O)[O-])c1 345296358 FTSKEYZGBWHXJH-ZCFIWIBFSA-N 274.254 -0.080 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 352984706 FXVQPOLQBDHLJA-QMMMGPOBSA-N 292.251 -0.348 5 20 CBBD C[C@@H]1CC(=O)NCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 371055768 QQWXNEVGCCLJAA-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD COC[C@@](C)(O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 525777161 KILNLIHPHUUAMZ-NSHDSACASA-N 286.288 -0.305 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1ccc([N+](=O)[O-])cn1 579794284 BECYDKHHECKTQD-UHFFFAOYSA-N 279.212 -0.361 5 20 CBBD CNc1nccc(C(=O)NCC[C@H](C)O)c1[N+](=O)[O-] 594302011 ZVEFOKAFKUQAMZ-ZETCQYMHSA-N 268.273 0.532 5 20 CBBD CN1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 595784379 TUXYYUXVZZEBSL-NSHDSACASA-N 297.315 -0.684 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)COc1cccc([N+](=O)[O-])c1 763704222 YVFHFBNFNATNNC-JTQLQIEISA-N 297.267 -0.803 5 20 CBBD CCS(=O)(=O)C[C@@H](C)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839683248 DWSANYFLCMECER-IWSPIJDZSA-N 278.330 -0.067 5 20 CBBD COC[C@@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 886866637 NAYJWTBEBVDTNT-MRVPVSSYSA-N 284.272 -0.184 5 20 CBBD CNC(=O)C1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 1324007559 SGYUEORXABHFIJ-UHFFFAOYSA-N 267.245 -0.854 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1C[C@H](C(=O)O)C1 1601383958 DDMXLWZAKRIBEI-ZKCHVHJHSA-N 295.251 -0.264 5 20 CBBD CNC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 7706659 HLWPHEGHSOJDOW-UHFFFAOYSA-N 263.209 -0.063 5 20 CBBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1N)C(=O)NC(N)=O 21741935 FZMSTRAEUVIUCU-RXMQYKEDSA-N 296.239 -0.083 5 20 CBBD Cc1nn(C)c(NCCNS(C)(=O)=O)c1[N+](=O)[O-] 36749406 VYYTVPGQHGYDCO-UHFFFAOYSA-N 277.306 -0.402 5 20 CBBD C[S@](=O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 158093073 KARDUUPJHDACBC-NIVTXAMTSA-N 276.318 -0.880 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 191729448 GRDCXSNMPCZQCL-PSASIEDQSA-N 284.272 -0.601 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 228492566 JLPHLDZMZSTSDA-QMMMGPOBSA-N 287.659 -0.176 5 20 CBBD C[C@@H](C[S@@](C)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286105534 OXLXBORJWIYUDJ-IEMIWKFJSA-N 260.275 -0.185 5 20 CBBD C[C@@H](O)CN(C)c1ncc([N+](=O)[O-])cc1C(N)=O 292372806 PQUKXASUJFOXNU-ZCFIWIBFSA-N 254.246 -0.094 5 20 CBBD CCc1[nH]nc(C(=O)NCC(=O)NCCOC)c1[N+](=O)[O-] 344930216 OHKDHGSZXSQSMU-UHFFFAOYSA-N 299.287 -0.627 5 20 CBBD CC(CO)(CO)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 357703343 FHHULBBTGJULDJ-UHFFFAOYSA-N 298.251 -0.203 5 20 CBBD Nc1c(C(=O)N2CC[C@@H](CO)[C@H](O)C2)cccc1[N+](=O)[O-] 557629242 MTRFZZPHFXWLIG-GZMMTYOYSA-N 295.295 -0.008 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)CCF 593862933 NSRSHWFDKURLMU-ZETCQYMHSA-N 260.225 -0.372 5 20 CBBD O=C(N=c1cc[nH]cc1[N+](=O)[O-])NN1CCCNC1=O 755294979 BSMOULRCQLGYBE-UHFFFAOYSA-N 280.244 -0.137 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCc1cnccn1 1254145285 RKIXDPWWVHQZFL-UHFFFAOYSA-N 276.256 -0.060 5 20 CBBD CCS(=O)(=O)CCNC(=O)c1c[nH]nc1[N+](=O)[O-] 1324864837 ROJCSLLNHRHMOP-UHFFFAOYSA-N 276.274 -0.518 5 20 CBBD NC(=O)c1cc(NC(CO)CO)ccc1[N+](=O)[O-] 1327686789 CKFGUAWJQRPYTH-UHFFFAOYSA-N 255.230 -0.541 5 20 CBBD COCCN(CCC(=O)O)C(=O)c1c[nH]nc1[N+](=O)[O-] 1574156504 KDPWHTQNSNLQDI-UHFFFAOYSA-N 286.244 -0.119 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NCCC(=O)O 1594665022 LZDXSJIIKQUAAH-UHFFFAOYSA-N 254.202 -0.224 5 20 CBBD O=C(O)CN1CCC[C@H]1COC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1606258828 YEVTVKFCAAPWIK-DJLDLDEBSA-N 272.257 -0.256 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](CN)C1CC1 159112920 SSTARJRCWNGEQV-VIFPVBQESA-N 267.289 -0.047 5 20 CBBD CN1CCC[C@@H]1CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 226049861 AKWLXJBBBVOYCL-ZYHUDNBSSA-N 283.332 -0.164 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(C(C)(C)C(N)=O)CC1 267527760 UEBGGEUIQZXYEU-UHFFFAOYSA-N 296.331 -0.286 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1nc[nH]n1 269737651 XSFQTDHZDHULJK-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD NC(=O)c1ccc(SCC(=O)NCCO)c([N+](=O)[O-])c1 298231944 BCZKLWCYOWHLIE-UHFFFAOYSA-N 299.308 -0.106 5 20 CBBD CCN(C[C@H](C)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 341333724 AOGOVJPUQNNWRP-VIFPVBQESA-N 283.284 -0.014 5 20 CBBD Nc1nc(N2CC[C@@H]3COC(=O)N[C@H]3C2)ncc1[N+](=O)[O-] 374006021 NXNYSEGFDVTIJB-RQJHMYQMSA-N 294.271 -0.098 5 20 CBBD CN1C[C@H]2CN(C(=O)c3c([N+](=O)[O-])cnn3C)C[C@H]2C1 408375674 UGJDYLUDMRVUJY-DTORHVGOSA-N 279.300 -0.038 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1=CCNCC1 427173040 UZYZHXRWSJLACV-UHFFFAOYSA-N 265.273 -0.173 5 20 CBBD CCN1C[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 450762245 NREJDZKYQSAFIM-ZCFIWIBFSA-N 266.261 0.000 5 20 CBBD CO[C@@H]1COC[C@H]1NCCn1cc([N+](=O)[O-])ccc1=O 579350809 UXCFNCPZJAPKKU-GHMZBOCLSA-N 283.284 -0.240 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1OCCCO1 716313012 IJMRCVGYJHGQLY-UHFFFAOYSA-N 270.245 -0.330 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CC(n2cncn2)C1 732760201 FTYQQBLJEMDCCK-UHFFFAOYSA-N 291.271 -0.144 5 20 CBBD CN1CCC[C@@H](OC(=O)Cn2cc([N+](=O)[O-])cn2)C1=O 778769435 QWZIWRFXNYIRQO-SECBINFHSA-N 282.256 -0.045 5 20 CBBD Cc1nn(C)c(C(=O)O[C@@H](C)C(=O)NC(N)=O)c1[N+](=O)[O-] 920658244 HCTRKDWQLGNICD-YFKPBYRVSA-N 299.243 -0.623 5 20 CBBD Cc1nc(NC/C=C/CNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1107480706 RIMRQYSSQAQLSR-NSCUHMNNSA-N 293.283 -0.132 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](O)C(=O)OC 1116505676 OESBLFPITXDAAY-JTQLQIEISA-N 297.267 -0.100 5 20 CBBD COCCN(C)CCN1C[C@H](NCC[N+](=O)[O-])CC1=O 1120603601 QIWJYNZNJFVVIX-LLVKDONJSA-N 288.348 -0.968 5 20 CBBD CC(C)OC(=O)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1253411549 LJKRPSWWLZUIHH-UHFFFAOYSA-N 297.267 -0.176 5 20 CBBD C[C@H](O)[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 1319949208 HHSWVWKPTPWNLJ-UWVGGRQHSA-N 295.295 -0.014 5 20 CBBD CC1(O)CN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1 1321298834 MPQVNCXEFSUREH-UHFFFAOYSA-N 267.241 -0.650 5 20 CBBD CS(=O)(=O)CCNC(=O)CCn1cc([N+](=O)[O-])cn1 1322221254 BSOMMOIWAAELPP-UHFFFAOYSA-N 290.301 -0.658 5 20 CBBD Cc1nn(C)c(C(=O)N2CC[C@@H](CC(N)=O)C2)c1[N+](=O)[O-] 1323364519 DCJOHXUFGBNCFR-QMMMGPOBSA-N 295.299 -0.026 5 20 CBBD COC[C@@H](O)CCNC(=O)Cn1cc([N+](=O)[O-])nc1C 1336601136 NTAIKRDHXALPBY-VIFPVBQESA-N 286.288 -0.387 5 20 CBBD O=C(O)Cc1noc(Cn2cnc([N+](=O)[O-])n2)n1 1611519311 HZUGDCIWOLHPDM-UHFFFAOYSA-N 254.162 -0.755 5 20 CBBD CCNC(=O)NC(=O)Cn1ccc(C)c([N+](=O)[O-])c1=O 129652175 PDQJVGMSCOVRCI-UHFFFAOYSA-N 282.256 -0.089 5 20 CBBD COCCN1CCN(Cn2cc([N+](=O)[O-])cn2)CC1=O 160793391 BESPIIHYYYWAQX-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD C[C@@H]1CCNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 186707034 ZFSLFOSAOWNECT-PSASIEDQSA-N 267.289 -0.095 5 20 CBBD NC(=O)[C@H]1CCN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C1 236285776 PCTMFYOEZDXHHP-LURJTMIESA-N 280.240 0.000 5 20 CBBD Cc1ccnc(N2CCN(CC(N)=O)CC2)c1[N+](=O)[O-] 265262625 SMHXGQHQZVYNKH-UHFFFAOYSA-N 279.300 -0.094 5 20 CBBD CN(CC(C)(C)O)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 266866541 QYBYEZMIRMBORP-UHFFFAOYSA-N 283.284 -0.014 5 20 CBBD COc1ccc(CNC(=O)[C@H]2C[C@H](O)CN2)cc1[N+](=O)[O-] 269256158 PBHCMYDEPHYRQS-VHSXEESVSA-N 295.295 -0.058 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1NCCN1CCNC(=O)C1 289611079 KWPPGLDIXIFLQP-UHFFFAOYSA-N 296.331 -0.037 5 20 CBBD COC(=O)[C@@H](CNc1ncc([N+](=O)[O-])c(N)n1)OC 292241352 JKTZYOVCRPHVMS-ZCFIWIBFSA-N 271.233 -0.433 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 330580291 TYUNMUKZCFRUEF-QMMMGPOBSA-N 298.255 -0.658 5 20 CBBD CN(C(=O)N=c1cc[nH]cc1[N+](=O)[O-])[C@H]1CCNC1=O 359020341 QHJUTNHKNNNQLF-QMMMGPOBSA-N 279.256 -0.236 5 20 CBBD Nc1nc(N[C@@H](CO)C2CCOCC2)ncc1[N+](=O)[O-] 360183156 BNXIXXCXXXCZBV-QMMMGPOBSA-N 283.288 0.166 5 20 CBBD Cc1nc(O)nc(O)c1NC(=O)Cn1cnc([N+](=O)[O-])n1 427154826 ZFRPSPAEPGCPPY-UHFFFAOYSA-N 295.215 -0.665 5 20 CBBD CCOC(=O)N1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 496785515 NKPUOYTVGFBNAQ-DJLDLDEBSA-N 271.273 -0.001 5 20 CBBD COC(=O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 525698813 XZQUEHFJJOWOOT-UHFFFAOYSA-N 275.242 -0.559 5 20 CBBD COc1cc(C(=O)NC[C@H](O)C(N)=O)cc([N+](=O)[O-])c1C 590337634 KWELSDJHDRMRGI-VIFPVBQESA-N 297.267 -0.512 5 20 CBBD Cn1c(C(=O)Nc2nc(CC(=O)O)n[nH]2)ccc1[N+](=O)[O-] 739012643 MMZHPHBNXTVMPK-UHFFFAOYSA-N 294.227 -0.069 5 20 CBBD C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 746595824 HCCMTJQSAHOWEN-ZCFIWIBFSA-N 256.218 -0.402 5 20 CBBD CCN(CC(=O)O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 829635626 KRNZZLRWZNEVBM-VIFPVBQESA-N 272.261 -0.441 5 20 CBBD O=C(N[C@H]1[C@@H]2CN(CCF)C[C@@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] 1025775459 CBMJBRNFVHXNDM-SPFKKGSWSA-N 257.265 -0.333 5 20 CBBD CN(CCNC(=O)C(N)=O)c1ccc([N+](=O)[O-])cc1 1100294582 DLAHZPTUMWGVFJ-UHFFFAOYSA-N 266.257 -0.368 5 20 CBBD CC(C)CNC(=O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 1321286757 GMTLWJBWLDQAFX-UHFFFAOYSA-N 269.261 -0.180 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCn2ncnc2C1 1321319760 QEWBCWZPIPVKPN-UHFFFAOYSA-N 277.244 -0.575 5 20 CBBD COC[C@H](OC)C(=O)Nc1c([N+](=O)[O-])cnn1C 1328623203 DYTKQKLWVAPGML-ZETCQYMHSA-N 258.234 -0.072 5 20 CBBD CCN(CC(=O)O)C(=O)Cn1cc([N+](=O)[O-])cn1 38015802 ZDMUWIHSLNOLGM-UHFFFAOYSA-N 256.218 -0.276 5 20 CBBD O=c1[nH]cnc2cc(NC[C@H](O)CO)c([N+](=O)[O-])cc12 90281615 FHAUKUAPSLFWPS-LURJTMIESA-N 280.240 -0.404 5 20 CBBD C[C@H]1CO[C@H](CO)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 167585266 SCCMMDMIIGTYHG-IUCAKERBSA-N 284.272 -0.601 5 20 CBBD C[C@H]1CN(c2c([N+](=O)[O-])ncn2C)C[C@@H](CO)O1 230007407 FTZRKCKRCVUCIY-YUMQZZPRSA-N 256.262 -0.086 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCC[C@@H]1CO 270371866 MCHSUAYHUBMYNH-SNVBAGLBSA-N 281.268 -0.260 5 20 CBBD Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C)C(=O)N(C)C 330457859 OWLSRJNFGBULAS-ZETCQYMHSA-N 283.288 -0.307 5 20 CBBD NC(=O)[C@H](O)CNc1nc2ccccc2cc1[N+](=O)[O-] 339971333 QKZVVLOEZUKDSQ-SNVBAGLBSA-N 276.252 0.401 5 20 CBBD C[C@@](O)(CNc1ccc2ncc([N+](=O)[O-])n2n1)C(=O)O 565602701 GFHDQZGQTSXKOV-SNVBAGLBSA-N 281.228 -0.115 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1C[C@@H]2CNC[C@@H]2C1 611185729 VVBXUHYJWPPJDA-PHIMTYICSA-N 278.312 -0.092 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@H]1[N+](=O)[O-] 840670422 FHOWBLNJHBKMDG-HTQZYQBOSA-N 270.201 0.000 5 20 CBBD O=C(NCCn1cnnn1)c1ccc([N+](=O)[O-])[nH]1 845800820 BPPSOOBFPQBPNZ-UHFFFAOYSA-N 251.206 -0.661 5 20 CBBD O=C(NC1CN(CCn2cccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1030293487 LUTWGSBAAFQTHB-GHMZBOCLSA-N 279.300 -0.651 5 20 CBBD C[C@H](O)CCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1329400934 SDFOVPQQOJNULD-LURJTMIESA-N 255.230 -0.374 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H]1C[C@H]2CC[C@@H]1N2 1580703430 SVJBFLRPKAZMRI-MIMYLULJSA-N 294.315 -0.017 5 20 CBBD C[C@](O)(CNc1ccnc(O)c1[N+](=O)[O-])C(=O)O 1589148247 NZVPKFQRFKRGDI-VIFPVBQESA-N 257.202 -0.057 5 20 CBBD O=C(O)[C@H]1CSCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1608648851 NYQRCFWAATUTHQ-BWZBUEFSSA-N 274.298 -0.072 5 20 CBBD CNC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 49420117 VBJUMRXMXJOQGY-UHFFFAOYSA-N 269.261 -0.696 5 20 CBBD C[C@@H]1CCNC(=O)[C@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 194344401 GQUSTJAYZGUZSP-XCBNKYQSSA-N 281.272 -0.568 5 20 CBBD C[C@@H](O)C[C@H]1COCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 274379153 FVXVPSDHZIULEG-SFYZADRCSA-N 284.272 -0.070 5 20 CBBD COC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])[nH]n2)C1 285638979 BIJHNDBQADZJDP-UHFFFAOYSA-N 269.217 -0.502 5 20 CBBD NC(=O)[C@@H]1CCN(c2nccc(C(=O)O)c2[N+](=O)[O-])C1 312658392 LWWLYEGWEHTPLL-ZCFIWIBFSA-N 280.240 0.000 5 20 CBBD Nc1nc(=NCC[C@H]2CCCN2)[nH]cc1[N+](=O)[O-] 420235760 JAKPCAIEVMTNIQ-SSDOTTSWSA-N 252.278 -0.057 5 20 CBBD CCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])cnc1O 604175407 BZMKLMOPLWJEGB-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1C[C@@H](CO)[C@H](CO)C1 705335483 DTGNMOQFFWDWSP-YUMQZZPRSA-N 256.262 -0.635 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748714997 OJLFHMNAXZNQKZ-QMMMGPOBSA-N 297.267 -0.176 5 20 CBBD COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)C(N)=O 760059449 UXKXTYFMTSUSED-SECBINFHSA-N 285.231 -0.036 5 20 CBBD Cn1[nH]c(COC(=O)c2ccc([N+](=O)[O-])o2)nc1=O 765394273 YUMRHDLILHGXJP-UHFFFAOYSA-N 268.185 -0.033 5 20 CBBD O=C(O)[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 819281563 WHAGJLWIFHXFLF-SCZZXKLOSA-N 284.272 -0.441 5 20 CBBD CC(C)OC[C@@H](CO)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839743610 QPDQRINGAZWXLS-OPRDCNLKSA-N 260.290 -0.104 5 20 CBBD CN(C)C(=O)Cn1cc(C(=O)OCC(C)(C)[N+](=O)[O-])nn1 851127228 ZOLIQCSVORRJIQ-UHFFFAOYSA-N 299.287 -0.422 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]n1 990279723 VVMNMIOSWBKVJO-VXNVDRBHSA-N 279.256 -0.985 5 20 CBBD CC(=O)NCC1(O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1074583863 QLKJUMCHDODITA-NXEZZACHSA-N 285.300 -0.859 5 20 CBBD Nc1nc(NCCNC(=O)c2cocn2)ncc1[N+](=O)[O-] 1093556750 RMZYUECIUCEINP-UHFFFAOYSA-N 293.243 -0.203 5 20 CBBD NC(=O)c1cc(N2C[C@@H](O)[C@H](CO)C2)ccc1[N+](=O)[O-] 1118597171 VCPVXHHPRFRXAV-WRWORJQWSA-N 281.268 -0.517 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N[C@H]1C[C@H](O)C1 1328443370 BXWUZPUCUNPTDM-ZKCHVHJHSA-N 267.241 -0.604 5 20 CBBD O=[N+]([O-])c1cnn(C2CC(N[C@@H]3CNOC3)C2)c1 1580876291 ISHNKIJLUMUEMF-QJAFJHJLSA-N 253.262 -0.012 5 20 CBBD Cn1cc(CN2C[C@@H](O)C[C@@H](C(=O)O)C2)c([N+](=O)[O-])n1 1608113920 WNOMAJGQQJXCSX-APPZFPTMSA-N 284.272 -0.404 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)C(=O)O 20214040 GAXGWVOECDYQEE-FBCQKBJTSA-N 257.202 -0.513 5 20 CBBD CN(Cc1nc[nH]n1)C(=O)Cn1ccc([N+](=O)[O-])n1 80525834 UAVYRCCKWUOVRO-UHFFFAOYSA-N 265.233 -0.432 5 20 CBBD C[C@H](CO)N(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 153461410 NADLZIWUZVHORQ-MRVPVSSYSA-N 271.277 -0.187 5 20 CBBD CN(C)CCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 267092237 IRBDWTDECBMUHQ-UHFFFAOYSA-N 255.278 -0.189 5 20 CBBD COC[C@@H](CO)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 280288176 AAMMSRXJFDDYOD-SECBINFHSA-N 297.267 -0.343 5 20 CBBD Nc1nc(=NC[C@@H]2COCCO2)[nH]cc1[N+](=O)[O-] 341817152 OOTQIHMVCQVSGO-ZCFIWIBFSA-N 255.234 -0.784 5 20 CBBD COC(=O)[C@@H](O)CNC(=O)CNc1ccccc1[N+](=O)[O-] 352535457 QUEYSNADAWGIAO-JTQLQIEISA-N 297.267 -0.343 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCCCN1CCOCC1 356121535 XAUMCQFCQVRBKN-UHFFFAOYSA-N 297.315 -0.220 5 20 CBBD NC(=O)CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 359670809 CCORXMIUJDYTKV-UHFFFAOYSA-N 258.255 -0.005 5 20 CBBD O=C(CCn1cncn1)NCCn1cc([N+](=O)[O-])cn1 493180244 KNQFLALKXUEQGY-UHFFFAOYSA-N 279.260 -0.411 5 20 CBBD COc1cc(C(=O)NCC(N)=O)cc([N+](=O)[O-])c1OC 505362349 OAGDFZDELZRMDF-UHFFFAOYSA-N 283.240 -0.173 5 20 CBBD Cn1c(C(=O)N[C@H]2CNC(=O)C2)ccc1[N+](=O)[O-] 541707685 MJWYIFIQMNCDKO-ZCFIWIBFSA-N 252.230 -0.448 5 20 CBBD CNc1nccc(C(=O)NCCn2cncn2)c1[N+](=O)[O-] 574819637 GVZXUDMLVVKFJA-UHFFFAOYSA-N 291.271 0.053 5 20 CBBD CN(CC(=O)O)S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600655078 HXQQJJIHFPZYSS-UHFFFAOYSA-N 278.246 -0.967 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1COCO1 861975455 LCAQXBUGCPLYNY-ZETCQYMHSA-N 268.229 -0.325 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CC[C@]3(CCNC3)C2)c1 923331670 MQHMXNHAXGKDQY-STQMWFEESA-N 295.343 -0.162 5 20 CBBD C[C@@H](CN)N(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1261492096 QVGXHEBRXARPHP-QMMMGPOBSA-N 268.273 -0.438 5 20 CBBD COC(=O)[C@H]1CCN(CC[N+](=O)[O-])[C@H](C(=O)OC)C1 1333921490 WKRNNINEBWALHQ-IUCAKERBSA-N 274.273 -0.310 5 20 CBBD CC(C)[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)C(=O)O 1609717518 RITBMODQWQRDPN-JTQLQIEISA-N 297.267 -0.018 5 20 CBBD COCC(=O)N1CCN(Cn2cc([N+](=O)[O-])cn2)CC1 48621524 HCBAVFDSEIAILQ-UHFFFAOYSA-N 283.288 -0.461 5 20 CBBD O=C(NC[C@H]1CNCCO1)c1ccc([N+](=O)[O-])o1 134257611 QMYAQZUYQNFIHF-SSDOTTSWSA-N 255.230 -0.094 5 20 CBBD O=[N+]([O-])c1cnn(CCNS(=O)(=O)C2CC2)c1 152849151 YYRNJBWSPHEPAF-UHFFFAOYSA-N 260.275 -0.127 5 20 CBBD CN(Cc1nnc[nH]1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 174809255 AJFSSJQPALVNJO-SECBINFHSA-N 281.276 -0.598 5 20 CBBD NC(=O)CCNC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 266659611 GRLAOMNQYDUYEO-UHFFFAOYSA-N 295.251 -0.222 5 20 CBBD CCN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1=O 273415810 IWPYYSYYCVHLRZ-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD O=C(NC[C@H]1CC[C@@H](CO)O1)c1cc([N+](=O)[O-])[nH]n1 293984984 RAZRBQDYXPOKHM-RQJHMYQMSA-N 270.245 -0.412 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2ccc([N+](=O)[O-])n2C)C1 358046028 KBTCZWIFLDSBRV-LBPRGKRZSA-N 282.300 -0.270 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1CO 360862081 UTNAEPXAOJDIOJ-VHSXEESVSA-N 295.295 -0.157 5 20 CBBD O=C(O)CSCC(=O)NCCn1cc([N+](=O)[O-])cn1 520229581 WQKZOJONYDYVBN-UHFFFAOYSA-N 288.285 -0.275 5 20 CBBD CNc1nccc(C(=O)N2CC(O)C2)c1[N+](=O)[O-] 553531605 DCBLPMQPZLQZIV-UHFFFAOYSA-N 252.230 -0.152 5 20 CBBD CNc1nccc(C(=O)N(C)[C@H](C)CO)c1[N+](=O)[O-] 574650570 DATDSBUUCWBDOH-SSDOTTSWSA-N 268.273 0.484 5 20 CBBD C[C@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCNC1 595993167 WFWMCXZKSQJOSO-JTQLQIEISA-N 253.262 -0.341 5 20 CBBD O=C(N[C@]1(C(=O)O)CCOC1)c1cc([N+](=O)[O-])n[nH]1 595997516 NSPMDVZSVHUSKH-SECBINFHSA-N 270.201 -0.709 5 20 CBBD Cc1c(CC(=O)NC[C@@H](O)C(N)=O)cccc1[N+](=O)[O-] 619566051 WBJDQUFIDNPWCS-SNVBAGLBSA-N 281.268 -0.592 5 20 CBBD CN1CC[C@H](N(C)Cn2nccc2[N+](=O)[O-])C1=O 738270033 UNWOSBIJRZHBPJ-QMMMGPOBSA-N 253.262 -0.089 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])c1)N[C@H]1CCSC1=O 760310638 HLXMMLPNMKTSCB-LURJTMIESA-N 270.270 -0.060 5 20 CBBD COC[C@@H](O)C(=O)OCCn1cc([N+](=O)[O-])cn1 766137112 HVXULYXGALYJSR-MRVPVSSYSA-N 259.218 -0.658 5 20 CBBD C[C@@H](COC(=O)[C@H]1CCCN(C(N)=O)C1)[N+](=O)[O-] 813105072 VEEPEJJVUGNOEV-YUMQZZPRSA-N 259.262 -0.015 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] 816327626 MKPYUBCFPDVUJH-LURJTMIESA-N 299.287 -0.722 5 20 CBBD C[C@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CCNC1=O 853169634 FODBFMGOFPSEIH-LLVKDONJSA-N 282.256 -0.139 5 20 CBBD C[C@H]1CN(CC[N+](=O)[O-])[C@H](C)CN1CC[N+](=O)[O-] 930068762 FPSINLRNJXJTPA-AOOOYVTPSA-N 260.294 -0.066 5 20 CBBD COCCO[C@@H]1CCN(c2nnc(C[N+](=O)[O-])n2C)C1 1121299567 PEEFDSGBKQKCKL-SECBINFHSA-N 285.304 -0.167 5 20 CBBD Cc1noc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 1318305282 XLNSCHYYDVKCHU-UHFFFAOYSA-N 266.217 -0.201 5 20 CBBD NC(=O)NC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 3602246 LBADAKFFFCTJSE-UHFFFAOYSA-N 292.207 -0.614 5 20 CBBD C[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1nncn1C 50418260 JTDRYWUTPHKJOV-WPRPVWTQSA-N 295.303 -0.369 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC(=O)N(C)C 65836421 YPCKGODSKDJEPT-UHFFFAOYSA-N 283.288 -0.354 5 20 CBBD CC(C)N1CC[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 114655831 JIYWIOBHHZNENO-VIFPVBQESA-N 295.299 -0.083 5 20 CBBD C[C@@H](CO)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 122820217 SDHIEAMDQSAUIX-MRVPVSSYSA-N 271.277 -0.281 5 20 CBBD CCCc1[nH]nc(C(=O)NC(CO)CO)c1[N+](=O)[O-] 132463297 ZUOALNGDLRCLSJ-UHFFFAOYSA-N 272.261 -0.647 5 20 CBBD CO[C@@H](C)CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 224205381 BATXTIORLAMSPX-WPRPVWTQSA-N 258.278 -0.223 5 20 CBBD C[C@H](O)CN(CCn1cc([N+](=O)[O-])cn1)[C@H](C)CO 248935426 NDNZQPUZEQHOCY-ZJUUUORDSA-N 272.305 -0.145 5 20 CBBD CCN(CCCO)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266604369 XXUVZKYQRSAQRE-LLVKDONJSA-N 272.305 -0.144 5 20 CBBD CN1CCN(C(=O)CCn2cc([N+](=O)[O-])ccc2=O)CC1 283163930 VVDVDJXSQWNOPD-UHFFFAOYSA-N 294.311 -0.079 5 20 CBBD Nc1nc(NC[C@]2(O)CCOC2)ncc1[N+](=O)[O-] 301866358 VJXNFFPLGRMDMU-SECBINFHSA-N 255.234 -0.470 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H](C)C(=O)O)c([N+](=O)[O-])n1 340448139 GJYHEFNDLCYIMA-RXMQYKEDSA-N 292.273 -0.437 5 20 CBBD COC(=O)C[C@]1(NC(=O)c2n[nH]cc2[N+](=O)[O-])CCOC1 344868925 BCNLCSLJYFFRRR-LLVKDONJSA-N 298.255 -0.230 5 20 CBBD CCc1[nH]nc(C(=O)NCCCC(N)=O)c1[N+](=O)[O-] 346141724 REQDEVSQWKODEK-UHFFFAOYSA-N 269.261 -0.124 5 20 CBBD C[C@@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C[C@@H](CO)O1 347554008 MRAFIJJYZGGHGY-APPZFPTMSA-N 297.267 -0.083 5 20 CBBD O=C(NCCn1ccccc1=O)c1cc([N+](=O)[O-])n[nH]1 352839789 RYHZNYRIDFKJJE-UHFFFAOYSA-N 277.240 -0.090 5 20 CBBD CCn1cc(S(=O)(=O)N2CCNCC2)c([N+](=O)[O-])n1 353214682 HAJCBWAOVUPQRB-UHFFFAOYSA-N 289.317 -0.595 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC(O)(C(F)F)C1 425009220 KEWSBIJOFVHPMS-UHFFFAOYSA-N 277.187 -0.975 5 20 CBBD Cn1cc(C(=O)NCCn2cc([N+](=O)[O-])cn2)ccc1=O 492883793 AZFOJKKOFNBSCO-UHFFFAOYSA-N 291.267 -0.080 5 20 CBBD C[C@@H]1OC(=O)N[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1 496506817 HIUXNNAXBBHXQG-XPUUQOCRSA-N 284.228 -0.169 5 20 CBBD Cc1nc(N2CCO[C@H](C(=O)O)C2)ncc1[N+](=O)[O-] 573094037 RVDUGGRKWLCUDR-QMMMGPOBSA-N 268.229 -0.017 5 20 CBBD CN(CCC(=O)O)S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600655121 IUWHQUQGZVDCCX-UHFFFAOYSA-N 292.273 -0.577 5 20 CBBD CC(C)NC(=O)CN1CCN(CC[N+](=O)[O-])CC1 787705957 MITKEKPRKRKFOF-UHFFFAOYSA-N 258.322 -0.595 5 20 CBBD Nc1nccc(C(=O)OCC(=O)N2CCC2)c1[N+](=O)[O-] 848788389 XXYCNNQUGCLGSX-UHFFFAOYSA-N 280.240 -0.039 5 20 CBBD NC(=O)CN1[C@H]2CCC[C@H]1CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 1039583139 DUMWRUUNPQDYSY-UKKRHICBSA-N 296.327 -0.798 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCc1ncc[nH]1 1318833692 VBBRYBKOSZQIMM-UHFFFAOYSA-N 291.267 -0.162 5 20 CBBD C[C@H](CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 1592654929 NJKQSRZCJAIKGR-SSDOTTSWSA-N 283.240 -0.407 5 20 CBBD C[C@@H](CCO)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 97440674 RXPMVWDLWYDFJD-GXSJLCMTSA-N 272.305 -0.240 5 20 CBBD CN(C)C(=O)C(C)(C)NC(=O)Cn1ccc([N+](=O)[O-])n1 108191213 AXNOTPRTEJKHGO-UHFFFAOYSA-N 283.288 -0.226 5 20 CBBD NC(=O)CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 109120296 BTASPEQUVOWZRR-UHFFFAOYSA-N 289.251 -0.004 5 20 CBBD O=C(NCCN1CCOCC1)c1[nH]ncc1[N+](=O)[O-] 196749925 XKOLAULFMQQJLW-UHFFFAOYSA-N 269.261 -0.620 5 20 CBBD COC[C@]1(C)NC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 269448538 VGMYQGOXLANUSE-NSHDSACASA-N 297.271 -0.252 5 20 CBBD CN1CCN(C)[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 330693412 HWENGLJRSZTPNZ-JTQLQIEISA-N 296.331 -0.847 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCOCCO)c1 345400317 JNEFICYNWSCVNI-UHFFFAOYSA-N 286.240 -0.448 5 20 CBBD COC(=O)CNC(=O)Cn1ccc(C)c([N+](=O)[O-])c1=O 349213829 KPGDDCSVPHUUOS-UHFFFAOYSA-N 283.240 -0.646 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1cc([N+](=O)[O-])n[nH]1 354422522 DXZHMLFVETZWHW-NKWVEPMBSA-N 281.272 -0.038 5 20 CBBD C[C@@H]1CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H](CO)O1 357711221 XQYXJFSGTRNNAL-HTQZYQBOSA-N 296.283 -0.325 5 20 CBBD CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](CO)C(=O)NC 361014701 OEHHRULGTGIZMS-ZETCQYMHSA-N 271.277 -0.362 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 382560741 LOECBSLANSWRQP-NSHDSACASA-N 285.256 -0.177 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCC(=O)N1 447745150 MSTYTNIXVHSLGV-SECBINFHSA-N 295.299 -0.034 5 20 CBBD C[C@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H](C)N1 923285900 HNSUHFXORFMARU-UMNHJUIQSA-N 283.332 -0.166 5 20 CBBD O=C(NCC1CN(C(=O)c2ccon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001796280 ODMCBZGEYPTPPZ-PSASIEDQSA-N 294.267 -0.472 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CCn2cncn2)C1 1042711483 UPNPUPOAOBVPEJ-GHMZBOCLSA-N 294.315 -0.914 5 20 CBBD CCCC(=O)NCCN(CCO)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057543502 LJPPAYGTYKDDAK-NXEZZACHSA-N 287.316 -0.611 5 20 CBBD CS(=O)(=O)C1(CNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1116956531 CZGPZBMFARMQJJ-UHFFFAOYSA-N 288.285 -0.375 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCCO[C@@H](CN)C1 1118165312 UEAJOPHPXSOETD-JTQLQIEISA-N 297.315 -0.324 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1318790751 MOAWIWLBZCGUCH-JTQLQIEISA-N 272.261 -0.246 5 20 CBBD COC[C@@H](CO)NC(=O)Cn1cc([N+](=O)[O-])nc1C 1321061417 KSDSHBWQWGCBNX-MRVPVSSYSA-N 272.261 -0.777 5 20 CBBD C[C@@H]1CO[C@H](CO)CN1C(=O)c1c([N+](=O)[O-])cnn1C 1324732359 MFOHLCITCPTEPL-SFYZADRCSA-N 284.272 -0.450 5 20 CBBD Cc1[nH]nc(C(=O)N2CCO[C@]3(CCNC3)C2)c1[N+](=O)[O-] 1579514366 NCDVFIAJBSQYEP-LBPRGKRZSA-N 295.299 -0.169 5 20 CBBD C[C@@](NC[C@@H](O)CO)(C(=O)O)c1cccc([N+](=O)[O-])c1 1593285411 DPKNWPABDZOZMK-PWSUYJOCSA-N 284.268 -0.163 5 20 CBBD COCCNC1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1754513940 KDDODIYAGOQKOY-RKDXNWHRSA-N 257.290 -0.464 5 20 CBBD NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 48380502 WLLNHEJMULPHKL-UHFFFAOYSA-N 251.198 -0.195 5 20 CBBD COC(=O)CNC(=O)CCn1cc([N+](=O)[O-])cn1 65689153 FWFDRRAZYJBAIR-UHFFFAOYSA-N 256.218 -0.529 5 20 CBBD COC[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)O 167317027 LFTVYLHAMWLGBU-ZCFIWIBFSA-N 272.217 -0.993 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@]1(CO)CCOC1 182935814 ZDOUYMZKXBVJRZ-SNVBAGLBSA-N 270.245 -0.941 5 20 CBBD CCOC(=O)c1ccnc(NC[C@H](O)CO)c1[N+](=O)[O-] 269101162 AEKWLWYDGCWOLA-ZETCQYMHSA-N 285.256 -0.068 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])[nH]n1 284908533 HRNWAFOVEFKSCQ-YFKPBYRVSA-N 255.234 -0.428 5 20 CBBD COC(=O)c1cc(C)nc(N2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 287539587 BNINZUDERHETDE-DTORHVGOSA-N 297.267 -0.373 5 20 CBBD CC(C)[C@@](C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 287909268 OIIOYWKSIMFRRX-LLVKDONJSA-N 283.288 -0.193 5 20 CBBD O=C(NCCN1C(=O)CCCC1=O)c1cc([N+](=O)[O-])n[nH]1 353470429 KVHLWEIRHHVOLA-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C(N)=O 356475046 GUABXWGIKIGETR-SSDOTTSWSA-N 281.272 -0.192 5 20 CBBD CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])nn1C 360541441 VBKXJMMFTKAVPQ-UHFFFAOYSA-N 256.218 -0.379 5 20 CBBD CNc1nccc(C(=O)N(C)CCO)c1[N+](=O)[O-] 578683421 VYGWRDQFUMGCRG-UHFFFAOYSA-N 254.246 0.096 5 20 CBBD CC[C@@H](O)CNC(=O)NCCn1cc([N+](=O)[O-])cn1 591989828 POFSSXYIMWLGLH-SECBINFHSA-N 271.277 -0.139 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)c1[N+](=O)[O-] 593815788 LRWKAVOVKNHIBF-OLQVQODUSA-N 267.245 -0.380 5 20 CBBD Cn1nnnc1CSc1ncc([N+](=O)[O-])c(N)n1 594901282 TYEDZBAATXNSAK-UHFFFAOYSA-N 268.262 -0.217 5 20 CBBD CN(CC(C)(C)N)C(=O)Cn1cnc([N+](=O)[O-])n1 595963089 ZPYIUXZZENRSFU-UHFFFAOYSA-N 256.266 -0.618 5 20 CBBD CN1C(=O)CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1=O 773673404 GVKBAJRWSSMCMH-UHFFFAOYSA-N 292.251 -0.382 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nn1cnnc1O 782126335 VPRDMEGMAREIBV-UHFFFAOYSA-N 281.232 -0.443 5 20 CBBD COC(=O)[C@@H]1[C@H]2CN(C(=O)Cn3ccc([N+](=O)[O-])n3)C[C@H]21 816963743 VOKRSPUDLFDJBZ-VROVMSAKSA-N 294.267 -0.331 5 20 CBBD C[C@H](C(=O)O)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 817772428 ZEFAGJXHXAYJSU-APPZFPTMSA-N 272.261 -0.443 5 20 CBBD O=C(O)[C@@H]1CCCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 819240062 GWEMNWRLLBZVFZ-UWVGGRQHSA-N 284.272 -0.299 5 20 CBBD CC[C@@H](CNS(C)(=O)=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839783927 MXGZZIMDYSOPTB-XLPZGREQSA-N 279.318 -0.904 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C(N)=O)C1 846438623 ZNEISDSRJLVZHE-OLQVQODUSA-N 279.256 -0.434 5 20 CBBD COC[C@H](O)C(=O)OCc1onc(C)c1[N+](=O)[O-] 853906573 JCRPDGBLZAFSAG-LURJTMIESA-N 260.202 -0.058 5 20 CBBD CCn1ccnc1CN1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1030291809 KRUIXDDXTYZZEG-GHMZBOCLSA-N 293.327 -0.131 5 20 CBBD CCc1nnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1126936656 PCSYQXNYWQDFHY-HTQZYQBOSA-N 283.288 -0.497 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCNC(=O)C1CC1 1253912483 LHJZARIJTDXBQE-UHFFFAOYSA-N 281.272 -0.416 5 20 CBBD NC(=O)[C@@H]1CCCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1317940667 NWQZCVMWYPUALS-ZETCQYMHSA-N 282.260 -0.947 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCCNC1 1327074501 XCTGDKODOLVVBF-SSDOTTSWSA-N 254.250 -0.946 5 20 CBBD Cn1ncc([N+](=O)[O-])c1NC[C@@H]1CN2CCN1CC2 1334956433 PRJNSUXPQQVHGP-SECBINFHSA-N 266.305 -0.260 5 20 CBBD Cc1[nH]nc(C(=O)NCC2[C@@H]3CNC[C@@H]23)c1[N+](=O)[O-] 1579514786 WNCDVZLQLWHCOO-RNFRBKRXSA-N 265.273 -0.178 5 20 CBBD O=C(NC(CO)CO)c1ccc([N+](=O)[O-])cc1F 87751223 VPNBTHOPYBKBOM-UHFFFAOYSA-N 258.205 -0.183 5 20 CBBD C[C@@H]1CCNC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 186761209 WRQPJKCGNZPVNQ-MWLCHTKSSA-N 294.311 -0.129 5 20 CBBD CN(CC(N)=O)C[C@H](O)COc1ccccc1[N+](=O)[O-] 273030964 MSZMNAFUPVQLOC-VIFPVBQESA-N 283.284 -0.248 5 20 CBBD CN(CC(=O)NC1CC1)c1ncc([N+](=O)[O-])c(N)n1 298696643 DGFYTMVOBXRCEJ-UHFFFAOYSA-N 266.261 -0.318 5 20 CBBD COCC[C@@H](CO)NC(=O)Cn1ccc([N+](=O)[O-])n1 336805443 ZJNIZWBKBREQQU-QMMMGPOBSA-N 272.261 -0.695 5 20 CBBD O=[N+]([O-])c1cccc(S(=O)(=O)C[C@H](O)CO)c1 356567288 PWRVSMFHXXGIOJ-MRVPVSSYSA-N 261.255 -0.278 5 20 CBBD C[C@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)N(C)C 357858373 AHUJTLOMLQGLAD-SSDOTTSWSA-N 256.266 -0.747 5 20 CBBD CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C(=O)N1 450613567 MPAJWTCLEUZXLB-RXMQYKEDSA-N 270.270 -0.269 5 20 CBBD C[C@@H](CN=c1nc(N)c([N+](=O)[O-])c[nH]1)S(C)(=O)=O 533128517 KRBNKOUXQANWMI-YFKPBYRVSA-N 275.290 -0.766 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1c[nH]nc1[N+](=O)[O-] 555319000 WYMFMEYXKWKPOA-IYSWYEEDSA-N 267.245 -0.428 5 20 CBBD O=[N+]([O-])c1cnc(N2CCN(Cc3nc[nH]n3)CC2)nc1 593509752 ZRFMDPGJPQONHU-UHFFFAOYSA-N 290.287 -0.175 5 20 CBBD O=C1CC(CCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)=NN1 597663666 AFFAWERDUNRXLJ-UHFFFAOYSA-N 280.244 -0.296 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCCNS(C)(=O)=O 766628562 NNKVTKKOUOUKQX-UHFFFAOYSA-N 292.273 -0.966 5 20 CBBD C[S@@](=O)CCNC(=O)NCCn1cc([N+](=O)[O-])cn1 768523562 JIQAJINNCWEPDP-LJQANCHMSA-N 289.317 -0.531 5 20 CBBD O=C(O)[C@@H](CO)NS(=O)(=O)c1csc([N+](=O)[O-])c1 776445123 RALQVKYBUPVTOD-RXMQYKEDSA-N 296.282 -0.620 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)O[C@@H]1CCC(=O)NC1=O 798606442 VXKPKJMHHCRZGU-SSDOTTSWSA-N 296.239 -0.552 5 20 CBBD O=C(OCCn1cnc([N+](=O)[O-])n1)c1cc2n(n1)CCO2 810607514 QDDRZFWAAZRQKV-UHFFFAOYSA-N 294.227 -0.368 5 20 CBBD C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839686140 LEVBBTKQBUVKIH-RBXMUDONSA-N 276.314 -0.314 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCNC1 923425423 MYYRACBLOVWVSI-PWSUYJOCSA-N 283.332 -0.164 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ncn(C)n1 1256712339 GQVGHFHWQMARAU-RXMQYKEDSA-N 265.233 -0.063 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2c([N+](=O)[O-])cnn2C)C1 1320227638 DTHQAEULVMMKBQ-NSHDSACASA-N 283.288 -0.875 5 20 CBBD CO[C@@H](C)CNC(=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 1328466489 GZFIBEDEIXOMQO-QMMMGPOBSA-N 299.287 -0.941 5 20 CBBD O=[N+]([O-])CCN1CCS(=O)(=O)[C@H]2COCC[C@@H]21 1341532585 GUMMYIBYDDQOBS-IUCAKERBSA-N 264.303 -0.849 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)OCC(=O)C(=O)O)n1 1593666299 NUCHXPBPYHBQDQ-UHFFFAOYSA-N 271.185 -0.378 5 20 CBBD Cc1noc(CN2CCN(C(=O)C(=O)O)CC2)c1[N+](=O)[O-] 1594500873 ZDPLZZVFQTVSSH-UHFFFAOYSA-N 298.255 -0.380 5 20 CBBD O=C(N[C@@H](CCF)C(=O)O)c1n[nH]cc1[N+](=O)[O-] 1601416789 FLBPZRJZMRSPKQ-BYPYZUCNSA-N 260.181 -0.140 5 20 CBBD COC[C@@H](C)NC(=O)NC(=O)Cn1nccc1[N+](=O)[O-] 48706119 PRLNKMXXNDMNCL-SSDOTTSWSA-N 285.260 -0.348 5 20 CBBD CC(C)[C@H]1CN(C)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 153727225 SMQHZYZKKMIKFH-SNVBAGLBSA-N 296.331 -0.015 5 20 CBBD O=C1C[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)CCN1 177927837 RNOUQECOHQAOIL-MRVPVSSYSA-N 282.256 -0.139 5 20 CBBD C[C@@H](CN1CCOCC1)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285310394 WTZZUVDDNDGWHE-QMMMGPOBSA-N 283.288 -0.232 5 20 CBBD C[C@@H](C[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 286105519 OXLXBORJWIYUDJ-AAODDVHNSA-N 260.275 -0.185 5 20 CBBD C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[S@@]1=O 343730764 XYEUCVAORKHODK-QQOXFEPMSA-N 272.286 -0.089 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2nnnn2C)c1 356787686 PHBHVKLMJOUOFJ-UHFFFAOYSA-N 294.227 -0.885 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC1(c2nn[nH]n2)CC1 357040506 CYHMXEAZCVHUAP-UHFFFAOYSA-N 278.232 -0.740 5 20 CBBD CN(Cc1nnc(O)o1)C(=O)c1n[nH]cc1[N+](=O)[O-] 590546719 RPUIVUMHCHRLOD-UHFFFAOYSA-N 268.189 -0.321 5 20 CBBD CN(C)[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H]1O 594358980 BLQAOJFLHXNXFL-IUCAKERBSA-N 283.288 -0.925 5 20 CBBD O=[N+]([O-])c1ccc(NCCN2CC[C@H](O)C2)nc1 599201222 GRYQBCGUTGSLJF-JTQLQIEISA-N 252.274 0.468 5 20 CBBD Cn1ncc(C(=O)OCCn2cnc([N+](=O)[O-])n2)n1 793157362 DGUFRQIXEMFYOM-UHFFFAOYSA-N 267.205 -0.828 5 20 CBBD COC[C@@H]1CCCN1NC(=O)Cn1cnc([N+](=O)[O-])n1 862602263 HGSJNTQUFPAGOX-QMMMGPOBSA-N 284.276 -0.672 5 20 CBBD CC(C)C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990267321 WYQKARHXFCSMNM-RKDXNWHRSA-N 255.274 -0.365 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1342931661 JHFWPBKJFGKKCQ-BQBZGAKWSA-N 270.245 -0.806 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCC12CNC2 1580546845 YDQFRMSMVNWXKA-UHFFFAOYSA-N 265.273 -0.244 5 20 CBBD O=C(NC[C@H](C(=O)O)[C@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1608418830 TWENINXTICDJBE-BQBZGAKWSA-N 298.255 -0.215 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NCC1(C(=O)O)CC1 1608455645 AWUIVTNKUVMYCH-UHFFFAOYSA-N 297.271 -0.045 5 20 CBBD O=[N+]([O-])c1cc(NC(CO)CO)ccc1-c1nn[nH]n1 1609601037 OIOZDESRRWGGOE-UHFFFAOYSA-N 280.244 -0.460 5 20 CBBD O=C1CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])o2)CCN1 28126259 YILZKNOGORJKCL-UHFFFAOYSA-N 297.223 -0.697 5 20 CBBD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCO 35610752 JZFWWJWMXRVVJI-UHFFFAOYSA-N 276.270 -0.126 5 20 CBBD COCCN(CC(=O)O)C(=O)Cn1cc([N+](=O)[O-])cn1 49606433 CKJZPSSGVINRCW-UHFFFAOYSA-N 286.244 -0.649 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 135513916 FXNDPHJSPXHBOC-VIFPVBQESA-N 298.255 -0.808 5 20 CBBD NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O 159279784 KAYFORGDOHCBCI-UHFFFAOYSA-N 253.214 -0.094 5 20 CBBD CNC(=O)C1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 186195739 IFQOTHURJCDQNW-UHFFFAOYSA-N 278.268 -0.005 5 20 CBBD COC(=O)[C@H]1[C@H](O)CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 275436409 BFWVVZTXIMPVDB-VXNVDRBHSA-N 298.255 -0.544 5 20 CBBD CN(C)CC(C)(C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 349730350 QBQRDPIHVDDGIC-UHFFFAOYSA-N 284.320 -0.110 5 20 CBBD O=C1NC(=O)N2CCN(c3ncccc3[N+](=O)[O-])C[C@H]12 351882335 FQZJQNURYYBGPF-MRVPVSSYSA-N 277.240 -0.270 5 20 CBBD Cn1ccc(CCN=c2nc(N)c([N+](=O)[O-])c[nH]2)n1 354563551 AYPDCAKDIVNQQP-UHFFFAOYSA-N 263.261 -0.223 5 20 CBBD O=C1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)N1 355511237 XCKWINNMDKOXET-ZCFIWIBFSA-N 267.245 -0.284 5 20 CBBD NC(=O)c1ccnc(NC[C@@H]2COCCO2)c1[N+](=O)[O-] 357234966 PCKRHHVZWYEFIF-SSDOTTSWSA-N 282.256 -0.084 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@]2(O)CCN(C)C2)c1[N+](=O)[O-] 358060112 DVIHCUAUPFOCSG-LLVKDONJSA-N 283.288 -0.577 5 20 CBBD C[C@H](O)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](C)CO 442696075 SJYXYQAAMVGHPM-BQBZGAKWSA-N 272.261 -0.478 5 20 CBBD C[S@](=O)C1(CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1 442936942 VAXKXFOYVVWRTO-IBGZPJMESA-N 286.313 -0.181 5 20 CBBD CN(C)C(=O)O[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 495925398 CTVOCQSFGNXNLA-IWSPIJDZSA-N 271.273 -0.049 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 516171247 LNDWWYIWRFTBAL-ZETCQYMHSA-N 281.272 -0.159 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1=O 524875797 UGHAUXLHVJAKBP-UHFFFAOYSA-N 266.257 -0.153 5 20 CBBD C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)S(N)(=O)=O 535071663 WJFHWLDLWLVYFB-LURJTMIESA-N 288.285 -0.603 5 20 CBBD CCN(C)C(=O)[C@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 549349074 NSPNAQXALOMOBR-LURJTMIESA-N 269.261 -0.086 5 20 CBBD NC(=O)[C@]1(NC(=O)Cc2cccc([N+](=O)[O-])c2)CCOC1 583154072 XBFVOYJOSIJNHT-ZDUSSCGKSA-N 293.279 -0.102 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](C)N 592332969 CARXZQPCPCKXJN-SSDOTTSWSA-N 255.278 -0.047 5 20 CBBD Cc1noc(CN2CCN3C(=O)NC(=O)[C@H]3C2)c1[N+](=O)[O-] 595404207 OOGJFIPXHHXCIH-SSDOTTSWSA-N 295.255 -0.373 5 20 CBBD CN(Cc1cn(C)nn1)c1ncc([N+](=O)[O-])c(N)n1 596484351 OEPNXTAFHCODSX-UHFFFAOYSA-N 264.249 -0.268 5 20 CBBD C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CN(C)CCO1 610907211 FPWHMRMGTLITMF-KOLCDFICSA-N 297.315 -0.373 5 20 CBBD NC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCO1 769693200 ZKISRNAPEPGMEY-SNVBAGLBSA-N 294.267 -0.497 5 20 CBBD O=Cc1ccc(OCC(=O)NOCCO)c([N+](=O)[O-])c1 787299191 NMLYQSPFEIKPTD-UHFFFAOYSA-N 284.224 -0.174 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NCCn2cnnn2)n1 845574104 JIYJMIBSVKARDI-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD CON(C)C(=O)[C@@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 858842760 WOCRWXNJDSVBKJ-RXMQYKEDSA-N 270.249 -0.213 5 20 CBBD Cn1cnn(CCC(=O)OCCC[N+](=O)[O-])c1=O 860919324 WVZVRVSNZJILIR-UHFFFAOYSA-N 258.234 -0.818 5 20 CBBD CN(C)C(=O)CCN1CCC(NCC[N+](=O)[O-])CC1 905105486 KNXQWWXXEHREFH-UHFFFAOYSA-N 272.349 -0.205 5 20 CBBD O=C(c1cc[nH]n1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010415532 WJWOGJOOJOURMQ-PSASIEDQSA-N 293.283 -0.641 5 20 CBBD CC(=O)N1CCC(CO)(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1080856656 OPSJTIQLGDZQKT-NXEZZACHSA-N 285.300 -0.859 5 20 CBBD COC[C@@H](O)CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 1116485416 WHBGHFHHQYRACA-QMMMGPOBSA-N 286.288 -0.236 5 20 CBBD O=C(O)[C@@H]1C[C@@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 1608601522 KPMHAEBWDQEOPT-RKDXNWHRSA-N 284.272 -0.441 5 20 CBBD C[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 85984740 RNNTURDTUDWQGH-LURJTMIESA-N 255.230 -0.216 5 20 CBBD O=C(N[C@@H](CO)C(=O)O)c1cc(F)cc([N+](=O)[O-])c1 165092682 DWDMPWZJRDLUGJ-QMMMGPOBSA-N 272.188 -0.091 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 227044271 DCJOTRBQBKILNS-SECBINFHSA-N 286.215 -0.002 5 20 CBBD COc1cc(CNC[C@@H](O)CO)c([N+](=O)[O-])cc1O 276704292 FRYKCWJDVKQTHQ-MRVPVSSYSA-N 272.257 -0.248 5 20 CBBD COCCNC(=O)CNc1ncc([N+](=O)[O-])c(N)n1 298702759 HZBGUGJGDKQYCY-UHFFFAOYSA-N 270.249 -0.859 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@](C)(O)CN(C)C)c1[N+](=O)[O-] 337447408 JBCGOUQWAGSEMD-NSHDSACASA-N 285.304 -0.331 5 20 CBBD O=C1[C@H]2COCCN2C(=O)N1CCn1cc([N+](=O)[O-])cn1 348875675 ADYAFZGKDXKUOZ-SECBINFHSA-N 295.255 -0.546 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)NCc1nc(O)n[nH]1 354543216 WLJQDVGXYBLZID-UHFFFAOYSA-N 278.228 -0.069 5 20 CBBD COC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])nn1C 356498316 QOJMZBOYCVXRKZ-RXMQYKEDSA-N 256.218 -0.380 5 20 CBBD C[C@@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 408051902 MCNZFPZYDODXDH-ZCFIWIBFSA-N 267.245 -0.711 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1CCNC1=O 443026983 BQSNRONIWUFRGP-SECBINFHSA-N 293.283 -0.077 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NCC(F)(F)CO 545219577 JMWCGBACSRMDLO-UHFFFAOYSA-N 297.239 -0.104 5 20 CBBD CCN(CC(=O)O)C(=O)NCCn1cc([N+](=O)[O-])cn1 570956729 CLKFVLUZDRJKSD-UHFFFAOYSA-N 285.260 -0.093 5 20 CBBD C[C@H](N)[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CCO1 592307351 FYVNEPKQNNZGFK-POYBYMJQSA-N 269.261 -0.494 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NC1[C@@H]2CNC[C@@H]12 592390498 YPAFMABQTMIRAB-RNFRBKRXSA-N 284.297 -0.514 5 20 CBBD COCCN(C)C[C@H](O)Cn1ccnc1[N+](=O)[O-] 601966315 ZFMMKLDKFPKXCQ-VIFPVBQESA-N 258.278 -0.270 5 20 CBBD CN(C)c1noc(COC(=O)Cn2ccc([N+](=O)[O-])n2)n1 801231990 ILSAKZJYWYDMLV-UHFFFAOYSA-N 296.243 -0.016 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)NC1CN(C(=O)O)C1 831708804 LJYGSTPPXXTJIS-UHFFFAOYSA-N 298.259 -0.547 5 20 CBBD Cc1cc(NCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n(C)n1 846644331 UZTBYVBSFANPCP-RKDXNWHRSA-N 267.289 -0.078 5 20 CBBD COC[C@@H](OC)C(=O)OCCn1cc([N+](=O)[O-])cn1 850202323 ZRRUEXJJVYOYCJ-SECBINFHSA-N 273.245 -0.004 5 20 CBBD CN[C@H]1CCCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923284982 YNKQMICAKXOZRF-CMPLNLGQSA-N 283.332 -0.164 5 20 CBBD CCNC(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 1253914390 YKTQFKFWSFVMQA-UHFFFAOYSA-N 269.261 -0.464 5 20 CBBD Cc1[nH]nc(C(=O)N2C[C@H](O)C[C@H]2CO)c1[N+](=O)[O-] 1321386753 JHFWPBKJFGKKCQ-NKWVEPMBSA-N 270.245 -0.806 5 20 CBBD C[C@H]1CCN(C(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1323568151 LBKBVLOFJPWKRT-VIFPVBQESA-N 295.299 -0.224 5 20 CBBD CCNCc1noc(Cn2cnc([N+](=O)[O-])n2)n1 1326236146 DINOZGAYBJDECG-UHFFFAOYSA-N 253.222 -0.273 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H]2CCCNC2=O)c1[N+](=O)[O-] 1327204305 BKUWDUAKIMPRNE-MRVPVSSYSA-N 295.299 -0.107 5 20 CBBD Cc1noc(CN2CC[C@@H](S(N)(=O)=O)C2)c1[N+](=O)[O-] 1327517707 FSYFANHGIGZRTL-SSDOTTSWSA-N 290.301 -0.246 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCN1CC[C@H](O)C1 1329626611 RORDOGYCJGSCEH-QMMMGPOBSA-N 283.288 -0.875 5 20 CBBD NC(=O)c1cc(N2CCS(=O)(=O)CC2)ccc1[N+](=O)[O-] 1330005789 IFHYTHWWOMPVIA-UHFFFAOYSA-N 299.308 -0.072 5 20 CBBD C[C@H]1CN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1 1332333460 BOMYZADHLUSODA-GXSJLCMTSA-N 269.305 -0.554 5 20 CBBD CNC[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332400401 LMPNPVHULHZWTH-VIFPVBQESA-N 282.304 -0.356 5 20 CBBD Cc1noc(Cn2cnc3c(nnn3C)c2=O)c1[N+](=O)[O-] 1347179453 WJOKNGZQJOISSZ-UHFFFAOYSA-N 291.227 -0.222 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCN(C2CNC2)CC1 1580812232 SIPMALXDUJKELO-UHFFFAOYSA-N 280.288 -0.953 5 20 CBBD C[C@@](O)(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)O 1609784121 AFDWPMFRELLOOT-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD O=C(O)[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 43702284 LYIZSPAWWILOPT-MRVPVSSYSA-N 284.228 -0.897 5 20 CBBD C[C@]1(O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 248342721 JSRDGCSYONGVEG-MNOVXSKESA-N 270.289 -0.391 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@](C)(O)CN(C)C)c1[N+](=O)[O-] 269908322 OLMLWOCVGQQHSB-GFCCVEGCSA-N 299.331 -0.077 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)Cn2ccc([N+](=O)[O-])n2)c1 270202796 ZSJWXRQTOAMIGX-QMMMGPOBSA-N 282.216 -0.043 5 20 CBBD NC(=O)[C@@H]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)O1 347736672 RRLZWQGVDVHLEH-APPZFPTMSA-N 282.256 -0.314 5 20 CBBD COCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])nn2C)C1 356461360 OURSMYPOXQCYNR-SECBINFHSA-N 297.315 -0.221 5 20 CBBD Cc1nn(C)c(N2CC(S(C)(=O)=O)C2)c1[N+](=O)[O-] 407973701 AQVPZMGMSLVYJC-UHFFFAOYSA-N 274.302 -0.130 5 20 CBBD O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CC[C@@H](CO)[C@H](O)C1 546693805 RNUWGOPCRAZIKD-OIBJUYFYSA-N 297.267 -0.489 5 20 CBBD CNC(=O)[C@@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(C)C 579241668 HPMBKSLEMZWGQW-QMMMGPOBSA-N 295.299 0.072 5 20 CBBD Nc1nc(N2C[C@@H]3COC[C@]3(C(=O)O)C2)ncc1[N+](=O)[O-] 595968875 XSQZOCRJPNOASQ-KSBSHMNSSA-N 295.255 -0.496 5 20 CBBD CC(C)(C(=O)NC[C@H](O)C(N)=O)c1ccc([N+](=O)[O-])cc1 597587568 YUQLQCCVVBCLSN-JTQLQIEISA-N 295.295 -0.165 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2CC[C@H](C1)N2 602593322 XNNPAZDMDOYJAG-AOOOYVTPSA-N 292.295 -0.281 5 20 CBBD C[S@](=O)CCNC(=O)c1cc([N+](=O)[O-])cnc1O 735116000 WWGICAXNFPYXQI-SFHVURJKSA-N 273.270 -0.196 5 20 CBBD COC[C@@](C)(NC(=O)c1n[nH]c(C)c1[N+](=O)[O-])C(=O)O 831627953 SFIRHAXHWIYRLN-SNVBAGLBSA-N 286.244 -0.154 5 20 CBBD CCN(CCCNCC[N+](=O)[O-])S(C)(=O)=O 899873845 VRYVCNSYLYNDIF-UHFFFAOYSA-N 253.324 -0.476 5 20 CBBD NC(=O)CSCC(=O)NCCn1cc([N+](=O)[O-])cn1 1116309524 JKBQWHJQPFNEHI-UHFFFAOYSA-N 287.301 -0.874 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@@H](S(C)(=O)=O)C1 1120040478 YVTLNNIRBXEFJV-SSDOTTSWSA-N 274.302 -0.048 5 20 CBBD CCN(c1nccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCNC1=O 1343587323 BFLUHQJZIQTYHY-QMMMGPOBSA-N 293.283 -0.197 5 20 CBBD CCN(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@H]1CCNC1 1349899173 ZFWPOKWXWIBAGF-JTQLQIEISA-N 294.311 -0.033 5 20 CBBD O=C(O)CNC(=O)CN1CCc2ncc([N+](=O)[O-])cc2C1 1611471015 DQLOXVCDWCOYAN-UHFFFAOYSA-N 294.267 -0.451 5 20 CBBD O=C(O)CNC(=O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 35384339 IQFMWOQTGAADKX-UHFFFAOYSA-N 295.251 -0.546 5 20 CBBD CCc1nn(C)c(N2CCN(C(=O)CO)CC2)c1[N+](=O)[O-] 91675165 DUMMGFRQAQFLFJ-UHFFFAOYSA-N 297.315 -0.468 5 20 CBBD COC(=O)[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C 120655573 NQPRWOLTKFENPO-LURJTMIESA-N 270.245 -0.223 5 20 CBBD Nc1c(C(=O)N[C@@H]2CNC(=O)C2)cccc1[N+](=O)[O-] 230655025 BCUISUHWBXGNRV-LURJTMIESA-N 264.241 -0.205 5 20 CBBD CN(C[C@H](O)CO)C(=O)c1ccc([N+](=O)[O-])n1C 354163585 ZEOMZRZXCNYOGA-ZETCQYMHSA-N 257.246 -0.642 5 20 CBBD O=C(NCCc1nc(=O)o[nH]1)c1cc(O)ccc1[N+](=O)[O-] 355495135 AATLITOCXHSYGQ-UHFFFAOYSA-N 294.223 -0.051 5 20 CBBD Cn1nnnc1Cn1cc([N+](=O)[O-])cc(Cl)c1=O 357528214 PMBOPSPCBIXADJ-UHFFFAOYSA-N 270.636 -0.018 5 20 CBBD O=C1NC[C@@H]2[C@H]1CCCN2C(=O)Cn1ccc([N+](=O)[O-])n1 374101484 ZGBNDWZQYOSFIL-RKDXNWHRSA-N 293.283 -0.472 5 20 CBBD O=[N+]([O-])c1ccn(CCN[C@@H](CO)[C@@H]2CCCO2)n1 447921927 NBGJUSNCGNQWIC-UWVGGRQHSA-N 270.289 -0.079 5 20 CBBD C[C@H]1CCNC(=O)[C@H]1NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400549 NXNGAUOZXKICSI-XPUUQOCRSA-N 293.283 -0.174 5 20 CBBD Cn1c(C(=O)Nc2nnc3nc[nH]n23)ccc1[N+](=O)[O-] 590379872 STKSYTNHHJBMGC-UHFFFAOYSA-N 276.216 -0.049 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 600349785 XEMDZCYRJZHDDZ-UHFFFAOYSA-N 288.285 -0.704 5 20 CBBD COC[C@](C)(O)CNc1ncc([N+](=O)[O-])c(N)n1 609564108 HVRALLDLKZYHDX-SECBINFHSA-N 257.250 -0.224 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)OCC(=O)N1CCC1 746971660 UTCQRBKJCSKUJG-UHFFFAOYSA-N 282.256 -0.043 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCn1cnccc1=O 816280871 SFZZXYOMMZTUTR-UHFFFAOYSA-N 293.239 -0.409 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@H](C(=O)O)C1 821315054 ILCRDCIXTHAMBV-ZETCQYMHSA-N 284.228 -0.746 5 20 CBBD CS(=O)(=O)N1CCC[C@@H](NCC[N+](=O)[O-])C1 905062640 YINYPVHKZJTRLR-MRVPVSSYSA-N 251.308 -0.723 5 20 CBBD O=C(NC1CCN(CCCO)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] 1002788085 NDOKGKSWEBVELI-GHMZBOCLSA-N 271.317 -0.385 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(Cc2cnn(C)n2)C1 1042705211 MLBNRBAOULLXLK-GHMZBOCLSA-N 294.315 -0.877 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H]2COCC[C@@H]21 1119917316 PJJSPVGAIZPCGX-WCBMZHEXSA-N 296.283 -0.042 5 20 CBBD COCc1nc2n(n1)C[C@H](NCC[N+](=O)[O-])CC2 1120274040 XLSLFJQRXCOFRV-MRVPVSSYSA-N 255.278 -0.394 5 20 CBBD CN1CCC(N(C)C(=O)Cn2cnc([N+](=O)[O-])n2)CC1 1251171715 DQICMSKKUCILIV-UHFFFAOYSA-N 282.304 -0.261 5 20 CBBD CC(C)(CCC(=O)N[C@](C)(CO)C(=O)O)[N+](=O)[O-] 1592742557 PMSYSPASFYKEOU-SNVBAGLBSA-N 262.262 -0.226 5 20 CBBD CN1CCN(c2c([N+](=O)[O-])ncn2C)C[C@@H](C(=O)O)C1 1598619848 MVTXOISLRJQRKT-QMMMGPOBSA-N 283.288 -0.219 5 20 CBBD Cn1cc(CNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cn1 41159583 WJVRCFBCKIDFAT-NSHDSACASA-N 280.288 -0.325 5 20 CBBD CC[C@@H]1C(=O)NCCN1Cn1cc([N+](=O)[O-])cn1 106855701 HAXFVUJKZLJEKO-SECBINFHSA-N 253.262 -0.041 5 20 CBBD CN1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CCC1=O 133639473 AUKSOXAOQJESEM-SECBINFHSA-N 295.299 -0.082 5 20 CBBD C[C@@H]1CN(C(=O)Cn2ncc([N+](=O)[O-])c2N)CCO1 177760337 FKZRRWNUWVPEMB-SSDOTTSWSA-N 269.261 -0.379 5 20 CBBD COC(=O)N1CC(NC(=O)Cn2cc([N+](=O)[O-])cn2)C1 269397288 YJVDSKXFTXGPEX-UHFFFAOYSA-N 283.244 -0.642 5 20 CBBD C[C@@H](O)C(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 270861935 RWHQJVSHYWGKDD-MRVPVSSYSA-N 296.283 -0.412 5 20 CBBD C[C@H](CN1CCN(C)CC1)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285597645 YBWDQCXMRGWQFH-SECBINFHSA-N 296.331 -0.316 5 20 CBBD NC(=O)[C@H]1CN(c2c(F)cccc2[N+](=O)[O-])CCN1 286312721 ZEYWEPYZFCFZBX-MRVPVSSYSA-N 268.248 -0.003 5 20 CBBD O=C(Nc1nc(SCCO)n[nH]1)c1cc([N+](=O)[O-])[nH]n1 288575808 XVQJBJQJFLLJDM-UHFFFAOYSA-N 299.272 -0.227 5 20 CBBD C[C@H](O)CN(C)c1ncc([N+](=O)[O-])cc1C(N)=O 292372798 PQUKXASUJFOXNU-LURJTMIESA-N 254.246 -0.094 5 20 CBBD C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])[nH]n2)CCS1(=O)=O 293849330 UTZGIAZZHZNGDS-WDSKDSINSA-N 288.285 -0.377 5 20 CBBD CS(=O)(=O)NCCCNC(=O)c1ccc([N+](=O)[O-])[nH]1 298843426 IBNFRIWWEBQFLV-UHFFFAOYSA-N 290.301 -0.408 5 20 CBBD Cn1c(C(=O)NCCNS(C)(=O)=O)ccc1[N+](=O)[O-] 342806866 UQWQUIZQQDRHMY-UHFFFAOYSA-N 290.301 -0.788 5 20 CBBD CCn1cc(S(=O)(=O)N(C)[C@@H](C)CN)c([N+](=O)[O-])n1 353217843 MVPSIVYGYOUKLH-ZETCQYMHSA-N 291.333 -0.221 5 20 CBBD CCCc1[nH]nc(C(=O)NC[C@](C)(O)CO)c1[N+](=O)[O-] 355288829 KDNALXOHYXCZCF-NSHDSACASA-N 286.288 -0.257 5 20 CBBD Cc1[nH]nc(C(=O)N2CCN(C)C(=O)[C@@H]2C)c1[N+](=O)[O-] 428570666 IGISVSPVJGPOTD-ZETCQYMHSA-N 281.272 -0.071 5 20 CBBD CCOC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])nc1C 433369207 ZYNDTCDNVVNWDA-SECBINFHSA-N 286.288 -0.387 5 20 CBBD Nc1nc(NCC2(CO)COC2)ncc1[N+](=O)[O-] 446871534 NTAMZNQLQPQAIB-UHFFFAOYSA-N 255.234 -0.612 5 20 CBBD O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H](O)CN1 514605903 WCKDRGYUWNCXBZ-CMPLNLGQSA-N 295.295 -0.187 5 20 CBBD CCN1CC[C@@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 591765805 IUHGJWGZRPYNKR-WDEREUQCSA-N 297.315 -0.637 5 20 CBBD COC(=O)COCCNC(=O)Cn1ccc([N+](=O)[O-])n1 600404373 CHDPKGZIIYWPRR-UHFFFAOYSA-N 286.244 -0.903 5 20 CBBD COC(=O)C[C@@H](O)Cn1cc([N+](=O)[O-])ccc1=O 609481456 LVSRMFOMWSUXFM-MRVPVSSYSA-N 256.214 -0.320 5 20 CBBD O=[N+]([O-])c1ccc(N(CCO)CCO)c(-c2nn[nH]n2)c1 738369539 HXQWZAPLZOSXJM-UHFFFAOYSA-N 294.271 -0.434 5 20 CBBD Cn1nnc(COC(=O)c2c([N+](=O)[O-])cnn2C)n1 799502047 UISIMCRPJYIZMT-UHFFFAOYSA-N 267.205 -0.791 5 20 CBBD CNC(=O)[C@H](O)CNc1cc(N)ccc1[N+](=O)[O-] 808048497 VVOLCAIEXHGAIZ-SECBINFHSA-N 254.246 -0.304 5 20 CBBD CN1C[C@H](N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1=O 848129661 SPDAIKILPVOQMB-IWSPIJDZSA-N 255.274 -0.269 5 20 CBBD O=C(CN1C(=O)CNC1=O)NCc1cccc([N+](=O)[O-])c1 1116060771 OMKLGGFITJHRBQ-UHFFFAOYSA-N 292.251 -0.237 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCN1 1326046568 GMVLQQITMXVBOZ-SSDOTTSWSA-N 253.262 -0.190 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCCNc1ncccn1 1352899391 RYXQKXZEZCHHGZ-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD O=C1CN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCN1 1607047296 GYYIFQSSPSWJBQ-UHFFFAOYSA-N 289.255 -0.289 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCN2CCOCC2)c1 37880943 YPQFXBSYIGZUBB-LBPRGKRZSA-N 299.331 -0.926 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCO[C@H](C(=O)O)C1 43751808 MQRMPXGVWVEDIX-LURJTMIESA-N 256.218 -0.382 5 20 CBBD CN1CC[C@@H](N(C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 75752623 GCMHBXPWGNENKT-WDEREUQCSA-N 297.315 -0.685 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN1CC[C@@H](O)C1 90526213 MFSIIPOHSDZWMB-SNVBAGLBSA-N 253.258 -0.177 5 20 CBBD O=C(O)CSCCNC(=O)Cn1ccc([N+](=O)[O-])n1 262065121 HRULGYYZQBERSZ-UHFFFAOYSA-N 288.285 -0.275 5 20 CBBD O=C(N[C@]1(CCO)CCOC1)c1cnc(O)c([N+](=O)[O-])c1 277981806 CAYDWONSENXHAT-GFCCVEGCSA-N 297.267 -0.033 5 20 CBBD CN(CCOCCO)C(=O)Cn1ccc([N+](=O)[O-])n1 282044856 CBVRLZVYUYUCQO-UHFFFAOYSA-N 272.261 -0.741 5 20 CBBD COC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])[nH]n2)CCO1 285527155 FFBPJZYRLDQARV-SSDOTTSWSA-N 270.245 -0.195 5 20 CBBD CS(=O)(=O)C1CN(c2ncc([N+](=O)[O-])c(N)n2)C1 337938743 WADJDUJEMAQFGS-UHFFFAOYSA-N 273.274 -0.800 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCC[C@H]1O 341837293 PUUHSDXLVRZEAB-HTQZYQBOSA-N 269.261 -0.442 5 20 CBBD NC(=O)[C@@]1(O)CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1 355070691 OXAYIFSDDQMARN-GFCCVEGCSA-N 295.251 -0.637 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@]1(O)CCN(C)C1 358046273 KOKOBGQZODHOQO-LBPRGKRZSA-N 297.315 -0.717 5 20 CBBD Cc1n[nH]cc1CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 576270977 OBBQSRNQUVDIOO-NSHDSACASA-N 280.288 -0.026 5 20 CBBD CN(Cc1nnc(O)o1)C(=O)c1c[nH]nc1[N+](=O)[O-] 598744560 HEDFEZVAUFCEDV-UHFFFAOYSA-N 268.189 -0.321 5 20 CBBD O=C(NCCN1CC[C@H](O)C1)c1ccc([N+](=O)[O-])[nH]1 600807475 HPSVCSDIFGLSFQ-QMMMGPOBSA-N 268.273 -0.281 5 20 CBBD O=C(NN1CCCNC1=O)c1cc([N+](=O)[O-])n[nH]1 803052541 AJFDHMIZFZLXAK-UHFFFAOYSA-N 254.206 -0.622 5 20 CBBD COCC[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839775690 WRGDRDWTDNDBPZ-IVZWLZJFSA-N 258.274 -0.085 5 20 CBBD CN[C@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923278152 PKYNDQYWSOAFOR-ONGXEEELSA-N 269.305 -0.554 5 20 CBBD C[C@H]1NC(=O)N(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 1116145477 VQURAKSMRPPECA-SVRRBLITSA-N 283.244 -0.908 5 20 CBBD CCn1cc(CNC(=O)c2c([N+](=O)[O-])cnn2C)nn1 1118786258 GVBVZQWOWRDNSX-UHFFFAOYSA-N 279.260 -0.130 5 20 CBBD COCCCNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767769 TWIAYFGMARAVPR-NXEZZACHSA-N 259.306 -0.216 5 20 CBBD C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ncn(C)n1 1320847053 AHSFFIXNQSAGKF-ZETCQYMHSA-N 279.260 -0.203 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@@H]1CO 1338724916 XCPKFEQPBZJWPY-MWLCHTKSSA-N 295.295 -0.014 5 20 CBBD O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H](CO)[C@H](O)C1 1344550230 WITIINRYZRXFTQ-POYBYMJQSA-N 270.245 -0.867 5 20 CBBD CONC(=O)CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-] 1591466618 STYIMAKMEHNVEV-UHFFFAOYSA-N 293.243 -0.136 5 20 CBBD O=C(O)[C@H]1CCN1C(=O)Cn1cc([N+](=O)[O-])ccc1=O 1601835371 VDOJICUWWKQFPI-MRVPVSSYSA-N 281.224 -0.558 5 20 CBBD O=C(O)c1ccnc(N2CCO[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 1602479594 IVRLHPXNTWVSCG-SSDOTTSWSA-N 297.223 -0.022 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@@H](O)CO)cc1-c1nn[nH]n1 1607082696 SGXFWYBTTOZINH-SSDOTTSWSA-N 280.244 -0.460 5 20 CBBD C[C@H](NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C(N)=O 45798964 FYYHVGGPSKAEJM-ZETCQYMHSA-N 287.297 -0.112 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCc2ccon2)c1 148874692 NBUVUAHSKNKIBK-SNVBAGLBSA-N 267.245 -0.070 5 20 CBBD O=C(c1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 236575216 BIKJFRBJVRTFIO-UWVGGRQHSA-N 252.226 -0.228 5 20 CBBD CCN(CCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 269473711 JOKFUAJCUGLCJM-UHFFFAOYSA-N 269.257 -0.403 5 20 CBBD CN(C[C@H](O)CO)C(=O)COc1ccccc1[N+](=O)[O-] 273652784 BFBOBTYNCJTOLJ-VIFPVBQESA-N 284.268 -0.215 5 20 CBBD CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 276180109 GTDUAUHHMOJBLB-UHFFFAOYSA-N 278.268 -0.005 5 20 CBBD O=C(NC[C@@H](O)C1CCOCC1)c1cc([N+](=O)[O-])[nH]n1 286702664 HSYWIZKZYPVIFE-SECBINFHSA-N 284.272 -0.165 5 20 CBBD CC(=O)NCCNc1ncc([N+](=O)[O-])cc1C(N)=O 298277649 DVGFXSYBWAFHNC-UHFFFAOYSA-N 267.245 -0.363 5 20 CBBD Cn1cnc([N+](=O)[O-])c1Nc1ccn(CC(N)=O)n1 340684232 ZWHWCQDVJCELJG-UHFFFAOYSA-N 265.233 -0.246 5 20 CBBD CN(CC(=O)N1CCOCC1)C(=O)c1n[nH]cc1[N+](=O)[O-] 343166057 UTVVZLPIKIBLAJ-UHFFFAOYSA-N 297.271 -0.751 5 20 CBBD Cc1nn(C)c(C(=O)NCC(F)(F)CO)c1[N+](=O)[O-] 344971035 QVQRBKTXMDUROP-UHFFFAOYSA-N 278.215 -0.006 5 20 CBBD N=C(N)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 347399439 KGOFNJUQAGZTAG-UHFFFAOYSA-N 272.286 -0.148 5 20 CBBD CCN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C[C@@H](C)O 352233367 YDVRWVYYOVPLSP-KOLCDFICSA-N 272.305 -0.145 5 20 CBBD Nc1c(C(=O)N2C[C@@H](O)C[C@@H]2CO)cccc1[N+](=O)[O-] 371526948 UIWMITFQENEBST-SFYZADRCSA-N 281.268 -0.255 5 20 CBBD CCc1[nH]nc(C(=O)N[C@@H](C)CC(N)=O)c1[N+](=O)[O-] 439329522 YEZUJMVIHRVRCU-YFKPBYRVSA-N 269.261 -0.126 5 20 CBBD C[C@@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)S(C)(=O)=O 552365709 OEFGHPPJWUSQGJ-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD CNc1nccc(C(=O)NCC(C)(C)O)c1[N+](=O)[O-] 566444402 GBVAOKQNNJTISF-UHFFFAOYSA-N 268.273 0.532 5 20 CBBD Nc1ccc(N[C@@H]2C[C@H](C(=O)O)C[C@H]2O)nc1[N+](=O)[O-] 595981992 ZOWOQWRWVYVMHO-UIISKDMLSA-N 282.256 0.208 5 20 CBBD Nc1nc(=NCCOC[C@H]2CCOC2)[nH]cc1[N+](=O)[O-] 609463996 NITFTOWCDSNYPV-QMMMGPOBSA-N 283.288 -0.146 5 20 CBBD CC[C@@](C)(NC(=O)CCn1cc([N+](=O)[O-])cn1)C(N)=O 770015689 IQSNAZSRGDRFJM-LLVKDONJSA-N 283.288 -0.048 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCN1CCOCC1=O 785301615 QCRAWFBPUPWGGN-UHFFFAOYSA-N 298.255 -0.807 5 20 CBBD O=[N+]([O-])CCN[C@H]1CCCN(CCN2CCOCC2)C1 905447322 QCSCXHNYRDVBJO-ZDUSSCGKSA-N 286.376 -0.351 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@](O)(C(=O)O)C1 1608159600 RUKQLMCWGMZHFS-SECBINFHSA-N 256.218 -0.646 5 20 CBBD NC(=O)NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 26535239 PXXPABHNNNAWQF-UHFFFAOYSA-N 267.197 -0.019 5 20 CBBD CNC(=O)CCN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 170815874 HJXLXDNIYNRTIL-UHFFFAOYSA-N 269.261 -0.614 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@]1(O)CCOC1 229690410 BQPANIVAIQFKHH-SNVBAGLBSA-N 270.245 -0.941 5 20 CBBD C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H](CO)O1 230419606 LBQPBDDDQGQHNG-CBAPKCEASA-N 296.283 -0.206 5 20 CBBD NC(=O)C1=NO[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 276247275 LPDFZWYJYHUXEU-VIFPVBQESA-N 292.251 -0.045 5 20 CBBD CNC(=O)[C@H](CO)Nc1ncc(C)cc1[N+](=O)[O-] 302803608 VLUPXGLJUHDBPP-ZETCQYMHSA-N 254.246 -0.183 5 20 CBBD CCN(CC)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 336930763 BHVWGYNQGMBPRX-UHFFFAOYSA-N 270.293 -0.356 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C(N)=O)C(C)C 337141872 WFAKMIHNKVGGGR-JTQLQIEISA-N 283.288 -0.274 5 20 CBBD Cc1nn(C)c(C(=O)N(C)[C@H]2CCN(C)C2=O)c1[N+](=O)[O-] 341733960 SUOOVFVLVUYDQX-QMMMGPOBSA-N 295.299 -0.061 5 20 CBBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)N1CCOCC1 345073840 KPIMISSIQFRWDX-QMMMGPOBSA-N 296.283 -0.100 5 20 CBBD O=C(NCCCc1nc(O)n[nH]1)c1cc([N+](=O)[O-])n[nH]1 354336527 OBDBQVTVYMAPEM-UHFFFAOYSA-N 281.232 -0.496 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1Cc1c([N+](=O)[O-])ncn1C 361685455 FAIWDTDRSPFYSV-RKDXNWHRSA-N 270.289 -0.090 5 20 CBBD C[C@@H](O)[C@@H](CO)NC(=O)COc1ccc([N+](=O)[O-])cc1 387432662 IQUBWBKERSJYIZ-LDYMZIIASA-N 284.268 -0.169 5 20 CBBD O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC(CO)CO 593570192 URCHWXQUINLCRT-UHFFFAOYSA-N 272.232 -0.254 5 20 CBBD Nc1ncc2c(n1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CC2 598951070 PWARHPKAVWGQIG-UHFFFAOYSA-N 289.255 -0.111 5 20 CBBD CC(C)(C(=O)NCCNC(N)=O)n1cc([N+](=O)[O-])cn1 735812739 QAJCZENYHPVABA-UHFFFAOYSA-N 284.276 -0.689 5 20 CBBD CCCc1[nH]nc(C(=O)NOCC(N)=O)c1[N+](=O)[O-] 772936316 NEDMVZDSQWTQIJ-UHFFFAOYSA-N 271.233 -0.583 5 20 CBBD O=C(NC1CN(C(=O)c2cnccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280327 PECWAWWPIXQVOC-PSASIEDQSA-N 291.267 -0.918 5 20 CBBD O=C(CCn1cc([N+](=O)[O-])cn1)N1CCn2ncnc2C1 1338233517 NYYKKKHUJUOIOI-UHFFFAOYSA-N 291.271 -0.185 5 20 CBBD CON(C)C(=O)[C@@H](C)NC(=O)c1c([N+](=O)[O-])cnn1C 1351718272 XLQWPDCMPHKBQV-ZCFIWIBFSA-N 285.260 -0.534 5 20 CBBD Cc1nc(N2CCN(CC(=O)O)CC2)ncc1[N+](=O)[O-] 1356154094 JXDHGJLCWMYVIG-UHFFFAOYSA-N 281.272 -0.100 5 20 CBBD C[C@H](c1nnc(N2CCC[C@@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1525462175 KDERNKMTYXBVAV-HTQZYQBOSA-N 282.304 -0.146 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC2(CNC2)C1 1580102735 IDWRHFSKNHGUMN-UHFFFAOYSA-N 263.257 -0.502 5 20 CBBD Cc1nn(CC(=O)NCC(=O)O)c2ncc([N+](=O)[O-])cc12 1594487628 UZZUUMYUFRSWNL-UHFFFAOYSA-N 293.239 -0.151 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C(=O)O)C1 1598618400 DIXYQSHSXLYEHN-JTQLQIEISA-N 297.315 -0.261 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC(O)(C(=O)O)C1 1607985224 RKCWZSZWTXFHHP-UHFFFAOYSA-N 281.224 -0.430 5 20 CBBD Cc1cc([N+](=O)[O-])cnc1N1CCO[C@@H](C(N)=O)C1 78571698 RGBOCZGDTIDQMX-SECBINFHSA-N 266.257 -0.011 5 20 CBBD C[C@@H](O)CCCNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 227714596 KPFXGQNETSELRW-MWLCHTKSSA-N 272.305 -0.097 5 20 CBBD CC(C)C[C@H](CN)NC(=O)Cn1cnc([N+](=O)[O-])n1 236583860 JRQNKMVYDSZLNI-MRVPVSSYSA-N 270.293 -0.324 5 20 CBBD COCCN(CCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 270190661 DZHPVGZHZMTERD-UHFFFAOYSA-N 299.283 -0.776 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc(O)c([N+](=O)[O-])c1 273431417 XJXLENOIMNQHPO-ZETCQYMHSA-N 284.224 -0.436 5 20 CBBD COC(=O)[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])[nH]n1 286309088 XJBJROCMHBMSGN-ZETCQYMHSA-N 284.228 -0.668 5 20 CBBD CCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])nc1C)C(N)=O 286335888 LSZXVKCMLFJJDA-QMMMGPOBSA-N 283.288 -0.130 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CNC(=O)C1 330729689 HTNIYRGVDKWQLH-ZETCQYMHSA-N 267.245 -0.896 5 20 CBBD CN(CCOCCO)C(=O)N=c1cc[nH]cc1[N+](=O)[O-] 337543719 SIJLBRWVAJCBIZ-UHFFFAOYSA-N 284.272 -0.116 5 20 CBBD CCc1[nH]nc(C(=O)NC[C@@H](O)COC)c1[N+](=O)[O-] 338680154 JWMZKFUFLRHMFJ-ZCFIWIBFSA-N 272.261 -0.383 5 20 CBBD Cn1cnnc1CNc1ncc([N+](=O)[O-])c(N)n1 341807840 GVINDJBRNMTFKR-UHFFFAOYSA-N 250.222 -0.292 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1N 345283835 JYISFRHSZILELY-MRVPVSSYSA-N 283.240 -0.559 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCc1nc[nH]n1 346823911 FZSUBBSDSKUJFD-UHFFFAOYSA-N 277.244 -0.139 5 20 CBBD NC(=O)c1ccc(N2C[C@@H](O)C[C@H]2CO)c([N+](=O)[O-])c1 347409861 HHWFMFFKWDFMOC-IUCAKERBSA-N 281.268 -0.374 5 20 CBBD Cn1cc(CNC(=O)c2cc([N+](=O)[O-])nn2C)cn1 356466744 YEXQSHFXJCPITN-UHFFFAOYSA-N 264.245 -0.008 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H](O)COCC1CC1 359587284 GWRLFNKBIUYHSH-NSHDSACASA-N 298.299 -0.305 5 20 CBBD O=C(O)c1ccnc(NC(CO)CO)c1[N+](=O)[O-] 386435612 OVUYVSFCHLUVBG-UHFFFAOYSA-N 257.202 -0.547 5 20 CBBD CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CCNC1=O 442924475 KJEQSQDKHKRLHI-SSDOTTSWSA-N 281.272 -0.023 5 20 CBBD C[C@H]1CN(CCNC(=O)c2cc([N+](=O)[O-])nn2C)CCO1 547840759 QYQLVSWYBLFCDO-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD CCN1CC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1=O 594357089 SMDBIWZCNRWHMH-QMMMGPOBSA-N 293.283 -0.077 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC(=O)N1 596496967 UHCRJAXMDRTMNG-LURJTMIESA-N 279.256 -0.221 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2CC[C@H]1C2 597710559 VMIKRWRJDJVUQZ-VIFPVBQESA-N 265.273 -0.292 5 20 CBBD CN1CCN(CC(=O)NCCn2cc([N+](=O)[O-])cn2)CC1 610889779 SICCYQSTQUWYPV-UHFFFAOYSA-N 296.331 -0.845 5 20 CBBD CNS(=O)(=O)CCSc1ncc([N+](=O)[O-])c(N)n1 857223196 HIQMQPPAVQPVIO-UHFFFAOYSA-N 293.330 -0.392 5 20 CBBD CC(C)[C@H](N)CNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1118197025 LOUKLKQHDXRKRH-SECBINFHSA-N 282.300 -0.144 5 20 CBBD CCOCCCNCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1126938914 MVDBLRUPVPSAGX-NXEZZACHSA-N 259.306 -0.216 5 20 CBBD Nc1c(C(=O)N2C[C@@H](CO)[C@H](CO)C2)cccc1[N+](=O)[O-] 1301426374 AOOGITVGRKURMG-IUCAKERBSA-N 295.295 -0.150 5 20 CBBD C[C@@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)[C@H](C(=O)O)C1 1604745332 PWNWXALOYKWJQY-SFYZADRCSA-N 297.271 -0.102 5 20 CBBD CO[C@@]1(C(=O)O)CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1606700405 KOHYGLZBYLOQMX-JTQLQIEISA-N 284.228 -0.366 5 20 CBBD Cn1ncc([N+](=O)[O-])c1N1CC[C@@](O)(C(=O)O)C1 1608159601 RUKQLMCWGMZHFS-VIFPVBQESA-N 256.218 -0.646 5 20 CBBD CC[C@@H](C)[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)OC 53835767 PWBHSKBPZPBHCG-VXNVDRBHSA-N 299.287 -0.110 5 20 CBBD CN1CC[C@@H](N(C)c2c([N+](=O)[O-])ncn2C)C1=O 77992037 IMKFQPOBIMXXIK-SSDOTTSWSA-N 253.262 -0.005 5 20 CBBD NC(=O)C1(NS(=O)(=O)c2csc([N+](=O)[O-])c2)CC1 119978426 ZUUKATMWNNPYLU-UHFFFAOYSA-N 291.310 -0.048 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 186844700 CDJVFJSHIXSVPO-LURJTMIESA-N 267.245 -0.379 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC(=O)NCC1(C)C 282815136 YEURBFYDRWDBDK-UHFFFAOYSA-N 295.299 -0.163 5 20 CBBD C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 285814473 DYOGMAGYMQIUAG-SVGQVSJJSA-N 267.245 -0.428 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2cc([N+](=O)[O-])[nH]n2)C[C@@H]1C 285820553 WJXDPPKRODUBKK-IUCAKERBSA-N 297.315 -0.155 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 352994686 WLEASZKMUBKMMN-JTQLQIEISA-N 292.251 -0.348 5 20 CBBD CCN(C)CCNC(=O)Cn1cnc([N+](=O)[O-])n1 354022482 PJWHWOQRGNEBML-UHFFFAOYSA-N 256.266 -0.746 5 20 CBBD COCCN(CC(=O)OC)Cc1c([N+](=O)[O-])ncn1C 355349591 ICWDSMUIHVXVCH-UHFFFAOYSA-N 286.288 -0.050 5 20 CBBD CN(C)c1noc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)n1 356415480 RLHTUPAETDXAOK-UHFFFAOYSA-N 295.259 -0.443 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CCCCNC1=O 372561907 ABHRPXFOCNNACR-IWSPIJDZSA-N 255.274 -0.221 5 20 CBBD Cn1cc(C(=O)C(=O)Nc2c([N+](=O)[O-])cnn2C)cn1 429045276 GESUBMOHYDFXFE-UHFFFAOYSA-N 278.228 -0.117 5 20 CBBD O=[N+]([O-])c1cnn(CCNC[C@@H](O)Cn2cccn2)c1 515054428 HPNPLHJLLPPWMF-LLVKDONJSA-N 280.288 -0.362 5 20 CBBD CN(C)C(=O)CCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 549154269 WNOGPQMRPCFPKK-UHFFFAOYSA-N 269.261 -0.084 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1CC[C@H]1O 565770965 ZMZXFODBZVHDAR-RNFRBKRXSA-N 273.270 -0.209 5 20 CBBD CN1C[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)CCC1=O 576987683 VUTHGNBXGSOXRQ-SECBINFHSA-N 295.299 -0.130 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2C[C@@H]3CNC[C@@H]3C2)c1 610336112 KHAMQPCWBTWWGP-JFGNBEQYSA-N 281.316 -0.697 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 619254989 SAORBWZUXUBGAE-QMMMGPOBSA-N 293.239 -0.953 5 20 CBBD CN1C(=O)CN(NC(=O)c2cnc(O)c([N+](=O)[O-])c2)C1=O 770683734 SNEGXVKOCHFVCR-UHFFFAOYSA-N 295.211 -0.766 5 20 CBBD NC(=O)c1ccnc(NC[C@H]2COCO2)c1[N+](=O)[O-] 853686818 FVEQEVZGSMRGDE-LURJTMIESA-N 268.229 -0.127 5 20 CBBD CN(C[C@@H](O)CN1CCOCC1)c1c([N+](=O)[O-])cnn1C 892856908 PBMOXJXRWDYONT-SNVBAGLBSA-N 299.331 -0.542 5 20 CBBD COC(=O)[C@H]1CC[C@@H](C(=O)OC)N(CC[N+](=O)[O-])C1 931176461 LDUFTEUWSGPIFX-IUCAKERBSA-N 274.273 -0.310 5 20 CBBD C[C@@H](C[S@@](C)=O)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1116837467 HFDGLPKJYYKLLP-IEMIWKFJSA-N 260.275 -0.185 5 20 CBBD C[C@@]1(NC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CCNC1 1327592393 KMDSMNHLBWKARJ-GFCCVEGCSA-N 280.284 -0.375 5 20 CBBD CON(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)C(=O)O 1594036969 NLOMOSXACPJEAH-ZETCQYMHSA-N 299.239 -0.380 5 20 CBBD Cc1cnc(N2CC(O)(C(=O)O)C2)c([N+](=O)[O-])c1 1600623859 DUMGXRBLWNSKDI-UHFFFAOYSA-N 253.214 -0.066 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(O)(C(=O)O)C1 1602625388 FORVHHFIBVPDJG-UHFFFAOYSA-N 282.208 -0.428 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC(C(=O)O)CC1 1608091206 ZWSATTUCBCRWAV-UHFFFAOYSA-N 269.261 -0.107 5 20 CBBD NC(=O)C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 157339709 KQCRNHLTOBUGNC-UHFFFAOYSA-N 267.289 -0.011 5 20 CBBD CC(C)N1C[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1=O 263740029 QRTWAPPJPOXSRC-SECBINFHSA-N 295.299 -0.083 5 20 CBBD Nc1nc(NCCCN2C(=O)CNC2=O)ncc1[N+](=O)[O-] 264427991 BXGCROUNXWJCSB-UHFFFAOYSA-N 295.259 -0.679 5 20 CBBD CNC(=O)[C@H](C)CN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 267200917 JRZPQFWMOZDHLY-MRVPVSSYSA-N 283.288 -0.368 5 20 CBBD O=C(CCc1cccc([N+](=O)[O-])c1)NCC(=O)NCCO 269558287 QBEUDQLUSBCYNC-UHFFFAOYSA-N 295.295 -0.248 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 274701149 PYBQUXVJZFVOQF-MRVPVSSYSA-N 284.224 -0.436 5 20 CBBD O=[N+]([O-])c1cccc2ncnc(NC[C@H](O)CO)c12 347411788 RVPSLJPDAFQXGJ-ZETCQYMHSA-N 264.241 0.303 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NCCOCCN(C)C 349744432 MLSZMVDKSONZFD-UHFFFAOYSA-N 299.331 -0.206 5 20 CBBD COC[C@H](CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O)OC 358374461 JUONRJRNKJDZEI-JTQLQIEISA-N 299.283 -0.466 5 20 CBBD CN(CC(N)=O)c1cccc([N+](=O)[O-])c1S(N)(=O)=O 565928229 IMWKYLBXKRSJJZ-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD CN1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)CC1=O 615990764 LATUXZBJMPKGJZ-ZCFIWIBFSA-N 266.261 0.000 5 20 CBBD O=C(NCCNc1ccnc(O)c1[N+](=O)[O-])c1cnon1 1093798274 KFASRXZKJCLAHP-UHFFFAOYSA-N 294.227 -0.080 5 20 CBBD CC(=O)NCC(=O)NCCNCc1cccc([N+](=O)[O-])c1 1122667582 HDJQAAFCIKIKTN-UHFFFAOYSA-N 294.311 -0.063 5 20 CBBD Cn1ccc(CNCCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1157767556 QLDOSXJGIZTDPC-GHMZBOCLSA-N 281.316 -0.319 5 20 CBBD O=C(NCCCOCCO)c1n[nH]cc1[N+](=O)[O-] 1320059220 HLFKRDSCROZOIE-UHFFFAOYSA-N 258.234 -0.553 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)OCc1nc(=O)n(C)[nH]1 1320542897 IEDIPXPNYLCEMI-UHFFFAOYSA-N 282.216 -0.893 5 20 CBBD Cn1nncc1CNC(=O)Cn1cc([N+](=O)[O-])ccc1=O 1323792035 UTKXDMNLYWXEIW-UHFFFAOYSA-N 292.255 -0.799 5 20 CBBD Cn1nnc(C[S@@](=O)CCn2cc([N+](=O)[O-])cn2)n1 1346683689 UWDVQAFVDLHQOA-IBGZPJMESA-N 285.289 -0.736 5 20 CBBD C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C(=O)O 1594241826 VGWCAZWDMXKGFN-BYPYZUCNSA-N 254.202 -0.026 5 20 CBBD O=C(O)c1ccnc(N[C@@H]2C[C@H](O)[C@H](O)C2)c1[N+](=O)[O-] 1602483540 NUGHAWCERUNGCO-HYTIDYPLSA-N 283.240 -0.016 5 20 CBBD O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@](O)(C(=O)O)C1 1602625515 PWEWNDCFVUTLBL-LBPRGKRZSA-N 296.235 -0.038 5 20 CBBD CCOC[C@H](O)CNC(=O)Cn1cc([N+](=O)[O-])cn1 311589817 QTAIVOLAIGDLJB-SECBINFHSA-N 272.261 -0.695 5 20 CBBD C[C@H]1CCNC(=O)[C@@H]1NCc1c([N+](=O)[O-])ncn1C 331274964 PXINDFVFSSVFCG-IONNQARKSA-N 267.289 -0.058 5 20 CBBD Cc1cc(=O)n(CCCS(N)(=O)=O)cc1[N+](=O)[O-] 353828903 JNWWMQAQMQBMQT-UHFFFAOYSA-N 275.286 -0.256 5 20 CBBD COC(=O)[C@@](C)(O)CNc1c([N+](=O)[O-])ncn1C 361674832 UAIIWWGZHGVOSF-VIFPVBQESA-N 258.234 -0.336 5 20 CBBD C[C@@H]1CNCC[C@@H]1NC(=O)Cn1cc([N+](=O)[O-])cn1 432525458 HUBKPESWBGIUOQ-SCZZXKLOSA-N 267.289 -0.095 5 20 CBBD CCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1CCNC1=O 443026984 BQSNRONIWUFRGP-VIFPVBQESA-N 293.283 -0.077 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1C[C@@H]2C[C@H]1CN2 602590722 YXXRTYNHERCZIH-YUMQZZPRSA-N 251.246 -0.636 5 20 CBBD Cc1nn(C)c(C(=O)OCc2nc(O)n[nH]2)c1[N+](=O)[O-] 774928214 ZXTCSHBQLLEEBS-UHFFFAOYSA-N 282.216 -0.183 5 20 CBBD Nc1ccc(NC(=O)CN2CC(=O)NC2=O)cc1[N+](=O)[O-] 819905801 WTOQVVRCTSAWIU-UHFFFAOYSA-N 293.239 -0.333 5 20 CBBD CCn1ncn(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c1=O 854629134 ZYBSENGWMZQHFI-UHFFFAOYSA-N 267.205 -0.920 5 20 CBBD CC(C)NS(=O)(=O)N1CCN(CC[N+](=O)[O-])CC1 930344271 OQWYPKCBTWKLRZ-UHFFFAOYSA-N 280.350 -0.877 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@](F)(C(=O)O)C1 1116789147 RMJPKHYWUONKIH-JTQLQIEISA-N 286.219 -0.033 5 20 CBBD CNC(=O)Cc1noc(-c2c([N+](=O)[O-])c(C)nn2C)n1 1319285236 ZNRJMXJTARAMHD-UHFFFAOYSA-N 280.244 -0.025 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@]1(O)CCSC1 1319645183 FNVCOCFDBUURLN-JTQLQIEISA-N 286.313 -0.074 5 20 CBBD Cc1[nH]nc(C(=O)N[C@]2(CCO)CCOC2)c1[N+](=O)[O-] 1320865940 QKJFOHFFUDAPPL-LLVKDONJSA-N 284.272 -0.102 5 20 CBBD CC(=O)N1CCCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1341370530 AFTXQODDCIMMCF-UHFFFAOYSA-N 282.304 -0.350 5 20 CBBD Cc1[nH]nc(C(=O)NCC2[C@H]3CNC[C@H]23)c1[N+](=O)[O-] 1579514755 WNCDVZLQLWHCOO-BQBZGAKWSA-N 265.273 -0.178 5 20 CBBD CC(C)(CCC(=O)NC[C@](C)(O)C(=O)O)[N+](=O)[O-] 1593400460 GAZRUCBDVSDFRW-JTQLQIEISA-N 262.262 -0.226 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN2CCC(CO)CC2)c1 75626586 XQLYWIJFYHDBOG-GFCCVEGCSA-N 284.316 -0.144 5 20 CBBD CC(C)[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(N)=O 171730603 JIHSJGGQAYJVJV-SECBINFHSA-N 269.261 -0.583 5 20 CBBD Cc1nc([N+](=O)[O-])c(N2CCO[C@@H](C(=O)O)C2)n1C 235963516 GNMZHJKLWPRDRV-SSDOTTSWSA-N 270.245 -0.073 5 20 CBBD COc1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2)cc1[N+](=O)[O-] 269256159 PBHCMYDEPHYRQS-ZJUUUORDSA-N 295.295 -0.058 5 20 CBBD Cc1nn(C)c(N2CCC(O)(C(N)=O)CC2)c1[N+](=O)[O-] 312496450 QAUVNBLMQMZYPC-UHFFFAOYSA-N 283.288 -0.547 5 20 CBBD NC(=O)[C@@H](CO)Nc1ncc([N+](=O)[O-])cc1Cl 343270769 OYZPUANEENRQLD-ZCFIWIBFSA-N 260.637 -0.099 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(CCO)CC1CC1 344975441 PYNREPABFLOSBK-UHFFFAOYSA-N 295.295 -0.013 5 20 CBBD COc1n[nH]c(NC(=O)c2cc([N+](=O)[O-])n[nH]2)n1 354577179 YUXXXDZOVMCBQQ-UHFFFAOYSA-N 253.178 -0.303 5 20 CBBD Cc1cnc(N2CCN[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1 361266445 SZPJJEIASVLELM-MRVPVSSYSA-N 265.273 -0.438 5 20 CBBD Cc1nn(C)c(N2C[C@@H](O)C[C@@H](C(=O)O)C2)c1[N+](=O)[O-] 401777515 FIRLXTGQGOJMQX-SFYZADRCSA-N 284.272 -0.091 5 20 CBBD CC[C@@H](NC(=O)c1cc([N+](=O)[O-])cnc1O)C(=O)NC 412411610 QTOXHQHQOOUEEA-MRVPVSSYSA-N 282.256 -0.050 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 567736910 FBQOEGLQZAYYMZ-NXEZZACHSA-N 297.267 -0.714 5 20 CBBD COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 600394621 CXXVYOJKRSZSGO-UHFFFAOYSA-N 272.217 -0.763 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1nnnn1C1CC1 610303399 JBFNDSNMUCWAEU-UHFFFAOYSA-N 292.259 -0.571 5 20 CBBD C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CN(C)CCO1 619789087 FMBPRKUXCCVOBW-APPZFPTMSA-N 283.288 -0.233 5 20 CBBD CCn1cc(S(=O)(=O)N(C)OC)c([N+](=O)[O-])n1 758430121 WEEHBEIPUQAHSJ-UHFFFAOYSA-N 264.263 -0.007 5 20 CBBD CN(CCO)c1nccc(-c2nn[nH]n2)c1[N+](=O)[O-] 821602526 HEWQZGVKHJXNKX-UHFFFAOYSA-N 265.233 -0.402 5 20 CBBD NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839578026 JJLODINVFROEIT-OUAUKWLOSA-N 277.280 -0.136 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@@H](CN)C2)c1[N+](=O)[O-] 1118207372 LDOMUIFDRYFIBE-QMMMGPOBSA-N 283.288 -0.564 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N[C@]1(C)CCNC1 1118512152 IGIGJIVVIHDNDQ-SNVBAGLBSA-N 253.262 -0.190 5 20 CBBD CCNC(=O)CCOC(=O)Cn1cnc([N+](=O)[O-])n1 1518341597 OKSIHHAHAMUOBO-UHFFFAOYSA-N 271.233 -0.744 5 20 CBBD O=C(N[C@H]1CNOC1)c1cc([N+](=O)[O-])ccc1O 1580754617 ZKUQHGYTHOXOJZ-LURJTMIESA-N 253.214 -0.066 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1cc(O)cc([N+](=O)[O-])c1 1610682772 BMEXVBDSEYVLGT-MRVPVSSYSA-N 270.197 -0.524 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1ccccc1[N+](=O)[O-] 217687966 PHJBIDWDHGVXIN-SECBINFHSA-N 268.225 -0.142 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@](C)(O)C(=O)O 262341696 CRLGZMXLTHPUMP-LLVKDONJSA-N 283.240 -0.136 5 20 CBBD CCN(CCCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 266604370 XXUVZKYQRSAQRE-NSHDSACASA-N 272.305 -0.144 5 20 CBBD COC(=O)C[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 270605636 MVDLPIHQDVKVEC-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD Cc1[nH]nc(C(=O)N(C[C@@H](C)O)[C@H](C)CO)c1[N+](=O)[O-] 275963797 HTCZLEXGIKBJGR-RNFRBKRXSA-N 286.288 -0.170 5 20 CBBD C[C@@H](CS(C)(=O)=O)NC(=O)c1cc([N+](=O)[O-])[nH]n1 285562628 RRAHKXDRAKAECH-YFKPBYRVSA-N 276.274 -0.519 5 20 CBBD C[C@H]1NC(=O)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])nn1C 337797507 XDNALHFKPRHDLB-RNFRBKRXSA-N 281.272 -0.275 5 20 CBBD CCNC(=O)[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 343095852 LACNXXYISGLGSM-YFKPBYRVSA-N 255.234 -0.428 5 20 CBBD CN(C)C(=O)NCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 357454293 KRUHBSHQYLPTEY-UHFFFAOYSA-N 296.287 -0.228 5 20 CBBD Cn1cnc(=O)n1C[C@@H](O)COc1ccccc1[N+](=O)[O-] 414155271 MVGGUXBYWHGSQM-SECBINFHSA-N 294.267 -0.070 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCNC1 428651110 KLXICASIIVJLRB-QMMMGPOBSA-N 253.262 -0.422 5 20 CBBD CCN1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 452999729 UXZHVAAPIISJCL-SECBINFHSA-N 295.299 -0.082 5 20 CBBD CCc1[nH]nc(C(=O)N2CC(=O)N(C)C(=O)C2)c1[N+](=O)[O-] 563401473 SPFIIXORTNQXOX-UHFFFAOYSA-N 295.255 -0.679 5 20 CBBD NC(=O)[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1 578521158 NBKPCFJHBGUMOV-LBPRGKRZSA-N 295.251 -0.325 5 20 CBBD Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(N3CC(O)C3)cc21 587803166 XNPMXPDOQIUZQO-UHFFFAOYSA-N 278.268 -0.034 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 594335042 JIXOAEQXNVYOAG-SSDOTTSWSA-N 298.255 -0.774 5 20 CBBD NC(=O)[C@H](O)CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 619255421 XZZNCEFBEOHIOL-SNVBAGLBSA-N 292.251 -0.348 5 20 CBBD COC(=O)[C@@]1(F)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 839696320 QJBSXWDVWPWMKD-BRDIYROLSA-N 260.221 -0.235 5 20 CBBD CCCOCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1124483831 PPVNWONYFNATNC-UHFFFAOYSA-N 299.331 -0.039 5 20 CBBD COC[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)OC 1320808002 NJFROEVVYMMQFX-SSDOTTSWSA-N 272.261 -0.281 5 20 CBBD Cc1noc(CS(=O)(=O)c2ncnn2C)c1[N+](=O)[O-] 1330609183 QSMBNCXEJLCZJI-UHFFFAOYSA-N 287.257 -0.006 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H](CO)[C@@H]1CCOC1 1339740059 CNJMCQQBMWBTBW-NXEZZACHSA-N 298.299 -0.448 5 20 CBBD NCC[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(F)(F)F 1348945075 VFJPEUIEMGIYPK-YFKPBYRVSA-N 296.209 -0.418 5 20 CBBD COC(=O)C(=O)[C@H](C)n1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1591226053 KDQXFLNMPZSZKL-BYPYZUCNSA-N 295.215 -0.726 5 20 CBBD COc1cccc(C(=O)N[C@H](CO)C(=O)O)c1[N+](=O)[O-] 1599641739 XMTGCVWETQXAPF-SSDOTTSWSA-N 284.224 -0.221 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCCC(=O)C(=O)O 1610678347 UOCTZZXGBAHIKA-UHFFFAOYSA-N 285.212 -0.232 5 20 CBBD COc1cc(OCC(=O)N(C)CC(N)=O)ccc1[N+](=O)[O-] 68860434 FNHDRZAGJJTWNP-UHFFFAOYSA-N 297.267 -0.074 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCO1 112669689 OGBIEJGGVUEBMS-SECBINFHSA-N 283.240 -0.063 5 20 CBBD COC[C@@](C)(NCCn1cc([N+](=O)[O-])cn1)C(=O)OC 182599760 LBWLFMMKRKOWIB-LLVKDONJSA-N 286.288 -0.041 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCCCCCO)c1 229127383 GFKRVKWEXIHORN-NSHDSACASA-N 272.305 -0.096 5 20 CBBD CCc1nn(C)c(N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 234174491 MXHFMYDVGHSKPC-YUMQZZPRSA-N 256.262 -0.568 5 20 CBBD NC(=O)[C@@H]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)O1 268543787 SIDBWJSEHKAXLD-BQBZGAKWSA-N 283.240 -0.050 5 20 CBBD C[C@@H]1CC(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)=NO1 270855310 RQGJZTWIWIJUMF-SSDOTTSWSA-N 280.240 -0.005 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])[nH]1)NC1CC1 298860871 GOTNBDGRFYWAGC-UHFFFAOYSA-N 252.230 -0.069 5 20 CBBD NC(=O)[C@@H](CO)Nc1ncnc2sc([N+](=O)[O-])cc12 343296291 YLQWGCFGVLGPDV-RXMQYKEDSA-N 283.269 -0.142 5 20 CBBD CN(CCC(N)=O)C(=O)Cn1ccc([N+](=O)[O-])n1 343497228 KSOLNBMTXWUJEI-UHFFFAOYSA-N 255.234 -0.875 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H](CO)[C@H]1CCCO1 344854766 JZWXOZUZRSMUOG-VHSXEESVSA-N 284.272 -0.553 5 20 CBBD CNC(=O)[C@H]1CCC[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-] 346343193 FLEAEYCWBSXPRW-BQBZGAKWSA-N 281.272 -0.038 5 20 CBBD CC[C@@H]1C(=O)NCCN1C(=O)c1c([N+](=O)[O-])cnn1C 347221577 CTLMVIXNQQPDTK-SSDOTTSWSA-N 281.272 -0.321 5 20 CBBD CN(C)C(=O)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 354356856 GSYAMZGYUWVMCG-UHFFFAOYSA-N 266.257 -0.005 5 20 CBBD COC(=O)[C@H]1C[C@@H](OC)CN1c1ncc([N+](=O)[O-])c(N)n1 372787262 WDLYHXNGTGQNEO-RNFRBKRXSA-N 297.271 -0.266 5 20 CBBD O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](O)C[C@@H]1CO 373471973 CBJJWKVBTXHBGQ-BDAKNGLRSA-N 282.252 -0.132 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)N1CCOCC1 574705979 BAGWORXFSOODLJ-ZETCQYMHSA-N 297.271 -0.705 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)c1nccc(N)n1 597719016 DXAMTZOVZUHUQM-ZETCQYMHSA-N 291.271 0.041 5 20 CBBD CS(=O)(=O)NC1CN(c2ccnc(O)c2[N+](=O)[O-])C1 599147599 KSNWRJRVRYJBOF-UHFFFAOYSA-N 288.285 -0.567 5 20 CBBD CNC(=O)CN1CCN(c2cccnc2[N+](=O)[O-])CC1 603840842 ARERTOQVIPROPZ-UHFFFAOYSA-N 279.300 -0.142 5 20 CBBD CN(C[C@@H](O)C1CC1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 610669905 JJVRSUFXUBTUDV-LLVKDONJSA-N 295.295 -0.014 5 20 CBBD Cn1nnnc1CCNC(=O)c1cnc(O)c([N+](=O)[O-])c1 618388765 ADMRVODIOCHFDL-UHFFFAOYSA-N 293.243 -0.809 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1C[C@@H]2C[C@]2(CO)C1 783816888 ZORPWDWROORMQV-TVQRCGJNSA-N 293.279 -0.403 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NN1CCOC1=O 862699302 NYSKDQXBGBSVQS-UHFFFAOYSA-N 255.190 -0.725 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cc[nH]n1 1001008440 VVXITJVBHXIJQZ-PSASIEDQSA-N 293.283 -0.737 5 20 CBBD CCOCC(=O)NCCNCc1c([N+](=O)[O-])ncn1C 1123014319 MPYBYHNULKJAJH-UHFFFAOYSA-N 285.304 -0.429 5 20 CBBD CN(Cc1cnn(C)c1)C(=O)Cn1ncc([N+](=O)[O-])c1N 1328674536 CTMPRZOLDQRGAC-UHFFFAOYSA-N 293.287 -0.234 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)CC[C@@H]1N 1329483115 JIDJDDCNDJNLRG-SFYZADRCSA-N 268.277 -0.618 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 49498143 VVLVABXZYGWOPE-LURJTMIESA-N 283.240 -0.036 5 20 CBBD COC(=O)C[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(=O)O 71337093 PZOKKGILLDTSHQ-LURJTMIESA-N 299.239 -0.321 5 20 CBBD NC(=O)[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CCO1 173350260 HOWBULVLVDOTTN-LLVKDONJSA-N 293.279 -0.150 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@]1(O)CCOC1 229687387 GXDHDINOUPJTML-SNVBAGLBSA-N 270.245 -0.941 5 20 CBBD CN1CCN(C)[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 264760373 OESDHOYVTCPNHJ-SECBINFHSA-N 281.316 -0.102 5 20 CBBD O=C(NCCN1C(=O)CSC1=O)c1cc([N+](=O)[O-])[nH]n1 285116028 PBDSULAWYXZKOC-UHFFFAOYSA-N 299.268 -0.257 5 20 CBBD CC(C)(O)CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1 311953776 ZRBKDLCSFDXIDP-JTQLQIEISA-N 272.305 -0.097 5 20 CBBD CN(C[C@@H]1CCC[C@@H]1O)C(=O)Cn1cnc([N+](=O)[O-])n1 330460487 QXOWMNNTVSUGFX-IUCAKERBSA-N 283.288 -0.194 5 20 CBBD CC(C)[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339644503 WMCNYRVPFQGKKB-ZETCQYMHSA-N 271.233 -0.588 5 20 CBBD NS(=O)(=O)CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O 345454827 FAUZYUPKSSUEEM-UHFFFAOYSA-N 299.264 -0.521 5 20 CBBD O=C1CC[C@H](NC(=O)N=c2cc[nH]cc2[N+](=O)[O-])CN1 359031322 XYUDDPHTQZXJLV-ZETCQYMHSA-N 279.256 -0.188 5 20 CBBD NC(=O)[C@@H]1CCCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 362476695 MFAUVDZCPNHTJX-HTQZYQBOSA-N 296.287 -0.653 5 20 CBBD C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1N 429180355 XRNFMRHYRZHQMX-ONGXEEELSA-N 294.311 -0.048 5 20 CBBD CCOC[C@H](O)CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 444968983 TXOWSXBRLMDYQH-MRVPVSSYSA-N 285.256 -0.177 5 20 CBBD NC(=O)[C@@H]1C[C@@H](F)CN1c1ncc([N+](=O)[O-])cn1 585786416 RDNJHXOXWPJIHD-VDTYLAMSSA-N 255.209 -0.213 5 20 CBBD C[C@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 586787613 JGIIWXCOHDLMGF-LURJTMIESA-N 267.245 -0.332 5 20 CBBD COC[C@H]1C[C@@H](O)CN1C(=O)c1cnc(O)c([N+](=O)[O-])c1 593813096 AGLPMBGVVFBFPB-RKDXNWHRSA-N 297.267 -0.083 5 20 CBBD COC[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])OC 594341712 RPUXFAHZSQGXBA-SSDOTTSWSA-N 284.272 -0.037 5 20 CBBD NC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 702037900 SKCMPGZMTWQMEI-UHFFFAOYSA-N 253.262 -0.259 5 20 CBBD NC(=O)C1=NO[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 793899465 WOOFIBAPRPVSCU-ZCFIWIBFSA-N 281.228 -0.717 5 20 CBBD C[C@H](C[N+](=O)[O-])OC(=O)C(C)(C)NS(C)(=O)=O 814045726 YJKKLRAKWUGXGX-ZCFIWIBFSA-N 268.291 -0.477 5 20 CBBD CNS(=O)(=O)C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839700880 NCVMFVGHGMMYRE-DJLDLDEBSA-N 291.329 -0.808 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 1320216718 XCPJQVHCLYVZQG-RXMQYKEDSA-N 255.234 -0.509 5 20 CBBD CCn1cc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])nn1 1328403305 KSAQXRGLLGLZRV-UHFFFAOYSA-N 265.233 -0.141 5 20 CBBD CN(Cc1cn(C)nn1)C(=O)Cn1ccc([N+](=O)[O-])n1 1329656593 RBGKNDYSNQKPAQ-UHFFFAOYSA-N 279.260 -0.422 5 20 CBBD Cc1[nH]nc(C(=O)N2CC(n3cncn3)C2)c1[N+](=O)[O-] 1338957863 LHEYCMFUWRIHJO-UHFFFAOYSA-N 277.244 -0.085 5 20 CBBD CCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(C(N)=O)n1 1346541449 QKBWBRCBVKKTTC-SSDOTTSWSA-N 271.277 -0.797 5 20 CBBD Cc1cc(C(=O)O)c([N+](=O)[O-])c(N(C)C[C@H](O)CO)n1 1600104203 JLEOYYKCEXINTJ-ZETCQYMHSA-N 285.256 -0.214 5 20 CBBD C[C@H](CNS(=O)(=O)c1ncccc1[N+](=O)[O-])C(=O)O 1603193350 IVTSFUBQURCKFB-ZCFIWIBFSA-N 289.269 -0.011 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H](CF)C(=O)O 1608379713 RTUKCHXTYZFUKW-RXMQYKEDSA-N 260.181 -0.670 5 20 CBBD CCNC(=O)CN(CC)C(=O)Cn1cnc([N+](=O)[O-])n1 49179089 JJSAUMYCJOWPIF-UHFFFAOYSA-N 284.276 -0.829 5 20 CBBD C[C@@H]1C(=O)NCCN1c1ccc(N)c([N+](=O)[O-])n1 310903905 BNNNBCYAYVOMAM-ZCFIWIBFSA-N 251.246 -0.103 5 20 CBBD Cn1c(C(=O)NCCn2cncn2)ccc1[N+](=O)[O-] 337677042 YPNHXJANQLCFHV-UHFFFAOYSA-N 264.245 -0.045 5 20 CBBD COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)OC 347846798 CMVKJURQZIYINI-QMMMGPOBSA-N 285.256 -0.149 5 20 CBBD COC[C@@H](C(N)=O)N(C)C(=O)c1c(N)cccc1[N+](=O)[O-] 354622421 NUNAVVQQDISNAZ-VIFPVBQESA-N 296.283 -0.251 5 20 CBBD CCOC[C@H](O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357498685 CKSFHDZDPNTKRF-SSDOTTSWSA-N 284.272 -0.102 5 20 CBBD NC(=O)NC(=O)CCSc1ncc([N+](=O)[O-])c(N)n1 566498635 LHVSTMFRLVMTMC-UHFFFAOYSA-N 286.273 -0.356 5 20 CBBD CC(=O)NCCN(C)C(=O)NCCn1cc([N+](=O)[O-])cn1 577605734 HEGKGRPYFVBQGQ-UHFFFAOYSA-N 298.303 -0.431 5 20 CBBD CNC[C@@H](C)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 595122808 VMKJRIKZLVOCIV-SSDOTTSWSA-N 274.302 -0.124 5 20 CBBD COC(=O)[C@@](C)(CO)NCc1onc(C)c1[N+](=O)[O-] 595533073 FRLQTACGRWDVDK-SNVBAGLBSA-N 273.245 -0.095 5 20 CBBD N[C@H]1C[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 595955595 GVSCTPUECKWECI-ZKCHVHJHSA-N 253.262 -0.355 5 20 CBBD O=C(CCOc1ccccc1[N+](=O)[O-])N1C[C@H](O)[C@@H](O)C1 600216957 JPUGUBSWYCZDQB-QWRGUYRKSA-N 296.279 -0.072 5 20 CBBD Cn1nnnc1CCNC(=O)N=c1cc[nH]cc1[N+](=O)[O-] 611598470 CQZFTGXVHRRZNH-UHFFFAOYSA-N 292.259 -0.701 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O 773573045 YIICJPOFBGVZCC-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD NC(=O)C[C@@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1 808227278 AMIWNRLXJDIMNV-QMMMGPOBSA-N 253.262 -0.054 5 20 CBBD CN(C)C1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1 825856072 MXIDTJRUNOIIMS-UHFFFAOYSA-N 290.287 -0.080 5 20 CBBD CCn1ncc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 1030292546 OCFAPFBBQYKIMI-GHMZBOCLSA-N 294.315 -0.736 5 20 CBBD C[C@H]1C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C(=O)O1 1326800273 QBOGKYSGDLRLND-UJURSFKZSA-N 254.202 -0.248 5 20 CBBD CN(Cc1cn(C)nn1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 1333616577 PVMKFUDTOQWBNX-NSHDSACASA-N 295.303 -0.587 5 20 CBBD CON(C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)[C@H](C)C(=O)O 1594038575 XICKBWNWJRGLES-SSDOTTSWSA-N 299.239 -0.380 5 20 CBBD O=C(N[C@H](CF)C(=O)O)c1cc([N+](=O)[O-])cnc1O 1608397862 AXXQDJVPTJPYMU-ZCFIWIBFSA-N 273.176 -0.152 5 20 CBBD O=C(O)CC1CC(OC(=O)Cn2cnc([N+](=O)[O-])n2)C1 1608693516 MATDWBQFDQSDDL-UHFFFAOYSA-N 284.228 -0.017 5 20 CBBD CCCNC(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 42650124 CMMSAPGFIJLDER-UHFFFAOYSA-N 282.256 -0.618 5 20 CBBD CC(C)[C@H](O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 157657513 NZBCFHZYFLFZAK-MRVPVSSYSA-N 256.262 -0.076 5 20 CBBD C[C@H](O)CN(CCn1ccc([N+](=O)[O-])n1)[C@@H](C)CO 190816986 QMSURNZKPXZMGW-UWVGGRQHSA-N 272.305 -0.145 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H](O)C(F)(F)F)c1 236537653 NMUANVMADOYGAB-YUMQZZPRSA-N 298.221 -0.335 5 20 CBBD CN1CC[C@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C1=O 265657949 NZHJUXFRBIUGMW-QMMMGPOBSA-N 281.272 -0.520 5 20 CBBD CS(=O)(=O)N1CC(CNc2ncc([N+](=O)[O-])cn2)C1 302450349 SBXPGAIFIOSVQU-UHFFFAOYSA-N 287.301 -0.312 5 20 CBBD C[C@@H](CNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)CN(C)C 312446281 CPBKCHOSOFNBEQ-JQWIXIFHSA-N 285.348 -0.061 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N(CCO)C1CCC1 332045240 YNISSPNIPBIDFS-UHFFFAOYSA-N 269.261 -0.440 5 20 CBBD CCCNC(=O)CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1 339638959 KAWMERLLIIRKBG-UHFFFAOYSA-N 284.276 -0.829 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CC[C@H](CO)O1 349622042 AGOMVLYHPPAHED-DTWKUNHWSA-N 284.272 -0.553 5 20 CBBD COCCOC[C@H](C)NC(=O)Cn1ccc([N+](=O)[O-])n1 358686940 UTENSJLCMVPOCG-VIFPVBQESA-N 286.288 -0.041 5 20 CBBD CC1(C)CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](CO)O1 421950035 YASXGNZGTWUFHL-ZETCQYMHSA-N 284.272 -0.070 5 20 CBBD CN(C)C[C@](C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 572563230 KODWHLKDZYJOEH-GFCCVEGCSA-N 297.315 -0.386 5 20 CBBD Cc1cc(=NCCc2nc(N)n[nH]2)[nH]cc1[N+](=O)[O-] 590567545 NVOSYLXBGIKTOA-UHFFFAOYSA-N 263.261 0.075 5 20 CBBD CS(=O)(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 600350289 YLSALEONZCZBMX-UHFFFAOYSA-N 299.308 -0.032 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])cn1C 600466989 BUMOKMIFGJOQQS-MRVPVSSYSA-N 285.256 -0.413 5 20 CBBD CC(C)(CO)N1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 611516138 VKUQLJHBSMMSLC-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD C[C@@H](NC(=O)c1cnc(O)c([N+](=O)[O-])c1)C(=O)N(C)C 618382206 YNXYCTYANPWXLY-ZCFIWIBFSA-N 282.256 -0.098 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)OCCN1CCNC1=O 729203392 HEVCSIRQAYDDAF-UHFFFAOYSA-N 283.244 -0.640 5 20 CBBD Cc1nn(C)c(C(=O)N2CCO[C@H](C(=O)O)C2)c1[N+](=O)[O-] 738375978 RJZZLVWMDWHNIB-ZETCQYMHSA-N 298.255 -0.438 5 20 CBBD Cc1nn(CN(C)[C@@H]2CCNC2=O)cc1[N+](=O)[O-] 779867690 BZQIWQOXVLSVBR-MRVPVSSYSA-N 253.262 -0.122 5 20 CBBD CC(C)[C@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820049502 YPCLMUGCMOYOSR-NSHDSACASA-N 297.267 -0.018 5 20 CBBD O=C(N[C@H]1C[C@H](NCc2cnon2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1020140087 XQENZXDMOZAJEC-KHUVANEUSA-N 281.272 -0.528 5 20 CBBD O=C(NCCNCCn1cccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936262 DERLPZYHZSINKV-NXEZZACHSA-N 267.289 -0.746 5 20 CBBD Cn1cc([C@H](CO)NC(=O)Cn2cc([N+](=O)[O-])cn2)cn1 1320004094 CUARDTBGKBLFMG-JTQLQIEISA-N 294.271 -0.625 5 20 CBBD Cc1nonc1CNC(=O)c1c([N+](=O)[O-])cnn1C 1352253697 RFYKICHNODOASJ-UHFFFAOYSA-N 266.217 -0.050 5 20 CBBD CO[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@](C)(C(=O)O)C1 1599135655 VRSACDWKQKNKTQ-PRKAOEEVSA-N 272.257 -0.258 5 20 CBBD Cn1cnnc1Cn1cc(C(=O)O)cc([N+](=O)[O-])c1=O 1600996192 QOMFCCBMKOTZFS-UHFFFAOYSA-N 279.212 -0.369 5 20 CBBD O=C(O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cn1 1601911655 WLDLPDLRPGVPNE-SSDOTTSWSA-N 269.213 -0.445 5 20 CBBD C[C@@](O)(CO)CNc1ccc(-c2nn[nH]n2)c([N+](=O)[O-])c1 1603690540 KSQWDXWDENMAQU-NSHDSACASA-N 294.271 -0.070 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@@H]2CCOC2)c1 38094672 PVIODNXTGGEGMR-ONGXEEELSA-N 270.289 -0.222 5 20 CBBD O=C(N[C@H](CO)C(=O)O)c1cc(F)cc([N+](=O)[O-])c1 165092783 DWDMPWZJRDLUGJ-MRVPVSSYSA-N 272.188 -0.091 5 20 CBBD CN(CC(N)=O)S(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 226387909 YCFXYLKGLMVMLB-UHFFFAOYSA-N 291.260 -0.160 5 20 CBBD COC[C@H](CNC(=O)c1cc([N+](=O)[O-])[nH]n1)OC 285496212 AHTLKYYMSBGSLQ-LURJTMIESA-N 258.234 -0.291 5 20 CBBD NC(=O)[C@H](CO)Nc1ncc([N+](=O)[O-])cc1Cl 286391398 OYZPUANEENRQLD-LURJTMIESA-N 260.637 -0.099 5 20 CBBD CN(CC(N)=O)c1ccc(C(N)=O)cc1[N+](=O)[O-] 339001863 ULTFBDJWUMGZGM-UHFFFAOYSA-N 252.230 -0.385 5 20 CBBD CC(C)C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)C(=O)O 339642118 MMPZUAQIXQUJSJ-SSDOTTSWSA-N 285.260 -0.198 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1CCNC1=O 340492835 KUSAKROLOUDBPL-QMMMGPOBSA-N 281.272 -0.553 5 20 CBBD CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 351849375 PQIOMXOVVTUPMN-UHFFFAOYSA-N 269.261 -0.028 5 20 CBBD O=C(N[C@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])n[nH]1 353375627 STZZISMMAHJTCS-AAODDVHNSA-N 258.259 -0.431 5 20 CBBD CN(C)C[C@](C)(O)CNc1nccc(C(N)=O)c1[N+](=O)[O-] 357458082 XLLYEJHATUEVFW-GFCCVEGCSA-N 297.315 -0.187 5 20 CBBD CO[C@@H]1CN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C[C@H]1O 395396694 YZACFPBUEWCVME-RKDXNWHRSA-N 283.240 -0.116 5 20 CBBD N=c1[nH]cncc1CN=c1[nH]cc([N+](=O)[O-])c(=N)[nH]1 427435895 OWJUWWFKBMRXEV-UHFFFAOYSA-N 262.233 -0.966 5 20 CBBD C[C@@H]1OC(=O)N[C@@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 496988705 YSUDCFBOZCSIPK-XPUUQOCRSA-N 284.228 -0.169 5 20 CBBD NC(=O)[C@@]1(NC(=O)c2cccc([N+](=O)[O-])c2)CCOC1 521897630 HDMCKHPOPLASRK-GFCCVEGCSA-N 279.252 -0.031 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCO[C@@H]2C[C@H]21 590437252 WIJQZBLTUGQPKS-RKDXNWHRSA-N 252.230 -0.209 5 20 CBBD O=C(O)C12CC(CN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2 594734189 RQIOVJRCIKCTEU-KRBLXSNTSA-N 296.283 -0.299 5 20 CBBD CN(C)CCN(CCN(C)C)C(=O)c1c[nH]nc1[N+](=O)[O-] 619788186 QDVPWEILDJUZKJ-UHFFFAOYSA-N 298.347 -0.117 5 20 CBBD NC(=O)C(=O)NC/C=C/CNc1ccnc(O)c1[N+](=O)[O-] 1107480453 JYJLRDRQJLVHQQ-OWOJBTEDSA-N 295.255 -0.735 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CCn2ccnc2)c1=O 1319584259 UFJUALIMZDBVIS-UHFFFAOYSA-N 277.240 -0.248 5 20 CBBD CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(=O)O 1606311825 SCRBGXSBWLZEEY-VIFPVBQESA-N 283.240 -0.188 5 20 CBBD O=C(O)[C@@H]1[C@H](O)CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1 1610732870 JHJAYJMSOYYLAR-SVRRBLITSA-N 284.228 -0.632 5 20 CBBD CS(=O)(=O)NCCNc1ncccc1[N+](=O)[O-] 30546854 BKIMYCALHLEEQQ-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1O 229420275 RABDAXXCJMSRKN-JMCQJSRRSA-N 297.267 -0.035 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C[C@@H](CO)O1 229997268 PVWLNXBPDSLTPV-APPZFPTMSA-N 297.267 -0.083 5 20 CBBD CO[C@H]1COC[C@@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 292556528 NNYQCGGZDQFYRV-CBAPKCEASA-N 283.240 -0.161 5 20 CBBD CN1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1 330458336 YXKHWBLIPDHOOI-SECBINFHSA-N 268.273 -0.017 5 20 CBBD CC(C)(C(=O)NCCCC(N)=O)n1cc([N+](=O)[O-])cn1 338663700 SRRASRVUWAICCB-UHFFFAOYSA-N 283.288 -0.092 5 20 CBBD CN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@@H]1CCC[C@@H]1O 341837296 PUUHSDXLVRZEAB-SFYZADRCSA-N 269.261 -0.442 5 20 CBBD NC(=O)NC(=O)CN1CCOc2ccc([N+](=O)[O-])cc2C1 352709341 KOBQKEISLWOICO-UHFFFAOYSA-N 294.267 -0.016 5 20 CBBD NC(=O)NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1 355940479 NEZMCMOOEBRCAF-UHFFFAOYSA-N 280.240 -0.090 5 20 CBBD NC(=O)[C@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1 436640243 HSUYMMQSZUXTQN-LBPRGKRZSA-N 295.251 -0.637 5 20 CBBD CC(=O)N1CC(Nc2ncc([N+](=O)[O-])cc2C(N)=O)C1 563729604 GEUDSHVEVAGQEA-UHFFFAOYSA-N 279.256 -0.269 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2C[C@@H](O)C2)c1 576159932 MDDMCLFZYYKAAL-FKTZTGRPSA-N 256.262 -0.735 5 20 CBBD O=C1C[C@@H](C(=O)NCc2ccccc2[N+](=O)[O-])NC(=O)N1 590424172 RHCOJYADLKWXTJ-QMMMGPOBSA-N 292.251 -0.191 5 20 CBBD O=C(NCCc1ccc([N+](=O)[O-])cc1)C1(O)CNC1 595932766 QERAGDUHECXWHC-UHFFFAOYSA-N 265.269 -0.412 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 600465888 RRXDAWNDGXCPEG-SNVBAGLBSA-N 298.251 -0.046 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC(=O)NC1CCCC1 604503302 ZZWNPSKCXLLLOS-UHFFFAOYSA-N 295.299 -0.034 5 20 CBBD O=C(O)CNC(=O)c1ccc(N2CC(O)C2)c([N+](=O)[O-])c1 739812860 ONTNZLILQHQOIY-UHFFFAOYSA-N 295.251 -0.410 5 20 CBBD O=C(O)[C@@H]1CCCN1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 819240064 GWEMNWRLLBZVFZ-ZJUUUORDSA-N 284.272 -0.299 5 20 CBBD O=C(NC1CN(C(=O)/C=C/C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 991280362 QDOSRUVFYMHZAF-YIZUVKHSSA-N 279.296 -0.055 5 20 CBBD COC[C@@H]1CN(c2nnc(CCC[N+](=O)[O-])n2C)CCO1 1262859801 AVPALYAMXQAAMS-JTQLQIEISA-N 299.331 -0.124 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2ncnn2C)c1 1319112087 FWSKOOOJYIXTBW-UHFFFAOYSA-N 293.239 -0.280 5 20 CBBD COC[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)OC 1320808004 NJFROEVVYMMQFX-ZETCQYMHSA-N 272.261 -0.281 5 20 CBBD Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@H](O)C(N)=O 1328360531 PHQHEUNZBDHCQE-MRVPVSSYSA-N 285.231 -0.382 5 20 CBBD CN1CC[C@@H](N2CCC(NCC[N+](=O)[O-])CC2)C1=O 1346339140 KEWXCYYNZUFWBD-LLVKDONJSA-N 270.333 -0.452 5 20 CBBD CN1CC[C@H](C(=O)OCCn2cnc([N+](=O)[O-])n2)C1=O 1516781239 KNBXZQJVYZFKIN-ZETCQYMHSA-N 283.244 -0.792 5 20 CBBD O=C(N[C@@H]1CCNC[C@H]1F)c1cc([N+](=O)[O-])n[nH]1 1580615223 BUMUCKJDQQTIOD-PHDIDXHHSA-N 257.225 -0.252 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1597399877 PARIHTZXBZWCPQ-LLVKDONJSA-N 298.255 -0.458 5 20 CBBD Cn1cc(CN2C[C@@H](C(=O)O)C[C@@H](O)C2)c([N+](=O)[O-])n1 1608113938 WNOMAJGQQJXCSX-IONNQARKSA-N 284.272 -0.404 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](O)[C@@H]2C(=O)O)n1 1610607366 XCUSVXCSFDNDIK-VXNVDRBHSA-N 298.255 -0.622 5 20 CBBD COc1ccc(S(=O)(=O)NCCN)c([N+](=O)[O-])c1 20562305 ZMVPILTWENSFQX-UHFFFAOYSA-N 275.286 -0.160 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1CCn1ccc([N+](=O)[O-])n1 153386518 SKGPHBLIEQZDKZ-VHSXEESVSA-N 270.289 -0.127 5 20 CBBD NC(=O)N1CCCN(CCn2cc([N+](=O)[O-])cn2)CC1 175157620 BTKUQMUPHZFOEK-UHFFFAOYSA-N 282.304 -0.122 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H](O)C(F)F 230239831 IDCXBZPSRGZJKS-LURJTMIESA-N 264.188 -0.467 5 20 CBBD CCc1[nH]nc(C(=O)NCCn2ncnn2)c1[N+](=O)[O-] 338960649 NEFNJYRLFVCVNU-UHFFFAOYSA-N 280.248 -0.703 5 20 CBBD CN1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C(=O)N1 349690192 FYWBLIUQPCNIOL-ZETCQYMHSA-N 297.246 -0.609 5 20 CBBD CN(CC(N)=O)C(=O)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 351103208 KFLWIBGIESDGBK-UHFFFAOYSA-N 298.230 -0.384 5 20 CBBD COC(=O)[C@@H](C)NS(=O)(=O)c1cccnc1[N+](=O)[O-] 532113289 NLZPYPITWFWZQG-ZCFIWIBFSA-N 289.269 -0.170 5 20 CBBD C[C@H](O)CN1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 555289808 DIIPSWCBGNDUOD-QMMMGPOBSA-N 283.288 -0.544 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)NCC(F)(F)CN 568748155 HDLMSZWGTHDSSM-UHFFFAOYSA-N 263.204 -0.348 5 20 CBBD COC(=O)C[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])n1C 600472783 ZTXWBOQMIYVKGJ-ZETCQYMHSA-N 285.256 -0.413 5 20 CBBD Cn1c(C(=O)OCCCS(N)(=O)=O)ccc1[N+](=O)[O-] 744605796 FPJBYXHEMAVYMI-UHFFFAOYSA-N 291.285 -0.231 5 20 CBBD NC(=O)c1cc(C(=O)OCCn2cnc([N+](=O)[O-])n2)c[nH]1 749079403 BOPCAOGAUVZJHS-UHFFFAOYSA-N 294.227 -0.530 5 20 CBBD CNC(=O)[C@H](O)CNc1nccc(C)c1[N+](=O)[O-] 757693483 QHAMCVVPMXVBGR-SSDOTTSWSA-N 254.246 -0.183 5 20 CBBD C[C@@]1(C(=O)O)CCN(C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 828024252 KHLLJHFWIJTWMN-ZYHUDNBSSA-N 298.299 -0.051 5 20 CBBD CCONC(=O)CNC(=O)c1ccc([N+](=O)[O-])o1 843768394 HGFLVFNDYGMKRN-UHFFFAOYSA-N 257.202 -0.015 5 20 CBBD COC(=O)CN1CCN(c2c([N+](=O)[O-])cnn2C)CC1 891670274 DXJWACSCNVYLSC-UHFFFAOYSA-N 283.288 -0.377 5 20 CBBD O=C(NCC1CN(C(=O)c2cc[nH]n2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001795871 LUSLNXSMIQXJOA-PSASIEDQSA-N 293.283 -0.737 5 20 CBBD O=C(c1cn[nH]c1)N1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1010435983 BZVNXSBVHGDESX-NXEZZACHSA-N 293.283 -0.641 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1CCNC1=O 1320148561 DFRFKZRXWPULBM-MRVPVSSYSA-N 279.256 -0.468 5 20 CBBD CCN(CC[N+](=O)[O-])[C@@H](C)CC(=O)N1CCNCC1 1577728630 IXMXPGFOJZRQGS-NSHDSACASA-N 272.349 -0.205 5 20 CBBD O=C(NCC1(C(=O)O)CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1594744085 HYCJJDJJSXTZRJ-UHFFFAOYSA-N 298.255 -0.071 5 20 CBBD Cc1ccnc(NCC(=O)NCC(=O)O)c1[N+](=O)[O-] 70495536 FHGXNZAPUOEFOH-UHFFFAOYSA-N 268.229 -0.089 5 20 CBBD NC(=O)c1ccc(N2CCO[C@@H](CO)C2)c([N+](=O)[O-])c1 94267320 MKIWTMYHLFHNKR-SECBINFHSA-N 281.268 -0.109 5 20 CBBD CCOC(=O)CN(C)C(=O)c1c([N+](=O)[O-])cnn1C 164477059 KVMHFQITRRWQSO-UHFFFAOYSA-N 270.245 -0.037 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](O)[C@@H](O)C2)n1 234576673 AWWAOLUKAWLMKR-IUCAKERBSA-N 283.240 -0.682 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N[C@]1(CO)CCOC1 330890370 OWULFNGAMGEFRJ-JTQLQIEISA-N 270.245 -0.941 5 20 CBBD CNC(=O)N[C@H]1CCN(c2c([N+](=O)[O-])ncn2C)C1 341544277 JCOXCQWPWOPOBU-ZETCQYMHSA-N 268.277 -0.164 5 20 CBBD CC(C)(C)NC(=O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 343081460 LBHQNPOHFFNKOU-UHFFFAOYSA-N 269.261 -0.038 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN2C(=O)CC[C@@H]2C1 346071333 PHILRNWLHIGIBC-SECBINFHSA-N 293.283 -0.376 5 20 CBBD C[C@H]1CN(C(=O)c2cnc(O)c([N+](=O)[O-])c2)C[C@@H](CO)O1 347554009 MRAFIJJYZGGHGY-CBAPKCEASA-N 297.267 -0.083 5 20 CBBD O=C1NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@H]12 352443982 UXSSZIVIUQRPIW-ZETCQYMHSA-N 293.239 -0.701 5 20 CBBD NCc1ccc(CNC(=O)Cn2cnc([N+](=O)[O-])n2)cc1 565000825 KWTYLLZZGZTITR-UHFFFAOYSA-N 290.283 -0.039 5 20 CBBD CNc1nccc(C(=O)N2CC(C)(O)C2)c1[N+](=O)[O-] 580342878 CTDQXNWTMVGSIB-UHFFFAOYSA-N 266.257 0.238 5 20 CBBD COc1ccc(CN(CCN)C[C@H](O)CO)cc1[N+](=O)[O-] 595901182 CYSJUKYMPLXIKL-NSHDSACASA-N 299.327 -0.283 5 20 CBBD C[C@@H](CCNC(=O)Cn1cnc([N+](=O)[O-])n1)N(C)C 597992945 PUGFYRGFIQTPOB-QMMMGPOBSA-N 270.293 -0.357 5 20 CBBD CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[C@H]2CN3)n1 602587781 IQSPAPGMPSHSQY-YUMQZZPRSA-N 265.273 -0.003 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCN(C)C(=O)C1 615929315 ZRVDWRKHMIFLKB-SECBINFHSA-N 295.299 -0.163 5 20 CBBD CS(=O)(=O)NCCOC(=O)c1ccc([N+](=O)[O-])[nH]1 732502144 MPOMFCNXYXNLJX-UHFFFAOYSA-N 277.258 -0.371 5 20 CBBD O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1F)NCCO 830233014 HFJOFOWUXODRAH-UHFFFAOYSA-N 285.231 -0.428 5 20 CBBD COC(=O)[C@@H]1[C@@H](O)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 840427602 GWISJGMSRKCERT-HXFLIBJXSA-N 272.257 -0.824 5 20 CBBD O=C(O[C@H]1CC(=O)N(C2CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 842329043 RZATUXHNHDQDFG-DJLDLDEBSA-N 254.242 -0.042 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC(N2CCOCC2)CC1 862212704 KCBFVDKUMHJAJJ-VXGBXAGGSA-N 283.328 -0.025 5 20 CBBD CC(C)=CC(=O)N1CC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 991281584 UYEXEMQFPFBNOG-NXEZZACHSA-N 267.285 -0.055 5 20 CBBD O=C(NC[C@H](O)C1CCOCC1)c1n[nH]cc1[N+](=O)[O-] 1116413643 RQSRQQKTCAORRA-VIFPVBQESA-N 284.272 -0.165 5 20 CBBD O=C(NCCNCc1noc(C2CC2)n1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126949389 QHJMKNJQKUJSJL-RKDXNWHRSA-N 295.299 -0.182 5 20 CBBD O=C(NCCCNCCn1cccn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1157767575 QZYZQTVXEHKEPX-GHMZBOCLSA-N 281.316 -0.356 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCS(=O)(=O)C1 1345369404 WRJDHTKPQDLNEY-ZCFIWIBFSA-N 288.285 -0.423 5 20 CBBD COC(=O)[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 48802493 XELGQAYNKFOWAD-MRVPVSSYSA-N 282.256 -0.187 5 20 CBBD CCOC(=O)[C@H](C)NC(=O)c1n[nH]cc1[N+](=O)[O-] 138162514 NNIHJBCDURREIJ-YFKPBYRVSA-N 256.218 -0.001 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCC1(CO)CC1 167697239 CCHMSACJUWKYLZ-UHFFFAOYSA-N 254.246 -0.320 5 20 CBBD CC(=O)N1CC(NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 173229166 ZUYYLPCYSJABRX-UHFFFAOYSA-N 281.272 -0.472 5 20 CBBD CN1C[C@@H](NC(=O)c2cnc(O)c([N+](=O)[O-])c2)CC1=O 277715674 MJNXAHRZPYNOFH-ZETCQYMHSA-N 280.240 -0.344 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@]1(O)CCO[C@@H]1C 331320633 BVFRGUCBMIFABZ-PRHODGIISA-N 298.299 -0.244 5 20 CBBD COCCOC1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 331421039 ATROMZQECIRTSC-UHFFFAOYSA-N 284.272 -0.184 5 20 CBBD CCCc1[nH]nc(C(=O)NCC(=O)NC)c1[N+](=O)[O-] 344920297 OWFABIXIUZUWAP-UHFFFAOYSA-N 269.261 -0.254 5 20 CBBD CNC(=O)CCN(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 362091636 WMEFLOXFTSPIRI-UHFFFAOYSA-N 282.256 -0.097 5 20 CBBD CN1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(=O)N1 537577401 VUJQMUXHYWDICF-JTQLQIEISA-N 294.267 -0.565 5 20 CBBD NCC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C(F)F 564995274 LGPBFGJDUDBZKX-ZETCQYMHSA-N 277.231 -0.110 5 20 CBBD Nc1nc(=NC[C@@H]2CCCNC2=O)[nH]cc1[N+](=O)[O-] 591183103 KKYSGHVDYDWBHO-LURJTMIESA-N 266.261 -0.673 5 20 CBBD CCCc1[nH]nc(C(=O)NCc2nn[nH]n2)c1[N+](=O)[O-] 609989141 DQVDRLFUXPGGCE-UHFFFAOYSA-N 280.248 -0.287 5 20 CBBD CN1C(=O)CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1=O 773677946 QXDPDRODDFXASG-UHFFFAOYSA-N 292.251 -0.382 5 20 CBBD C[C@H](COC(=O)c1cn(C)c(=O)nc1O)[N+](=O)[O-] 813108438 FXCQCBCWXSARAF-RXMQYKEDSA-N 257.202 -0.692 5 20 CBBD CON(C)C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1N 817664773 SNPNVDUCMPSLQH-UHFFFAOYSA-N 282.256 -0.073 5 20 CBBD CC[C@@H](C)S(=O)(=O)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 842333351 IIMAVFKMFFNALD-FSDSQADBSA-N 250.276 -0.104 5 20 CBBD C[C@H]1[C@H](C)N(CC[N+](=O)[O-])CCN1CC[N+](=O)[O-] 931074520 XJPFMFMOXDWWPT-UWVGGRQHSA-N 260.294 -0.066 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H](C(N)=O)C1 1322524960 MJTBGENDMMXJMZ-SECBINFHSA-N 295.299 -0.176 5 20 CBBD CCOC(=O)[C@@H](C)NC(=O)c1c[nH]nc1[N+](=O)[O-] 1325235037 ZSDZSIGBQADDIG-RXMQYKEDSA-N 256.218 -0.001 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCC[C@@H]1CCNC1 1329484770 VYNPYODOJPPIGZ-QMMMGPOBSA-N 268.277 -0.698 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)c1cc([N+](=O)[O-])n[nH]1 1345391133 OZJKNXZSYVYPKF-UHFFFAOYSA-N 276.274 -0.566 5 20 CBBD CC1CC(NC(=O)C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1346522045 HQTUSZHECVHPSH-UHFFFAOYSA-N 295.299 -0.178 5 20 CBBD COC[C@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])C(=O)O 1599176215 ZDVRNMZMYDQSDV-YFKPBYRVSA-N 272.217 -0.842 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@H]1C[C@@H](C(=O)O)C1 1605729725 FAIRVWIJFRFGKD-OLQVQODUSA-N 269.217 -0.834 5 20 CBBD O=C(O)[C@H]1C[C@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 1608601521 KPMHAEBWDQEOPT-IUCAKERBSA-N 284.272 -0.441 5 20 CBBD CC[C@@H]1COCCN1C(=O)Cn1cnc([N+](=O)[O-])n1 115310606 ILPIKDGSLYNLFG-MRVPVSSYSA-N 269.261 -0.176 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCNC1CC1 151492499 LWBIIIUAWZSSQU-UHFFFAOYSA-N 253.262 -0.341 5 20 CBBD COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](O)CO)n1 234551820 PSFQNOSGYOYBLI-ZCFIWIBFSA-N 271.229 -0.459 5 20 CBBD CC(C)(C(=O)N[C@H](CO)C(N)=O)c1ccc([N+](=O)[O-])cc1 341727627 IKZPBLMIPVJNEN-SNVBAGLBSA-N 295.295 -0.165 5 20 CBBD NC(=O)[C@H]1CCCC[C@@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 362476698 MFAUVDZCPNHTJX-YUMQZZPRSA-N 296.287 -0.653 5 20 CBBD C[C@H]1CNCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 432514614 MXDZAUNEORSXCK-IUCAKERBSA-N 267.289 -0.095 5 20 CBBD Nc1nc(N[C@@H](CO)[C@H]2CCCO2)ncc1[N+](=O)[O-] 447811226 NAJZZKHBUIIWFH-POYBYMJQSA-N 269.261 -0.081 5 20 CBBD CCc1nc(NC(=O)Cn2cnc([N+](=O)[O-])n2)n[nH]1 479075029 AGGXVIMTUNMCKQ-UHFFFAOYSA-N 266.221 -0.495 5 20 CBBD C[C@@H](O)C(=O)N1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 590583492 YEKCGJWBIGPUSP-MRVPVSSYSA-N 295.299 -0.399 5 20 CBBD COC[C@H](OC)C(=O)NCCn1cc([N+](=O)[O-])cn1 597411395 XJTVVLMXFQZLFB-VIFPVBQESA-N 272.261 -0.431 5 20 CBBD NC(=O)CN1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 728869711 XSNOVLLMALEKKZ-UHFFFAOYSA-N 296.283 -0.179 5 20 CBBD COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)C(N)=O 760044324 YONJUAWCQYQKBP-ZCFIWIBFSA-N 270.245 -0.837 5 20 CBBD CN1C(=O)C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1=O 773658031 KYHDGVPPMGWMMJ-MRVPVSSYSA-N 292.251 -0.336 5 20 CBBD O=C(O)CN(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 833247720 VIQPVGUNLCNFEL-SNVBAGLBSA-N 284.272 -0.299 5 20 CBBD O=C1C[C@H]2CC[C@@H](CN1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 863293589 UPDDWILYCYJMDV-BZNPZCIMSA-N 253.258 -0.469 5 20 CBBD O=C(NCC1CN(C(=O)C2(CF)CC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1001809851 INJGLZCJAUDOCL-NXEZZACHSA-N 299.302 -0.024 5 20 CBBD C[C@@H]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C(=O)O1 1261246003 XPMVHTBAQYLOEI-RFZPGFLSSA-N 254.202 -0.248 5 20 CBBD CN(C)CC1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 1261744169 WYQCKQXCUWDILU-UHFFFAOYSA-N 267.289 -0.189 5 20 CBBD COCCN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319998355 ORNZTWSPVKDXJO-UHFFFAOYSA-N 269.257 -0.139 5 20 CBBD NC(=O)c1ccnc(N2CCN3CC[C@H]2C3)c1[N+](=O)[O-] 1328719589 WVQZFTFUESURRC-QMMMGPOBSA-N 277.284 -0.017 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCc1ncccn1 1332383658 IQAMHAUGIGTJLK-UHFFFAOYSA-N 262.229 -0.102 5 20 CBBD COc1ccc(C(=O)N2CC(O)(C(=O)O)C2)cc1[N+](=O)[O-] 1599480249 RDMVUAZCAMVFRQ-UHFFFAOYSA-N 296.235 -0.125 5 20 CBBD O=C(O)c1cc([N+](=O)[O-])c(=O)n(Cc2nc[nH]n2)c1 1602300064 ZVZMBFSWLREMIG-UHFFFAOYSA-N 265.185 -0.379 5 20 CBBD CNC(=O)CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N 56228411 VWZRUPFOXCSFEK-UHFFFAOYSA-N 270.220 -0.208 5 20 CBBD O=C(NCCCO)NCCn1cc([N+](=O)[O-])cn1 162039442 AYKYNVPZARDLHL-UHFFFAOYSA-N 257.250 -0.527 5 20 CBBD COC[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 172621344 LAPZDTACOPRGLD-SNVBAGLBSA-N 284.272 -0.335 5 20 CBBD CN[C@@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C1 269144529 XUUFSDNKWQEYID-MRVPVSSYSA-N 253.262 -0.388 5 20 CBBD Cc1nc(NCCCN2CCNC(=O)C2)ncc1[N+](=O)[O-] 297340540 AXZHZJVHGYTGLY-UHFFFAOYSA-N 294.315 -0.073 5 20 CBBD C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])N1CCOCC1 330542467 IUGGQZAAXDYWRJ-VIFPVBQESA-N 297.315 -0.221 5 20 CBBD O=C1NC[C@@H]2[C@H]1CCCN2C(=O)c1cc([N+](=O)[O-])n[nH]1 343306024 XDGKWHVNDGYGOR-HTRCEHHLSA-N 279.256 -0.332 5 20 CBBD CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1COC[C@@H]1O 352794940 BMXMJGBYFJMYQJ-RYUDHWBXSA-N 295.295 -0.115 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1N1CC(n2ccnn2)C1 354820273 FIDPQWACMKPIIZ-UHFFFAOYSA-N 289.255 -0.259 5 20 CBBD NC(=O)c1ccnc(NCCCCO)c1[N+](=O)[O-] 357685412 AUSASWJGWMRZBX-UHFFFAOYSA-N 254.246 0.273 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1 360590332 CMQLHUFMFNYWRR-QMMMGPOBSA-N 298.251 -0.046 5 20 CBBD NC[C@@H]1CCC[C@H]1NC(=O)Cn1cnc([N+](=O)[O-])n1 429184483 BQCIJSPHEHAHPP-JGVFFNPUSA-N 268.277 -0.570 5 20 CBBD NC(=O)c1ccc(C(=O)NCCn2cc([N+](=O)[O-])cn2)o1 437340838 AXSLXPOPCJKBHV-UHFFFAOYSA-N 293.239 -0.087 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCCc1nc(=O)o[nH]1 447637799 WWUIONAKDUOYFB-UHFFFAOYSA-N 293.239 -0.053 5 20 CBBD CCOC(=O)[C@](C)(O)CNC(=O)c1c[nH]nc1[N+](=O)[O-] 549726005 NDBFMZIHQPLLBG-SNVBAGLBSA-N 286.244 -0.638 5 20 CBBD Cc1cc(=O)n(CC(=O)NCC(=O)O)cc1[N+](=O)[O-] 564983605 AWNIPNAAEUJBBU-UHFFFAOYSA-N 269.213 -0.734 5 20 CBBD CO[C@@H]1COC[C@H]1NC(=O)Cn1cc([N+](=O)[O-])nc1C 566260523 MZZLBCQSFIWLTC-RKDXNWHRSA-N 284.272 -0.370 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)N[C@@H]1CCNC1 592365773 CPAZHEYSVFXBEJ-SSDOTTSWSA-N 272.286 -0.370 5 20 CBBD NCCN(CCc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CO 595903635 ZCVPNMBVGQAMLK-CYBMUJFWSA-N 283.328 -0.249 5 20 CBBD C[C@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@]1(C)CO 598447093 HBFDLBBVTYEXCO-KWQFWETISA-N 283.288 -0.337 5 20 CBBD O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H](O)C[C@H]1CO 698151367 NMTAHEWRMCYENV-BQBZGAKWSA-N 256.214 -0.245 5 20 CBBD CCN(CCn1cc([N+](=O)[O-])ccc1=O)CC(=O)NC 761656626 KOSBJZWPHKULME-UHFFFAOYSA-N 282.300 -0.176 5 20 CBBD CCN(CCS(C)(=O)=O)C(=O)c1n[nH]cc1[N+](=O)[O-] 765163594 AYFZHIVUAPEWDS-UHFFFAOYSA-N 290.301 -0.175 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O 776247753 ZFMHWKQONKYFMW-UHFFFAOYSA-N 294.223 -0.161 5 20 CBBD Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CNCCO1 818011691 LXBWOCPYKAKGFQ-VIFPVBQESA-N 280.284 -0.105 5 20 CBBD CNC(=O)C1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCCC1 840309543 KRBLMEAJQVKRJM-HTQZYQBOSA-N 255.274 -0.173 5 20 CBBD Cc1nn(CC(=O)OCCC[N+](=O)[O-])c(=O)n1C 860922416 QKOZVPZNHXIYNW-UHFFFAOYSA-N 258.234 -0.900 5 20 CBBD CCOC(=O)COC(=O)Cn1cc([N+](=O)[O-])cn1 913303081 OWLRHJHJQAQLDK-UHFFFAOYSA-N 257.202 -0.102 5 20 CBBD Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](O)C[C@H]1CO 1116948948 DCKZQPZMRVABCE-BQBZGAKWSA-N 299.258 -0.116 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1cnnn1C 1121181918 COLNEJWBAROCSR-UHFFFAOYSA-N 293.287 -0.065 5 20 CBBD O=C(NCCNCc1cnsn1)[C@@H]1C[C@H]1[N+](=O)[O-] 1126936273 DQDJFSMBOLYSKD-HTQZYQBOSA-N 271.302 -0.591 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)OC[C@@H]1CCOC1 1317959913 YKAGCKJZTXNRRJ-SSDOTTSWSA-N 256.218 -0.234 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H](CO)OC[C@@H]2C)c1[N+](=O)[O-] 1319815668 KNTJARKUIMLKOX-CBAPKCEASA-N 298.299 -0.141 5 20 CBBD Cc1[nH]nc(C(=O)N[C@H]2CNC(=O)C2)c1[N+](=O)[O-] 1325038303 QKNLPAMHTSOGJQ-RXMQYKEDSA-N 253.218 -0.755 5 20 CBBD O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCNC[C@H]1CO 1580474952 CYFBVZBNIYAJRW-NWDGAFQWSA-N 295.295 -0.579 5 20 CBBD O=C(O)Cn1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1606348835 SRICJMMKUXKBES-PHDIDXHHSA-N 254.202 -0.429 5 20 CBBD Nc1ncc(C(=O)N2CC[C@H]2C(=O)O)cc1[N+](=O)[O-] 1608276905 PRZDKPYNYFAWRJ-LURJTMIESA-N 266.213 -0.129 5 20 CBBD CCOC(=O)CCNC(=O)Cn1ccc([N+](=O)[O-])n1 49277686 MDQCTBGHNJVGOS-UHFFFAOYSA-N 270.245 -0.139 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N1CCNCC1 57878212 RHMOEKAAPPYCTH-UHFFFAOYSA-N 266.257 -0.812 5 20 CBBD O=C(Cn1nccc1[N+](=O)[O-])N[C@H]1CCSC1=O 89684866 OYSFKXILNPCONP-LURJTMIESA-N 270.270 -0.060 5 20 CBBD CN(CC(N)=O)C(=O)c1cccc([N+](=O)[O-])c1O 225797134 KWUHXBZOFPSKJR-UHFFFAOYSA-N 253.214 -0.142 5 20 CBBD CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H](O)[C@H](O)C1 234206401 IMKVXFOLOFCULS-HTQZYQBOSA-N 256.262 -0.339 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 263764262 ZJUUYGOSNVOPFQ-MRVPVSSYSA-N 283.240 -0.559 5 20 CBBD C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 276589093 KGUNEVQMAZJSPD-DTWKUNHWSA-N 297.315 -0.155 5 20 CBBD Nc1ccc(N2C[C@@H](O)[C@@H](CO)C2)nc1[N+](=O)[O-] 316220120 AWHBWIIXPMIDDZ-HTRCEHHLSA-N 254.246 -0.639 5 20 CBBD C[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)NCCF 336989665 KJTMNXCBDJWSDW-ZETCQYMHSA-N 287.251 -0.618 5 20 CBBD CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 344185658 QUUFANNQVPVDQP-HTQZYQBOSA-N 298.303 -0.394 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H](CO)[C@@H]1CCCO1 344854767 JZWXOZUZRSMUOG-ZJUUUORDSA-N 284.272 -0.553 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])nn1C)c1nc[nH]n1 360686695 ZKGFTYHCLGDRQG-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD COc1ccnc(CNC(=O)Cn2ccc([N+](=O)[O-])n2)n1 424937561 OMJQUNQXCMXDCR-UHFFFAOYSA-N 292.255 -0.094 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCc3nc[nH]c3C2)c1 590601337 SSCZECCHRRCAIS-JTQLQIEISA-N 292.299 -0.066 5 20 CBBD NC(=O)c1ccnc(NCCCC(=O)O)c1[N+](=O)[O-] 592421972 YTXYMNWOSXXXJN-UHFFFAOYSA-N 268.229 0.365 5 20 CBBD CCn1cc(S(=O)(=O)NC/C=C\CO)c([N+](=O)[O-])n1 594819362 JARWKDYYJDFDCY-ARJAWSKDSA-N 290.301 -0.362 5 20 CBBD NC(=O)C1(NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCCC1 746472902 REGTZGHGEUBILT-JTQLQIEISA-N 297.315 -0.460 5 20 CBBD CNC(=O)[C@H](O)CNc1cc(N)c([N+](=O)[O-])c(CO)c1 808047585 QCIZGCPGHXFPNO-SECBINFHSA-N 284.272 -0.812 5 20 CBBD Cc1noc(COC(=O)[C@@H]2CC[C@H](C(N)=O)O2)c1[N+](=O)[O-] 860412414 CRKUZEZSXHWBGH-RQJHMYQMSA-N 299.239 -0.033 5 20 CBBD CNCCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 923377027 FBIWYWSWTRBEQA-NSHDSACASA-N 271.321 -0.307 5 20 CBBD C[C@@]12CN(CCO)C[C@]1(C)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 982278875 USONYCHUGHLZME-OXHZDVMGSA-N 297.355 -0.186 5 20 CBBD Cc1nonc1CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1020138918 IAVLKOIYBNTMGM-TURQNECASA-N 295.299 -0.220 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CC=CC1 1116186180 OOIGCXCPUABTOP-UHFFFAOYSA-N 265.273 -0.221 5 20 CBBD CN(C)c1noc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126932306 RJEMHPVKRDJPEZ-HTQZYQBOSA-N 298.303 -0.993 5 20 CBBD CC(=O)N1CC[C@@H](NC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1261773134 UALLZNZJFXKREK-ZYHUDNBSSA-N 297.315 -0.637 5 20 CBBD CN(CCNS(C)(=O)=O)Cn1nccc1[N+](=O)[O-] 1318788544 ZPGPFHAIQMUGAC-UHFFFAOYSA-N 277.306 -0.770 5 20 CBBD CC(C)n1[nH]cnc1=NC(=O)Cn1cnc([N+](=O)[O-])n1 1328066415 UZXJXELKSIMJKV-UHFFFAOYSA-N 280.248 -0.581 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1[C@H]2CC[C@H]1CC(=O)NC2 1348382924 DJEGRZNOVWPPKH-YUMQZZPRSA-N 293.283 -0.179 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@H]2COCO2)c1[N+](=O)[O-] 1351593799 YAKHIDKEXMWQLR-ZETCQYMHSA-N 270.245 -0.261 5 20 CBBD O=C(N[C@H]1C[C@@H](C(=O)O)C1)c1cc([N+](=O)[O-])n[nH]1 1594794757 VBCRUZGCXNVPJE-SYDPRGILSA-N 254.202 -0.089 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1CC[C@@](O)(C(=O)O)C1 1609029339 YYCGONCKECMITH-LBPRGKRZSA-N 296.235 -0.038 5 20 CBBD NC(=O)NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 3598547 SBPUJNZPMXXHCL-UHFFFAOYSA-N 292.207 -0.614 5 20 CBBD C[C@H](NC(=O)CNC(=O)CN)c1cccc([N+](=O)[O-])c1 37766598 MRLPAEPQMPEZRP-QMMMGPOBSA-N 280.284 -0.153 5 20 CBBD O=C(NCCc1ccccc1[N+](=O)[O-])NC(CO)CO 74764376 ZHMNMMWJZVIUPB-UHFFFAOYSA-N 283.284 -0.210 5 20 CBBD CN1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@H](CN)C1 122584363 JHMFFUWMRHHEBO-MRVPVSSYSA-N 268.273 -0.097 5 20 CBBD CN(C)C1CN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)C1 134894327 NCIXWQNNKCKKFW-UHFFFAOYSA-N 280.284 -0.471 5 20 CBBD CN(C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O)C1CC1 138238232 ZOEJROOHVLJWJN-UHFFFAOYSA-N 294.267 -0.524 5 20 CBBD COCCN1CC(=O)N(CCn2cc([N+](=O)[O-])cn2)C1=O 272173081 OEVVTIMHJVNLFP-UHFFFAOYSA-N 297.271 -0.298 5 20 CBBD C[C@@H](O)CN1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 275420472 IQMHPWZGQDBZFJ-SNVBAGLBSA-N 297.315 -0.684 5 20 CBBD CN(CCOCCO)C(=O)Cn1cc([N+](=O)[O-])ccc1=O 282082686 FWCCNAXGUZTRSR-UHFFFAOYSA-N 299.283 -0.776 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1cc([N+](=O)[O-])[nH]n1 285829518 SEKWEWVUDVJALM-SECBINFHSA-N 256.218 -0.801 5 20 CBBD CCNC(=O)C1CN(C(=O)c2c([N+](=O)[O-])cnn2C)C1 331481046 HYCBSRKXOGQSJC-UHFFFAOYSA-N 281.272 -0.464 5 20 CBBD COC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N 351750569 YKQRBKZXIUTSAK-YFKPBYRVSA-N 268.229 -0.137 5 20 CBBD COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[C@@H](O)CN1 358803704 SUQBVWKZFYILGX-MNOVXSKESA-N 295.295 -0.058 5 20 CBBD CN1CCC[C@H](NC[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1=O 519596162 KIBXWNZSBZUUKB-QWRGUYRKSA-N 297.315 -0.637 5 20 CBBD COCC[C@H](CO)NC(=O)c1ccnc(N)c1[N+](=O)[O-] 563400471 LPYLKYCNMBVNNC-SSDOTTSWSA-N 284.272 -0.301 5 20 CBBD CC(C)(C(=O)NC[C@H](O)C(=O)O)n1cc([N+](=O)[O-])cn1 833411579 JJLJXVUCUOMOLT-ZETCQYMHSA-N 286.244 -0.912 5 20 CBBD COCCN(CC[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 930108947 XETGJOOTSPPSNF-VIFPVBQESA-N 266.319 -0.601 5 20 CBBD Cc1nnc(CN2CC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)o1 1030292410 HCEHHTFUQUHJFF-RKDXNWHRSA-N 281.272 -0.656 5 20 CBBD CC(=O)N(CCO)CCNc1ccnc(O)c1[N+](=O)[O-] 1111422950 FLLAHGUFSJOCSI-UHFFFAOYSA-N 284.272 -0.052 5 20 CBBD Cn1c(-c2n[nH]cc2[N+](=O)[O-])nnc1N1CCOCC1 1122946407 KNSYRKVENQZPJP-UHFFFAOYSA-N 279.260 -0.050 5 20 CBBD C[C@@H]1CO[C@@H](CO)CN1C(=O)c1c([N+](=O)[O-])cnn1C 1324732357 MFOHLCITCPTEPL-HTQZYQBOSA-N 284.272 -0.450 5 20 CBBD C[C@@H](c1nnc(N2CC[C@H](C(N)=O)C2)n1C)[N+](=O)[O-] 1343360999 SMDKQYJYQKTLGN-BQBZGAKWSA-N 268.277 -0.536 5 20 CBBD O=C(NC[C@H](C(=O)O)[C@H]1CCOC1)c1cc([N+](=O)[O-])n[nH]1 1601457332 SQHZRUYJARHESI-BQBZGAKWSA-N 298.255 -0.215 5 20 CBBD CN(CCO)c1cc(N)c([N+](=O)[O-])c(-c2nn[nH]n2)c1 1609276247 WZCWCCSPCLBFCD-UHFFFAOYSA-N 279.260 -0.214 5 20 CBBD O=C(NCC(=O)N1CCNCC1)c1ccc([N+](=O)[O-])s1 40507909 DAQGKWYOSMKRKH-UHFFFAOYSA-N 298.324 -0.182 5 20 CBBD C[C@H](C(N)=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1 81078625 YHQOEIBVHILGQY-SECBINFHSA-N 279.300 -0.014 5 20 CBBD CC1(C)C(=O)NCCN1CCn1cc([N+](=O)[O-])ccc1=O 90549473 NKOILTPQGRGMSD-UHFFFAOYSA-N 294.311 -0.033 5 20 CBBD CNC(=O)NC(=O)Cn1cc([N+](=O)[O-])c(C)cc1=O 128471789 DIYVBDMZXJVXAR-UHFFFAOYSA-N 268.229 -0.479 5 20 CBBD C[C@@H]1C(=O)N(C)CCN1CCn1cc([N+](=O)[O-])ccc1=O 186991851 IZLRNPBRRGMSDE-SNVBAGLBSA-N 294.311 -0.081 5 20 CBBD COC(=O)[C@H]1[C@@H](O)CCCN1CCn1ccc([N+](=O)[O-])n1 189565171 CLINGQDELMIGSP-GXSJLCMTSA-N 298.299 -0.210 5 20 CBBD C[C@@H](O)CN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 275473461 BLFMGZPRJLNRCF-SECBINFHSA-N 269.305 -0.169 5 20 CBBD C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)N1CCOCC1 330560710 JNMWSORDYAOPQR-SECBINFHSA-N 297.315 -0.221 5 20 CBBD CCn1cc(S(=O)(=O)N(C)CC(=O)O)c([N+](=O)[O-])n1 340185608 NCEPQMQJMJBBFD-UHFFFAOYSA-N 292.273 -0.484 5 20 CBBD Cn1c(C(=O)N2CCN(C(=O)CO)CC2)ccc1[N+](=O)[O-] 345090482 OQZQDAHJMOEHKE-UHFFFAOYSA-N 296.283 -0.790 5 20 CBBD C[C@H](CO)N(C)c1nccc(C(N)=O)c1[N+](=O)[O-] 357467590 ZHLJBNOKBFADGH-ZCFIWIBFSA-N 254.246 -0.094 5 20 CBBD CCn1cc(S(=O)(=O)N(C)C[C@@H](C)O)c([N+](=O)[O-])n1 360409529 XSTTUWGGAOEIAN-SSDOTTSWSA-N 292.317 -0.188 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2C(=O)NCC[C@@H]2C)c1[N+](=O)[O-] 443040950 WQBHJKIQBRTZGH-FSPLSTOPSA-N 281.272 -0.119 5 20 CBBD CO[C@@H]1COC[C@@H]1NC(=O)c1cnc(O)c([N+](=O)[O-])c1 458360206 NNYQCGGZDQFYRV-IONNQARKSA-N 283.240 -0.161 5 20 CBBD CC(CO)(CO)CNC(=O)c1c(N)cccc1[N+](=O)[O-] 564396282 XDKNVICITRPTMD-UHFFFAOYSA-N 283.284 -0.102 5 20 CBBD NCCNC(=O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 598663134 SXFVOFFUGNBIDD-UHFFFAOYSA-N 281.272 -0.209 5 20 CBBD NC(=O)[C@H]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1 600316777 GEBDRVMFLSOBJX-URHBZAFASA-N 253.218 -0.688 5 20 CBBD COCCOCCOC(=O)Cn1cc([N+](=O)[O-])cn1 729094164 DODTXYCJSFMOFH-UHFFFAOYSA-N 273.245 -0.003 5 20 CBBD Cc1[nH]nc(C(=O)Nn2cnnc2O)c1[N+](=O)[O-] 777768841 UTKJQUSCLZLLPH-UHFFFAOYSA-N 253.178 -0.693 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCOC2(CN(CC3CC3)C2)C1 1053253670 UCDUMABATIPHIP-VXGBXAGGSA-N 295.339 -0.025 5 20 CBBD CNC(=O)[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])nc1C 1253671882 RMRXNMNWFSQJGQ-SSDOTTSWSA-N 283.288 -0.259 5 20 CBBD Cn1c(S)nnc1CCNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319843461 TTWVJMDYQMXLHL-UHFFFAOYSA-N 297.300 -0.292 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCNC1=O 1321242930 GZTMCZNPIMDGQZ-ZCFIWIBFSA-N 253.218 -0.722 5 20 CBBD COCC1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 1350697238 LUVYIMNDAUWCPK-NSHDSACASA-N 270.289 -0.270 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1NCCO 1593469985 AWOGGJLBXASOER-UHFFFAOYSA-N 251.206 -0.426 5 20 CBBD CN(CC(=O)O)c1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 1593723497 APUDOUKBPHWRHJ-UHFFFAOYSA-N 289.269 -0.237 5 20 CBBD C[C@H](O)[C@@H](O)CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1604378857 NYQTZLDMBLLBHC-WKEGUHRASA-N 298.251 -0.236 5 20 CBBD CN(CCNC[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 61996154 XDXLECAZJBEGQN-LBPRGKRZSA-N 283.332 -0.164 5 20 CBBD O=C(O)CN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)C1CC1 262140459 KANFLNAHQRNSTG-UHFFFAOYSA-N 295.251 -0.168 5 20 CBBD Cc1nn(C)c(NCCCN2C(=O)CNC2=O)c1[N+](=O)[O-] 264476210 OVDNYYNLEQHBOT-UHFFFAOYSA-N 296.287 -0.009 5 20 CBBD COC(=O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O 272378865 QWPNWZSTKLGYLG-MRVPVSSYSA-N 284.224 -0.436 5 20 CBBD CCC[C@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 286446020 SZABJTBRISLOMS-ZETCQYMHSA-N 269.261 -0.439 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1CCOC1 339401091 JGOBHYXARKIOJU-VIFPVBQESA-N 281.268 -0.091 5 20 CBBD CN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)C1CNC1 415738705 SOGMEXRPOKWZOI-UHFFFAOYSA-N 278.268 -0.037 5 20 CBBD CNc1nccc(C(=O)N2CC(CC(N)=O)C2)c1[N+](=O)[O-] 563897721 UQOFUTPXVFQPBP-UHFFFAOYSA-N 293.283 -0.021 5 20 CBBD COC(=O)COCCNC(=O)c1c[nH]nc1[N+](=O)[O-] 600395234 GYAPRHJUYJSFLL-UHFFFAOYSA-N 272.217 -0.763 5 20 CBBD NC(=O)CNC(=S)NCCOc1ccc([N+](=O)[O-])cc1 731570965 VMIJFYUFLDLTOV-UHFFFAOYSA-N 298.324 -0.077 5 20 CBBD CC(C)(C(=O)NN1CCCNC1=O)n1cc([N+](=O)[O-])cn1 783599819 CXRAFMQGEVBASY-UHFFFAOYSA-N 296.287 -0.027 5 20 CBBD O=C(Nn1c(O)nnc1O)c1ccccc1[N+](=O)[O-] 816732562 MVQQMKHXBQUCQJ-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD Cc1cc(NCCNC(=O)C(N)=O)ccc1[N+](=O)[O-] 1094079688 WJQVCWCTOCTXTK-UHFFFAOYSA-N 266.257 -0.083 5 20 CBBD CNC(=O)[C@H]1CCC[C@H]1NC(=O)c1c([N+](=O)[O-])cnn1C 1319888544 STKGTKPGEPGECB-JGVFFNPUSA-N 295.299 -0.027 5 20 CBBD O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CNC2 1327625852 FDEFTPOJCQPGPO-UWVGGRQHSA-N 292.295 -0.281 5 20 CBBD NC(=O)N1CC[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1 1339064580 MVTQFTDFUDAOEB-SSDOTTSWSA-N 282.260 -0.940 5 20 CBBD O=C(NCCCN1CCC(O)CC1)c1c[nH]nc1[N+](=O)[O-] 1348509963 BKXQWWGEMZUJKX-UHFFFAOYSA-N 297.315 -0.106 5 20 CBBD O=C(NC[C@@H](O)C1CC1)c1cc([N+](=O)[O-])c[nH]c1=O 71302187 KOAARZXATXAWTP-SECBINFHSA-N 267.241 -0.216 5 20 CBBD CCN(CCO)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 75714358 CZJCPWSKSWAYGE-JTQLQIEISA-N 258.278 -0.534 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CCO1 112669016 UJGCLNMWJPBUDJ-QMMMGPOBSA-N 298.255 -0.808 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)C[C@H](CO)O1 190119549 GPCDSDBSJPYTOJ-MWLCHTKSSA-N 270.289 -0.127 5 20 CBBD O=C(NCCNC(=O)C1CC1)c1cnc(O)c([N+](=O)[O-])c1 274945800 HBIKPEKXRBVZDN-UHFFFAOYSA-N 294.267 -0.049 5 20 CBBD CCn1cc(S(=O)(=O)N[C@H]2CCOC2)c([N+](=O)[O-])n1 339046359 CVSOCUXFZKLJOV-ZETCQYMHSA-N 290.301 -0.122 5 20 CBBD COCCc1noc(Cn2ncc([N+](=O)[O-])c2N)n1 353766223 JZNNAGMUEPRANY-UHFFFAOYSA-N 268.233 -0.006 5 20 CBBD C[C@@]1(C(N)=O)CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 361558172 VAXNRHASEZXPSG-CMPLNLGQSA-N 297.315 -0.651 5 20 CBBD CCc1[nH]nc(C(=O)N2CC[C@H](CO)[C@H](O)C2)c1[N+](=O)[O-] 545988162 KHROUQXRYMUPRE-VXNVDRBHSA-N 298.299 -0.304 5 20 CBBD CNc1nccc(C(=O)N[C@@H]2COC[C@H]2OC)c1[N+](=O)[O-] 581677179 SQTQNSVEXYJSKB-RKDXNWHRSA-N 296.283 0.175 5 20 CBBD COC(=O)[C@H]1CNCCCN1CCn1cc([N+](=O)[O-])cn1 592985021 ZZVDNRKPXPQWIH-LLVKDONJSA-N 297.315 -0.372 5 20 CBBD O=C(O)C[C@@H](CNC(=O)Cn1cnc([N+](=O)[O-])n1)C1CC1 595253689 WACIOSDWZOYXCF-QMMMGPOBSA-N 297.271 -0.197 5 20 CBBD C[C@@]1(NC(=O)Cn2cc([N+](=O)[O-])cn2)CCNC1 595993168 WFWMCXZKSQJOSO-SNVBAGLBSA-N 253.262 -0.341 5 20 CBBD CN(c1ccc(N)c([N+](=O)[O-])n1)[C@@H]1CCNC1=O 596177593 JJHRXWMNIVORNG-SSDOTTSWSA-N 251.246 -0.103 5 20 CBBD CNC(=O)[C@H](O)CNC(=O)c1cccc([N+](=O)[O-])c1 763701001 PPXHWSHFGQJKAP-SECBINFHSA-N 267.241 -0.569 5 20 CBBD COc1cncc(C(=O)OCCn2cnc([N+](=O)[O-])n2)n1 791822862 KIWOPTOESVXXBW-UHFFFAOYSA-N 294.227 -0.158 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1COC(=O)C1 820077892 IURRYTNTSRRQEF-LURJTMIESA-N 254.202 -0.777 5 20 CBBD C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1nccc(N)n1 854761574 IMDHLMNVZQQVFE-RRKCRQDMSA-N 251.246 -0.099 5 20 CBBD NS(=O)(=O)N1CCC(C(=O)OCCC[N+](=O)[O-])CC1 860913221 UPJLNRODEAOCPN-UHFFFAOYSA-N 295.317 -0.888 5 20 CBBD COC(=O)[C@H](CSCC[N+](=O)[O-])NC(C)=O 899885178 IFRPDIMTOZVNFT-ZETCQYMHSA-N 250.276 -0.326 5 20 CBBD C[C@@H]1NC(=O)[C@@H](C)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1C 911805516 AQFWTKGSNGSMMR-XDQCBXAXSA-N 255.274 -0.225 5 20 CBBD CCCc1nc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])no1 1126942751 GPDBZMRSZDYARN-RKDXNWHRSA-N 297.315 -0.107 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@@H]2CCCNC2=O)c1[N+](=O)[O-] 1327204306 BKUWDUAKIMPRNE-QMMMGPOBSA-N 295.299 -0.107 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)C(=O)NC1CCC1 1328308979 OXEZQGUFAZNAFQ-UHFFFAOYSA-N 281.272 -0.424 5 20 CBBD O=[N+]([O-])c1cnc(N2CC[C@@H](CO)[C@H](O)C2)nc1 1343664501 APNFFIOMIIJCIX-IONNQARKSA-N 254.246 -0.436 5 20 CBBD CN(C(=O)c1c[nH]nc1[N+](=O)[O-])C1[C@@H]2CNC[C@@H]12 1578387555 NNOZACOWUCXNOE-PHDIDXHHSA-N 251.246 -0.392 5 20 CBBD C[C@](O)(CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C(=O)O 1589144276 LPAGZPGCRMOZKI-NSHDSACASA-N 284.224 -0.134 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)N2CC(C(=O)O)C2)n1 1594548840 WJIHZCCYCCPIPN-UHFFFAOYSA-N 254.202 -0.515 5 20 CBBD C[C@@H]1C[C@H](C(=O)O)CCN1C(=O)Cn1cnc([N+](=O)[O-])n1 1607445848 IEOIDLDWNVSCGO-HTQZYQBOSA-N 297.271 -0.102 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCN(CCCO)CC1 60127147 GTZCFGZTCZHKPI-UHFFFAOYSA-N 269.305 -0.167 5 20 CBBD C[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](CO)O1 190123173 RFKFYFQKOKKIBQ-ZYHUDNBSSA-N 297.311 -0.162 5 20 CBBD NC(=O)[C@@H]1CCN(c2ncc(C(=O)O)cc2[N+](=O)[O-])C1 300532519 PCTMFYOEZDXHHP-ZCFIWIBFSA-N 280.240 0.000 5 20 CBBD C[C@@H](CN)NC(=O)Cn1cc([N+](=O)[O-])ccc1=O 347667463 FZIAEAULSSYGMN-ZETCQYMHSA-N 254.246 -0.780 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H](N)C1 429008814 NXWLJTOKSKLYFV-QMMMGPOBSA-N 253.262 -0.341 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cccc([N+](=O)[O-])c1O 436536372 PXIQOOIYOCQXIS-LBPRGKRZSA-N 298.251 -0.046 5 20 CBBD C[C@H](CC(N)=O)NC(=O)c1cnc(O)c([N+](=O)[O-])c1 444996596 BSIPMKPBHQHWBS-RXMQYKEDSA-N 268.229 -0.311 5 20 CBBD Nc1nc(=NC[C@@H]2CCCN2CCCO)[nH]cc1[N+](=O)[O-] 450600280 VGTOFNJDQSSTFA-VIFPVBQESA-N 296.331 -0.352 5 20 CBBD O=C(NCCN1C(=O)CCCC1=O)c1c[nH]nc1[N+](=O)[O-] 519749373 GCDURMJHPVWLTG-UHFFFAOYSA-N 295.255 -0.413 5 20 CBBD CC(C)(O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548058045 IWOFWDGLSGYRHT-UHFFFAOYSA-N 254.246 0.073 5 20 CBBD CN(C)C[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 588864651 LLGVIMGWAWKJRB-QMMMGPOBSA-N 282.300 -0.171 5 20 CBBD CCN(C(=O)Cn1cnc([N+](=O)[O-])n1)[C@H](C)C(=O)O 595999951 IVJVTZFACHANEV-ZCFIWIBFSA-N 271.233 -0.492 5 20 CBBD NC(=O)c1ccnc(NCCN2CC[C@H](O)C2)c1[N+](=O)[O-] 599199648 OKHIAWRGIODUPT-QMMMGPOBSA-N 295.299 -0.433 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H](N2CC[C@H](O)C2)C1 599940245 NDZACYUSOMZZIC-IUCAKERBSA-N 295.299 -0.401 5 20 CBBD COC(=O)c1cnc(NCCn2cnnn2)c([N+](=O)[O-])c1 845574611 NECVGLWWZZCHKO-UHFFFAOYSA-N 293.243 -0.125 5 20 CBBD NC(=O)C1=NO[C@H](CNc2ccc(N)c([N+](=O)[O-])n2)C1 853513203 XMWSHXQVUMECIV-YFKPBYRVSA-N 280.244 -0.386 5 20 CBBD CN(CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC(F)F 863809206 VOWZJFYPQZJURC-RNFRBKRXSA-N 251.233 -0.035 5 20 CBBD CC(C)(F)C(=O)NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 990050686 ZCSFRAUIIUARLY-HTQZYQBOSA-N 273.264 -0.273 5 20 CBBD CC1(O)CN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1 1117688806 YCZHPNJCFSYLOK-UHFFFAOYSA-N 252.230 -0.340 5 20 CBBD CN[C@H]1CCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1118085895 MWXYIZINSQNUMU-ZETCQYMHSA-N 254.250 -0.993 5 20 CBBD NC(=O)c1ccnc(N[C@@H]2COC(=O)C2)c1[N+](=O)[O-] 1327712257 XOQATVQZHBATQM-YFKPBYRVSA-N 266.213 -0.184 5 20 CBBD CNC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1 1345813791 XUJVWBBCKCDGEF-SSDOTTSWSA-N 253.262 -0.001 5 20 CBBD CC(C)(CCN)NC(=O)Cn1cnc([N+](=O)[O-])n1 1348942018 DHIPHZLOEDJPHF-UHFFFAOYSA-N 256.266 -0.570 5 20 CBBD CCc1noc(Cn2cc([N+](=O)[O-])c(-c3nn[nH]n3)n2)n1 1590934637 GFAFLASJEUQUSH-UHFFFAOYSA-N 291.231 -0.035 5 20 CBBD CN(CCNC(=O)c1c(N)cccc1[N+](=O)[O-])CC(=O)O 1598492498 NQNKHRMKFNSIQB-UHFFFAOYSA-N 296.283 -0.077 5 20 CBBD CN(CC(N)=O)C(=O)COc1ccccc1[N+](=O)[O-] 46979617 ULQDINSSAYSVPI-UHFFFAOYSA-N 267.241 -0.083 5 20 CBBD NC(=O)CCNC(=O)COc1ccc([N+](=O)[O-])cc1 106940136 UHZNGRZEEUFIGA-UHFFFAOYSA-N 267.241 -0.035 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCC(=O)N(C)C1 134045566 QUOOJBSPNUNXIS-SECBINFHSA-N 295.299 -0.163 5 20 CBBD COCCS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 152830526 USHWAUOZMBXCOW-UHFFFAOYSA-N 278.290 -0.643 5 20 CBBD CC(C)(O)CN1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 153193854 KJPNHKJGIJWGLI-UHFFFAOYSA-N 297.315 -0.153 5 20 CBBD C[C@@H](N)[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCO1 163129289 UNQIJNMDZUKLOD-MWLCHTKSSA-N 297.315 -0.244 5 20 CBBD CNC(=O)CCN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C 170815125 ZSTOXZRPGMWSQS-UHFFFAOYSA-N 283.288 -0.306 5 20 CBBD CCN(CC)C(=O)CNC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 228808327 BHIXNIRFIZSGQZ-LLVKDONJSA-N 299.331 -0.390 5 20 CBBD CN(C[C@H](O)CO)C(=O)COc1ccc([N+](=O)[O-])cc1 271255762 ILIKNIZORFEDCR-JTQLQIEISA-N 284.268 -0.215 5 20 CBBD CN(CC(C)(CO)CO)C(=O)Cn1cc([N+](=O)[O-])cn1 272754279 OUZXCKOSLAMKBQ-UHFFFAOYSA-N 286.288 -0.759 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCCO 281680419 CMVJHZZDBIYVGL-UHFFFAOYSA-N 256.262 -0.059 5 20 CBBD Cc1nn(CCS(=O)(=O)CC(=O)O)c(C)c1[N+](=O)[O-] 311878068 BDRDQMNMHOBPKE-UHFFFAOYSA-N 291.285 -0.092 5 20 CBBD Cn1cnc([N+](=O)[O-])c1N1CCC(O)(CO)CC1 313627268 MULVYEZORGMTTR-UHFFFAOYSA-N 256.262 -0.348 5 20 CBBD NS(=O)(=O)CCCCNC(=O)c1cc([N+](=O)[O-])n[nH]1 355953835 JJOOPVIDHHKOEI-UHFFFAOYSA-N 291.289 -0.884 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CC[C@@H](n2cncn2)C1 372482922 RTPMTQPQQHVSDL-SECBINFHSA-N 291.271 -0.144 5 20 CBBD CNCCNC(=O)CCn1cc([N+](=O)[O-])nc1C 429089702 ZCGQQIVAVUOHNC-UHFFFAOYSA-N 255.278 -0.175 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNC[C@H](CO)C2CC2)c1 565422064 LCMQNVNIFKNXAX-ZYHUDNBSSA-N 284.316 -0.240 5 20 CBBD Nc1nccc(C(=O)N2CCn3ncnc3C2)c1[N+](=O)[O-] 570696140 JPTMALRSAQVBPR-UHFFFAOYSA-N 289.255 -0.181 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCN2CC[C@H]1C2 597709151 WNPSKDNAXUWAIO-QMMMGPOBSA-N 265.273 -0.142 5 20 CBBD O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1C[C@H](O)[C@@H](O)C1 599531641 HTICRBQHTSHOIZ-DLOVCJGASA-N 298.295 -0.628 5 20 CBBD CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1=O 928867070 KNOPHERFFONDJY-HRDYMLBCSA-N 255.274 -0.221 5 20 CBBD NC(=O)C(=O)NC1CN(Cc2ccc([N+](=O)[O-])cc2)C1 1030881777 DJYBDKIZTHSWFF-UHFFFAOYSA-N 278.268 -0.620 5 20 CBBD CN1CCN(CCNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1 1116868619 GGRHKXNLHHAMDV-UHFFFAOYSA-N 282.304 -0.705 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCn1cnnc1 1118767658 HGKYPSUSNREWMI-UHFFFAOYSA-N 265.233 -0.801 5 20 CBBD CCOC(=O)[C@H]1CNCCN1CCn1ccc([N+](=O)[O-])n1 1328490931 ZTILFUKPFFBGOQ-SNVBAGLBSA-N 297.315 -0.372 5 20 CBBD O=[N+]([O-])c1cc(-c2nn[nH]n2)cnc1NCCOCCO 1593470636 JOMMPWMGCSMZKY-UHFFFAOYSA-N 295.259 -0.409 5 20 CBBD O=C(O)[C@@H](O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 1601523325 DJEBATXCOHXHLD-IUCAKERBSA-N 284.224 -0.810 5 20 CBBD NC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN1 14300856 HJRNKNFQCYUUSJ-MRVPVSSYSA-N 295.255 -0.234 5 20 CBBD Cc1cc(N2CCO[C@@H](C(N)=O)C2)ncc1[N+](=O)[O-] 80600154 QJJQEKMBIRVIAN-SECBINFHSA-N 266.257 -0.011 5 20 CBBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H](O)CN1 150755165 OUBWGIAFGWRTPN-NWDGAFQWSA-N 294.311 -0.154 5 20 CBBD COCCCS(=O)(=O)NCCn1cc([N+](=O)[O-])cn1 177246309 LGAKXOHSQMOFFF-UHFFFAOYSA-N 292.317 -0.253 5 20 CBBD CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2O)C1=O 265844586 XXIXOUKJZFWCGU-QMMMGPOBSA-N 280.240 -0.344 5 20 CBBD CN(C(=O)Cn1ccc([N+](=O)[O-])n1)[C@@H]1COC[C@H]1O 287123086 CWQNRCPVBUXWAG-HTQZYQBOSA-N 270.245 -0.991 5 20 CBBD CN1CCN(C(=O)Cn2cnc([N+](=O)[O-])c2)CC1 340665668 QGUIUNQWIAYNJP-UHFFFAOYSA-N 253.262 -0.435 5 20 CBBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCC(N)=O 342370654 UMCLKKVHNFKGSJ-ZETCQYMHSA-N 294.267 -0.685 5 20 CBBD CCn1cc(S(=O)(=O)N2CC[C@@H](O)C2)c([N+](=O)[O-])n1 407990936 QSAYMNCKESSMLC-SSDOTTSWSA-N 290.301 -0.434 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[C@H](C(N)=O)O1 531594747 HSZKKTNROREHIB-PSASIEDQSA-N 296.283 -0.304 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CCO1 549186568 ZGXCHAYNNODZTR-ZETCQYMHSA-N 284.228 -0.668 5 20 CBBD Nc1nccc(C(=O)NCCN2CCCC2=O)c1[N+](=O)[O-] 566747201 DUSYQPZYYBPDGU-UHFFFAOYSA-N 293.283 -0.076 5 20 CBBD O=C(O)c1ccnc(N2C[C@@H](O)C[C@H]2CO)c1[N+](=O)[O-] 592978904 JBBVRZAAPNSRNO-BQBZGAKWSA-N 283.240 -0.380 5 20 CBBD COC(=O)c1cn(C2CCN(CC[N+](=O)[O-])CC2)nn1 791055802 YOTYKXWMCTVJMN-UHFFFAOYSA-N 283.288 -0.022 5 20 CBBD COC[C@](C)(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(=O)OC 840393790 ZEXXOLKWGNKNQF-XSSZXYGBSA-N 260.246 -0.654 5 20 CBBD Nc1ccc(C(=O)NC[C@H]2CNCCO2)cc1[N+](=O)[O-] 842509815 HUDLMYKOBXPHBI-SECBINFHSA-N 280.284 -0.105 5 20 CBBD CN(C(=O)c1ccc[nH]1)C1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 953716273 PNZRVKVIGZOMIT-MWLCHTKSSA-N 292.295 -0.037 5 20 CBBD CC(C)=CC(=O)NCC1(O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1 1041314542 ZYXHHIBNPKHQFN-NXEZZACHSA-N 297.311 -0.693 5 20 CBBD C[C@]1(COC(=O)Cn2cnc([N+](=O)[O-])n2)CCNC1=O 1123099354 SWXQYRSJPQJNHP-SNVBAGLBSA-N 283.244 -0.744 5 20 CBBD Cn1ncnc1C[S@@](=O)CCn1cc([N+](=O)[O-])cn1 1253351923 BUVBZXYBCBRXQO-IBGZPJMESA-N 284.301 -0.131 5 20 CBBD CNC[C@@H](O)CN(C)C(=O)c1cccc([N+](=O)[O-])c1N 1578651946 BFNLCYFNAGYFOC-MRVPVSSYSA-N 282.300 -0.171 5 20 CBBD C[C@@H](O)[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)O 1607424766 KVJIZAYFGJLDLO-ANLVUFKYSA-N 284.224 -0.136 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NC(=O)NC1CCCC1 48603060 NPRQIXZVHIXYIT-UHFFFAOYSA-N 282.260 -0.045 5 20 CBBD CCNC(=O)CN(CC)c1ncc([N+](=O)[O-])c(N)n1 267093648 XRFGWCQGFFYSBT-UHFFFAOYSA-N 268.277 -0.071 5 20 CBBD NC(=O)[C@H]1CCCC[C@@H]1NC(=O)Cn1ccc([N+](=O)[O-])n1 267317207 NVBRCVJPPHGYAD-IUCAKERBSA-N 295.299 -0.048 5 20 CBBD C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@H](O)[C@H](O)C1 278940972 YDMLIWIKDNHGFH-KPXOXKRLSA-N 295.295 -0.041 5 20 CBBD COCCCN(CCO)C(=O)c1cc([N+](=O)[O-])[nH]n1 286735885 IOKREVLEXQFWQQ-UHFFFAOYSA-N 272.261 -0.211 5 20 CBBD COC(=O)CN1CCN(c2ncc([N+](=O)[O-])cn2)CC1 302096628 JKQFLCGCJGFXAY-UHFFFAOYSA-N 281.272 -0.320 5 20 CBBD NC(=O)COCCNC(=O)Cc1ccccc1[N+](=O)[O-] 353203771 FAFUIPGDGJSEKS-UHFFFAOYSA-N 281.268 -0.245 5 20 CBBD COC(=O)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@H](C)O1 355843625 GYNWJYQUCJJERV-XPUUQOCRSA-N 298.255 -0.280 5 20 CBBD Cn1ccc(CCNc2nccc(C(N)=O)c2[N+](=O)[O-])n1 357460405 QEKVXNNBKGIFLQ-UHFFFAOYSA-N 290.283 0.477 5 20 CBBD NC(=O)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 524718880 NDLHGZLHCNPWFU-UHFFFAOYSA-N 281.224 -0.071 5 20 CBBD CC(C)[C@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 725923969 MAOOATXCVDXVJF-VIFPVBQESA-N 270.245 -0.156 5 20 CBBD CN1C(=O)CN(NC(=O)c2ccc([N+](=O)[O-])n2C)C1=O 776245131 JFKRMRWJQXBZJR-UHFFFAOYSA-N 281.228 -0.528 5 20 CBBD O=C(OCCn1cc([N+](=O)[O-])ccc1=O)c1cnn[nH]1 805605907 RIWMUUIQINKSOD-UHFFFAOYSA-N 279.212 -0.268 5 20 CBBD CC1(S(=O)(=O)NC(=O)Cn2ccc([N+](=O)[O-])n2)CC1 806026161 SSURQWWWWWLJNT-UHFFFAOYSA-N 288.285 -0.210 5 20 CBBD CCN(OC)C(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 848238545 QXIJKORCHPFWEE-UHFFFAOYSA-N 297.271 -0.288 5 20 CBBD NC(=O)C(=O)N1CCN(Cc2csc([N+](=O)[O-])c2)CC1 949967054 IIMLZWJODHJNMT-UHFFFAOYSA-N 298.324 -0.214 5 20 CBBD Nc1nc(NCCNC(=O)c2ccon2)ncc1[N+](=O)[O-] 1093492850 XERXDXDXIXGNHA-UHFFFAOYSA-N 293.243 -0.203 5 20 CBBD CNC[C@H](C)CNC(=O)Cn1cnc([N+](=O)[O-])n1 1261492242 WDSOPMOULARPHK-ZETCQYMHSA-N 256.266 -0.842 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CCS(=O)(=O)CC1 1318277511 PZVKWVCVNYVGQL-UHFFFAOYSA-N 287.297 -0.196 5 20 CBBD CO[C@@H]1CN[C@@](C)(C(=O)NCCn2cc([N+](=O)[O-])cn2)C1 1573960177 GDFACNJZNFQKEW-CMPLNLGQSA-N 297.315 -0.326 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NC1(C(=O)O)CC(CO)C1 1601386538 CFUATDMATTWWID-UHFFFAOYSA-N 298.255 -0.867 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1cccc([N+](=O)[O-])c1O 1610696234 JBXQVCSZHORSQN-ZETCQYMHSA-N 270.197 -0.524 5 20 CBBD COC(=O)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 112668997 RDBCBPUPOPFMAW-MRVPVSSYSA-N 283.240 -0.063 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C[C@H](C)O 177408591 VVOJPVPBKLBHCE-ZETCQYMHSA-N 256.262 -0.061 5 20 CBBD Cc1nc(N2CCN[C@H](C(N)=O)C2)ccc1[N+](=O)[O-] 268521863 VEJLSXYJLNFPKB-QMMMGPOBSA-N 265.273 -0.438 5 20 CBBD NC(=O)COCCNC(=O)c1ccc(O)c([N+](=O)[O-])c1 273416784 LWVHZQJIFHRSEG-UHFFFAOYSA-N 283.240 -0.468 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)[C@@H]1CCCO1 344862691 QDISWLZGYCAZRQ-UWVGGRQHSA-N 296.283 -0.158 5 20 CBBD COC(=O)[C@@H]1C[C@@H](O)CN(CCn2ccc([N+](=O)[O-])n2)C1 592198819 OYKQFOSXJUGEKQ-NXEZZACHSA-N 298.299 -0.353 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 763712254 VCXOYYASBFVUQJ-VIFPVBQESA-N 297.267 -0.560 5 20 CBBD CO[C@H]1C[C@H](OC(=O)Cn2cnc([N+](=O)[O-])n2)C1 861302597 VNEAUPVAHZGWJE-LJGSYFOKSA-N 256.218 -0.093 5 20 CBBD CN(C[C@@H]1CCCN(CC[N+](=O)[O-])C1)S(C)(=O)=O 930440681 DIYIRRBEGVZMKU-JTQLQIEISA-N 279.362 -0.134 5 20 CBBD COC(=O)NC1CN(C(=O)c2cc([N+](=O)[O-])cnc2O)C1 1116649456 SFOKMCNTDAZBSQ-UHFFFAOYSA-N 296.239 -0.124 5 20 CBBD CCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@@H]1CCNC1=O 1256589003 XKYICGGYQCFSRM-MRVPVSSYSA-N 295.299 -0.013 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[S@@](C)=O 1318887044 NTQLJRONUQPNDV-LJQANCHMSA-N 288.329 -0.015 5 20 CBBD Cn1cnnc1CCCNC(=O)Cn1cc([N+](=O)[O-])cn1 1324340136 JFFARCAZRQXGJM-UHFFFAOYSA-N 293.287 -0.331 5 20 CBBD C[C@@H]1CN(C)C(=O)CN1c1nnc([C@@H](C)[N+](=O)[O-])n1C 1355414474 CSAUIIUVBDNEEI-HTQZYQBOSA-N 282.304 -0.180 5 20 CBBD CN(C(=O)c1cc([N+](=O)[O-])n[nH]1)C1[C@@H]2CNC[C@@H]12 1578389346 FUOJRSUZRCLACE-PHDIDXHHSA-N 251.246 -0.392 5 20 CBBD O=C(O)[C@H]1CC(F)(F)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1608818975 IASRAPQHCDUMFN-HSUXUTPPSA-N 264.184 -0.028 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCc1nc[nH]n1 49918479 IGLZBHUHBQLHRK-UHFFFAOYSA-N 251.206 -0.774 5 20 CBBD C[C@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)C(N)=O 119375783 AWXQNOHJNXSXGS-BYPYZUCNSA-N 279.299 -0.192 5 20 CBBD CCC[C@@H](NC(N)=O)C(=O)NCCn1cc([N+](=O)[O-])cn1 122172015 RIFZZMOJSSAFJC-SECBINFHSA-N 298.303 -0.256 5 20 CBBD CN(CCS(C)(=O)=O)C(=O)Cn1cc([N+](=O)[O-])cn1 171104776 PLUXAQWKYQEISD-UHFFFAOYSA-N 290.301 -0.706 5 20 CBBD COC[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)OC 272766121 GKRFHMUGEORPMO-JTQLQIEISA-N 286.288 -0.041 5 20 CBBD O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1O)NCCO 274959162 QEDZUUWIGQIWBD-UHFFFAOYSA-N 283.240 -0.861 5 20 CBBD O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1COC[C@H]1O 295259987 GUAYCRXSGFEJTE-VXNVDRBHSA-N 288.281 -0.367 5 20 CBBD CN1CC[C@H](N(C)Cc2c([N+](=O)[O-])ncn2C)C1=O 352659899 PMYDRXMIHWDTTQ-QMMMGPOBSA-N 267.289 -0.009 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1CO 360853721 JVFSDVDUGJBCPW-RKDXNWHRSA-N 268.273 -0.122 5 20 CBBD CC(C)N(CCC(=O)O)C(=O)Cn1cnc([N+](=O)[O-])n1 362312545 KWRJSIYHBHVMAL-UHFFFAOYSA-N 285.260 -0.102 5 20 CBBD Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](CO)[C@@H](O)C1 564402040 SVHDYGUAUWNNAC-KWQFWETISA-N 295.295 -0.008 5 20 CBBD CC[C@H](NC(=O)c1ccnc(N)c1[N+](=O)[O-])C(=O)NC 582190762 CULKSDGAPQVDPC-ZETCQYMHSA-N 281.272 -0.174 5 20 CBBD CNC(=O)NCCNc1nccc(C(N)=O)c1[N+](=O)[O-] 596272509 RSBMKPGYZROUIA-UHFFFAOYSA-N 282.260 -0.570 5 20 CBBD O=C(Nn1cnnc1O)c1ccc(O)c([N+](=O)[O-])c1 776185064 OAIHQOKOIQSLRI-UHFFFAOYSA-N 265.185 -0.019 5 20 CBBD COCCN(CC(=O)O)c1ncc([N+](=O)[O-])c(N)n1 820730351 QXLYVKQLVJCZPW-UHFFFAOYSA-N 271.233 -0.496 5 20 CBBD O=[N+]([O-])CCNCCCN1CCCS1(=O)=O 905088194 HOCAPJZVZCRUJX-UHFFFAOYSA-N 251.308 -0.722 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NN1CCCCC1 919679219 QXFHEPZAXNYZGU-UHFFFAOYSA-N 254.250 -0.297 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](NC(=O)C(N)=O)C2)n1 1059393857 OASWZZJVNAPXBU-ZKCHVHJHSA-N 293.283 -0.157 5 20 CBBD CNC(=O)CC(=O)NCCNc1nccc(C)c1[N+](=O)[O-] 1093568396 ZISJUGMPHPKBTH-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD CCN(CCNC(=O)CC(N)=O)c1ccc([N+](=O)[O-])cn1 1100474865 OAHOQJRQJULCBT-UHFFFAOYSA-N 295.299 -0.192 5 20 CBBD CCOC(=O)CN(C)C(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1319375150 ARWYSNZOERTHAA-UHFFFAOYSA-N 297.267 -0.222 5 20 CBBD CN(C)CCNC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1 1322897779 GYRNYRYZLVCONE-UHFFFAOYSA-N 268.273 -0.566 5 20 CBBD Nc1c([N+](=O)[O-])cnn1C[C@H]1CCS(=O)(=O)C1 1344056400 ITXQQHROJVAOIM-ZCFIWIBFSA-N 260.275 -0.192 5 20 CBBD CNC(=O)CCS(=O)(=O)Cc1onc(C)c1[N+](=O)[O-] 1347177340 CWDOWXUGYXYHFN-UHFFFAOYSA-N 291.285 -0.058 5 20 CBBD CCc1nn(C)c(N2CC[C@](O)(C(=O)O)C2)c1[N+](=O)[O-] 1776990578 IQWLAIBUEANSNC-LLVKDONJSA-N 284.272 -0.084 5 20 CBBD CN(C[C@H](O)CN1CCOCC1)c1c([N+](=O)[O-])ncn1C 81015839 YUGTWXDJGVSVIE-JTQLQIEISA-N 299.331 -0.542 5 20 CBBD CC[C@@H](CCO)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 134393104 XPJKEZZCBWIREF-ONGXEEELSA-N 272.305 -0.097 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])s1 188922839 GKGYPYMIWQGCKK-UHFFFAOYSA-N 293.326 -0.065 5 20 CBBD Cn1nnc(Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)n1 193047067 LXRCPMUEBORNEO-UHFFFAOYSA-N 287.239 -0.124 5 20 CBBD CC(C)N1C[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 265661259 QZRSGTKEQHJNEU-SECBINFHSA-N 295.299 -0.083 5 20 CBBD CCc1[nH]nc(C(=O)N2CCN(CCO)CC2)c1[N+](=O)[O-] 269335925 BIXWFTJVZLNPIW-UHFFFAOYSA-N 297.315 -0.370 5 20 CBBD O=C(N[C@H]1C[C@@H](O)C1)c1cc([N+](=O)[O-])cnc1O 298295046 IMGDGHFQNYGKOU-IAQIWYKVSA-N 253.214 -0.052 5 20 CBBD COC(=O)CN(C)C(=O)CCn1cc([N+](=O)[O-])cn1 299266954 RUMWFDQAWMSSHM-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD Nc1nc(=NC[C@@H](CO)c2cccnc2)[nH]cc1[N+](=O)[O-] 340945302 XRIVSWBBPCGVDG-VIFPVBQESA-N 290.283 -0.028 5 20 CBBD C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[S@@]1=O 353229705 LUKQFGDJLRCFHE-DMWPKQFHSA-N 272.286 -0.089 5 20 CBBD COc1c(C(=O)NCC(=O)NCCO)cccc1[N+](=O)[O-] 356436993 QTHMVNQFVUTINM-UHFFFAOYSA-N 297.267 -0.558 5 20 CBBD CCOC(=O)[C@@H](CO)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 356940598 WNXXAVLAHAPCIQ-SNVBAGLBSA-N 298.251 -0.046 5 20 CBBD CCc1[nH]nc(C(=O)N[C@H](C)CC(N)=O)c1[N+](=O)[O-] 439329518 YEZUJMVIHRVRCU-RXMQYKEDSA-N 269.261 -0.126 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NCC(C)(C)OCCO 494551198 YXANIJAWUWJXQP-UHFFFAOYSA-N 286.288 -0.154 5 20 CBBD O=C(O)C(=O)N1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 521881000 MWROZIJBFWCDEX-UHFFFAOYSA-N 297.271 -0.980 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CO)[C@H](O)C1 547403078 ZQVMNHCSIPNJKP-GZMMTYOYSA-N 283.284 -0.251 5 20 CBBD CO[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](CN)C1 574400360 IILYQZYNURQACP-SFYZADRCSA-N 283.288 -0.104 5 20 CBBD CC[C@@H](NS(=O)(=O)c1ncccc1[N+](=O)[O-])C(N)=O 594776245 WSQJYGBLZMHDIQ-ZCFIWIBFSA-N 288.285 -0.468 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNC[C@H]2C[C@@H](O)C2)c1 720925615 OREJWRKZKGSYCN-GDPRMGEGSA-N 270.289 -0.487 5 20 CBBD COc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)NC(N)=O 755677699 PEEPUAFHPDDLDH-UHFFFAOYSA-N 297.223 -0.045 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)c1c[nH]nc1[N+](=O)[O-] 801634376 XAMRUFLSZCRHEH-UHFFFAOYSA-N 295.215 -0.147 5 20 CBBD Cn1nncc1COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 809133401 IGLAIRQZJDKHTK-UHFFFAOYSA-N 293.239 -0.372 5 20 CBBD Cc1nn(CN2CC(=O)N[C@H](C)C2)cc1[N+](=O)[O-] 840131635 CJBWWAWGNZOQSD-SSDOTTSWSA-N 253.262 -0.122 5 20 CBBD Cn1cc([N+](=O)[O-])cc1C(=O)NC1CC(CO)(CO)C1 863520494 VUOBYDPWXFPOPZ-UHFFFAOYSA-N 283.284 -0.204 5 20 CBBD Cn1c(C(=O)OCCN2C(=O)CNC2=O)ccc1[N+](=O)[O-] 914624966 JBEPCWCDYLBPMU-UHFFFAOYSA-N 296.239 -0.358 5 20 CBBD CN[C@@H]1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 923278149 PKYNDQYWSOAFOR-KOLCDFICSA-N 269.305 -0.554 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H](N2CCCC2=O)C1 1121391547 GXFZGNVVSGNBOT-VIFPVBQESA-N 294.315 -0.207 5 20 CBBD Cc1nn(C)c(C(=O)NCCN2CC[C@@H](O)C2)c1[N+](=O)[O-] 1348480591 ZQTNQZKAXUMTNB-SECBINFHSA-N 297.315 -0.567 5 20 CBBD O=C(O)[C@H](CO)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1602208961 UQLHQJCZMRNHDQ-UWVGGRQHSA-N 270.241 -0.337 5 20 CBBD O=C1CN(C(=O)c2cc(C(=O)O)cc([N+](=O)[O-])c2)CCN1 1610885714 HONBLUNPTWZFRK-UHFFFAOYSA-N 293.235 -0.135 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])o1 35160311 WRXUOVYZGMELES-YFKPBYRVSA-N 258.186 -0.549 5 20 CBBD CCN(CCO)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O 37861146 APRMIGQXELFUBB-UHFFFAOYSA-N 255.230 -0.263 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)N(C)C 46271859 FJCWXKNYBXIPBW-QMMMGPOBSA-N 255.278 -0.142 5 20 CBBD NS(=O)(=O)NCCNc1ccccc1[N+](=O)[O-] 74038971 SEFKIIXUQUXFHT-UHFFFAOYSA-N 260.275 -0.200 5 20 CBBD C[C@](O)(CNC(=O)COc1cccc([N+](=O)[O-])c1)C(=O)O 90275985 RMDTVWFAOIGMRQ-LBPRGKRZSA-N 298.251 -0.075 5 20 CBBD COCC[C@@](C)(O)CNC(=O)Cn1ccc([N+](=O)[O-])n1 231683913 YYGYTRBDPNOYKT-LLVKDONJSA-N 286.288 -0.305 5 20 CBBD Cn1c(C(=O)N2C[C@H](O)[C@@H](O)C2)ccc1[N+](=O)[O-] 236079892 DYRAEPXESDPSHH-YUMQZZPRSA-N 255.230 -0.889 5 20 CBBD CC[C@H]1C(=O)NCCN1C(=O)CCn1cc([N+](=O)[O-])cn1 264556186 XFFLTCMGQKDEPJ-JTQLQIEISA-N 295.299 -0.082 5 20 CBBD O=C(NC[C@]1(O)CCOC1)c1cnc(O)c([N+](=O)[O-])c1 277953988 DASIHIHFQKGGKC-LLVKDONJSA-N 283.240 -0.423 5 20 CBBD COC[C@@H](CO)NC(=O)c1cccc([N+](=O)[O-])c1N 280140384 XEAOCAATULVLAQ-SSDOTTSWSA-N 269.257 -0.086 5 20 CBBD COC(=O)[C@@H](CNC(=O)c1cnc(O)c([N+](=O)[O-])c1)OC 294087293 RCABVYWRGGALAC-MRVPVSSYSA-N 299.239 -0.387 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H](C)CO 305273585 UVGHASBNZQKXIN-SSDOTTSWSA-N 256.262 -0.061 5 20 CBBD CN1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C1=O 341732879 GONZPWYSYQPISJ-VIFPVBQESA-N 293.283 -0.125 5 20 CBBD CC(C)[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 343485328 YVALGZNIWJXXNB-LURJTMIESA-N 255.234 -0.442 5 20 CBBD CN1CCC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1=O 344057705 LMZHDZOVMWHXDL-LURJTMIESA-N 267.245 -0.332 5 20 CBBD C[C@@](O)(CO)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 355292429 QVSWROMVOXHNAN-LBPRGKRZSA-N 294.267 -0.056 5 20 CBBD CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])nn1C 356703216 ACORDJQCCDNZHR-UHFFFAOYSA-N 283.288 -0.170 5 20 CBBD CN1CC[C@@](O)(CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1 357451132 FTMUKDCJFXOPSC-GFCCVEGCSA-N 295.299 -0.433 5 20 CBBD NC(=O)N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1 358041322 KIXAHTOOOUQJMF-ZCFIWIBFSA-N 267.245 -0.194 5 20 CBBD Cc1[nH]nc(C(=O)N[C@@H]2CCC(=O)N(C)C2=O)c1[N+](=O)[O-] 425095393 VSRIIKVGAIKCAQ-ZCFIWIBFSA-N 295.255 -0.496 5 20 CBBD CNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])n1C 440176574 PWWLZDGBRHMSCA-UHFFFAOYSA-N 290.301 -0.788 5 20 CBBD C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])cnc1N 447742193 OZMRYBPAHNJSNX-JVXZTZIISA-N 296.283 -0.158 5 20 CBBD COC(=O)CN1CCN(c2ncc([N+](=O)[O-])c(C)n2)CC1 450239463 DKTODISUYCTUNY-UHFFFAOYSA-N 295.299 -0.012 5 20 CBBD CN(C)[C@H]1[C@@H]2CN(C(=O)c3n[nH]cc3[N+](=O)[O-])C[C@@H]21 599999627 HBNMEXCCJQWAAO-MTBHXBHISA-N 265.273 -0.050 5 20 CBBD Cc1cnc(N2CCN(C(=O)CO)CC2)c([N+](=O)[O-])c1 611242782 ZCHVPNHRESYIGG-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C(C)(C)C(=O)O 830713514 HCKAMYKEJSCDIS-VIFPVBQESA-N 286.288 -0.053 5 20 CBBD CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1OC 839724768 CSHPZMLPAYNRSM-JDDHQFAOSA-N 258.274 -0.040 5 20 CBBD Cn1ccc(C(=O)NC2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)n1 991729784 QHZQXAXGOIEUSQ-PSASIEDQSA-N 293.283 -0.974 5 20 CBBD CC(=O)N[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1321769057 FRRZHDYBSDNFJJ-SECBINFHSA-N 296.287 -0.687 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cn(CC[C@H]2CCNC2)c1=O 1326052419 QYSGSOCCOLVSSC-MRVPVSSYSA-N 280.284 -0.145 5 20 CBBD Cc1nn(C)c(N2CC(OCCO)C2)c1[N+](=O)[O-] 1548523010 BALJUTOXGCPMIR-UHFFFAOYSA-N 256.262 -0.166 5 20 CBBD O=[N+]([O-])c1ncn(Cc2cc(-c3nn[nH]n3)ccn2)n1 1593486897 AJAVJJZGFVCNRU-UHFFFAOYSA-N 273.216 -0.190 5 20 CBBD O=C(O)CCCNC(=O)Cn1ccc([N+](=O)[O-])n1 50162181 ZJFASUCRFJLNRU-UHFFFAOYSA-N 256.218 -0.228 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H](CO)O[C@H](C)C2)c1[N+](=O)[O-] 187881411 KECDIBWWQSLZLQ-APPZFPTMSA-N 298.299 -0.141 5 20 CBBD CNS(=O)(=O)CCNc1ccc([N+](=O)[O-])cn1 221043842 YFMOBLDMLWQNGS-UHFFFAOYSA-N 260.275 -0.049 5 20 CBBD CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CC(=O)NC1=O 264142756 FUUKTYDPCBRJDX-LURJTMIESA-N 295.255 -0.496 5 20 CBBD C[C@@H](NC(=O)COc1ccc(C=O)cc1[N+](=O)[O-])C(N)=O 264586915 NOTZWTCKCKDUSE-SSDOTTSWSA-N 295.251 -0.224 5 20 CBBD CC(=O)C[C@H]1COCCN1C(=O)Cn1cc([N+](=O)[O-])cn1 274840317 PQZCKDGRRCBYRH-JTQLQIEISA-N 296.283 -0.002 5 20 CBBD COc1c(C(=O)N[C@@H]2CN(C)NC2=O)cccc1[N+](=O)[O-] 356640970 HISLUCLQWQSGHI-MRVPVSSYSA-N 294.267 -0.322 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@H](O)C[C@@H]1CO 366693272 FVEXSNBMMKWNDZ-HTQZYQBOSA-N 282.252 -0.132 5 20 CBBD CN(CCC(N)=O)C(=O)c1cc([N+](=O)[O-])cn1C 560513313 XRPHRJHNKCZFLT-UHFFFAOYSA-N 254.246 -0.119 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCc2cnn[nH]2)c1 562474312 HQLCKDLSDDKDNG-UHFFFAOYSA-N 293.239 -0.096 5 20 CBBD C[C@@H](O)CN(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1 594064170 KZRRLDACWPUBBA-SKDRFNHKSA-N 284.316 -0.003 5 20 CBBD CN(C[C@@H]1COCCO1)C(=O)Cn1cc([N+](=O)[O-])cn1 598180388 FFKYHUKFPPBHRI-SNVBAGLBSA-N 284.272 -0.335 5 20 CBBD N[C@H]1C[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1 715110663 UFQUYDAWGUTNGJ-ZKCHVHJHSA-N 253.262 -0.355 5 20 CBBD NC(=O)NCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 736110530 OJQAIBXCUSNWJU-UHFFFAOYSA-N 296.239 -0.278 5 20 CBBD CCN1CCOC[C@H]1C(=O)OCCn1cnc([N+](=O)[O-])n1 775536863 USEHBSGYYDJRNU-VIFPVBQESA-N 299.287 -0.550 5 20 CBBD COCOCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 848172248 NDZOJPIXEHUCCX-UHFFFAOYSA-N 272.261 -0.082 5 20 CBBD NC[C@]12CC[C@H]1CCN2C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 1580253440 MQUFHILZQSEPEJ-CYZMBNFOSA-N 295.343 -0.035 5 20 CBBD Nc1ncc(C(=O)N[C@@H](CF)C(=O)O)cc1[N+](=O)[O-] 1601221092 ITXQZZCQBXAVEJ-YFKPBYRVSA-N 272.192 -0.276 5 20 CBBD CC(C)NC(=O)CCNC(=O)Cn1cc([N+](=O)[O-])cn1 45919605 IXKLWPCBKKJLCJ-UHFFFAOYSA-N 283.288 -0.178 5 20 CBBD Cc1ccc(NC(=O)C(=O)NC(CO)CO)cc1[N+](=O)[O-] 267349703 JSKXDDPIGAEDKZ-UHFFFAOYSA-N 297.267 -0.689 5 20 CBBD CC1(CNC(=O)Cn2ccc([N+](=O)[O-])n2)OCCO1 269703338 RSYIHVODVVTXEI-UHFFFAOYSA-N 270.245 -0.330 5 20 CBBD C[C@H]1CS(=O)(=O)C[C@H]1NC(=O)c1cc([N+](=O)[O-])[nH]n1 290750663 YMORPXNEEAOWEF-CAHLUQPWSA-N 288.285 -0.519 5 20 CBBD CCc1nc(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)n[nH]1 295365100 OJKPYPJJIOYOHH-UHFFFAOYSA-N 265.233 -0.072 5 20 CBBD COc1ccc([N+](=O)[O-])cc1C(=O)NCCOCC(N)=O 353211391 ZYSZQFGOLTXXQS-UHFFFAOYSA-N 297.267 -0.165 5 20 CBBD Cn1nncc1CNC(=O)c1cnc(O)c([N+](=O)[O-])c1 360676417 UVXRGWJROKRNTN-UHFFFAOYSA-N 278.228 -0.246 5 20 CBBD COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])nn1C 360721859 MKMNKIPFGBDNPX-ZETCQYMHSA-N 272.261 -0.545 5 20 CBBD Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CCSC1 360752060 DIZLXEMQJVGYSJ-JTQLQIEISA-N 286.313 -0.074 5 20 CBBD O=C(c1cccc([N+](=O)[O-])c1O)N1C[C@H](O)C[C@H]1CO 366638812 FVEXSNBMMKWNDZ-JGVFFNPUSA-N 282.252 -0.132 5 20 CBBD CC(C)c1[nH]nc(C(=O)NCc2nnn(C)n2)c1[N+](=O)[O-] 428527933 YSOICJGCMRCYCI-UHFFFAOYSA-N 294.275 -0.105 5 20 CBBD NC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CCO1 514672378 NEYRYBMJDKNFSL-LURJTMIESA-N 255.234 -0.882 5 20 CBBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCCc1nc(N)n[nH]1 590550248 AFADXVXARVGKRH-UHFFFAOYSA-N 291.271 -0.029 5 20 CBBD CO[C@@H]1COC[C@@H]1Nc1ccc(N)c([N+](=O)[O-])n1 596268866 LWMZQQDFVUUYKM-JGVFFNPUSA-N 254.246 0.398 5 20 CBBD O=[N+]([O-])c1ccc(NC[C@]2(O)CCS(=O)(=O)C2)nc1 599083970 RTMGXPTXMOHJFN-SNVBAGLBSA-N 287.297 -0.049 5 20 CBBD NC(=O)NC(=O)CCNc1cccnc1[N+](=O)[O-] 610864579 FTBABWMMPMOSRC-UHFFFAOYSA-N 253.218 -0.013 5 20 CBBD CCN(C)S(=O)(=O)NC(=O)Cn1cc([N+](=O)[O-])cn1 744241830 OVSALTFKKIFZQJ-UHFFFAOYSA-N 291.289 -0.896 5 20 CBBD COC[C@](C)(CO)NC(=O)c1cc([N+](=O)[O-])cnc1N 768450738 HOUOEWICKRAVNQ-NSHDSACASA-N 284.272 -0.301 5 20 CBBD Cc1nn(C)c(C(=O)NN2CCCNC2=O)c1[N+](=O)[O-] 783601111 UGACPDKTLPNQCS-UHFFFAOYSA-N 282.260 -0.303 5 20 CBBD CNC(=O)CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 916577111 IHSYVRBKUUKVOY-UHFFFAOYSA-N 273.270 -0.381 5 20 CBBD CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(C(=O)c2cc[nH]c2)C1 954242580 USQJOYXROIEMBD-GHMZBOCLSA-N 292.295 -0.037 5 20 CBBD COc1nccc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 1126936677 QGSQIZIARBZAQS-NXEZZACHSA-N 295.299 -0.644 5 20 CBBD COC[C@@](C)(O)CNC(=O)c1n[nH]cc1[N+](=O)[O-] 1319847903 QGXIBEHJZYHJBC-VIFPVBQESA-N 258.234 -0.555 5 20 CBBD O=C(NC[C@@H](CO)[C@H]1CCOC1)c1n[nH]cc1[N+](=O)[O-] 1322483763 HCBZSKVQTRLASQ-YUMQZZPRSA-N 284.272 -0.307 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCc1nc[nH]n1 1323522161 OQHFPEQCULZZRP-UHFFFAOYSA-N 278.228 -0.809 5 20 CBBD NC[C@@H]1CCCN(C(=O)Cn2cnc([N+](=O)[O-])n2)C1 1332413853 RBHFKNPDJADTLZ-QMMMGPOBSA-N 268.277 -0.616 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1[C@@H]2CNC[C@@H]12 1580578465 FPZCRQYSGVDACK-NXEZZACHSA-N 292.295 -0.662 5 20 CBBD Cc1nc(NC[C@@H](O)CC(=O)O)ncc1[N+](=O)[O-] 1600716060 VJMNCAYDLAUWHC-LURJTMIESA-N 256.218 -0.059 5 20 CBBD O=C(NC[C@H](O)C(=O)O)c1ccc([N+](=O)[O-])cn1 1610696131 CNBSGOMSHAJZLC-ZETCQYMHSA-N 255.186 -0.835 5 20 CBBD O=C(O)[C@@H]1CNCCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 1610747149 DQJJYFCUVTVHJH-QMMMGPOBSA-N 282.256 -0.188 5 20 CBBD O=C(CCNc1ccccc1[N+](=O)[O-])NC(CO)CO 132316932 YEJQVHVPDUWTNV-UHFFFAOYSA-N 283.284 -0.134 5 20 CBBD CC(=O)NC[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 176248529 CIDIHBQMMOJUPY-NSHDSACASA-N 297.315 -0.372 5 20 CBBD C[C@H]1C(=O)N(C)CCN1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 186934193 RPWNIWADJOUSQK-ONGXEEELSA-N 297.315 -0.685 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCOC[C@H]1C(=O)O 262055661 AYMQLPDPYRAMDM-QMMMGPOBSA-N 298.255 -0.588 5 20 CBBD Cc1cc(=O)n(CCS(=O)(=O)N(C)C)cc1[N+](=O)[O-] 285221370 PYJIDJKWAJDYNQ-UHFFFAOYSA-N 289.313 -0.044 5 20 CBBD NC(=O)c1cc([N+](=O)[O-])cnc1NCCOCCO 298458625 XJJXLSVFJQQAHM-UHFFFAOYSA-N 270.245 -0.491 5 20 CBBD COC[C@H](C(N)=O)N(C)C(=O)c1cnc(O)c([N+](=O)[O-])c1 354548741 IIEHWLVADPLTGD-MRVPVSSYSA-N 298.255 -0.732 5 20 CBBD CN(CC(N)=O)c1cc([N+](=O)[O-])ccc1S(N)(=O)=O 428097757 FZUVTXRYHODLGW-UHFFFAOYSA-N 288.285 -0.836 5 20 CBBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)C(=O)NCCN(C)C 565208096 ZBCAZTCUNWWOAE-MRVPVSSYSA-N 297.315 -0.281 5 20 CBBD CN1CCN(CCn2ccc([N+](=O)[O-])n2)CCC1=O 595786653 VIMNJEFUZYZSHJ-UHFFFAOYSA-N 267.289 -0.045 5 20 CBBD C[C@H](CC(=O)O)NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-] 600650724 APBNMSKOBSYBNX-RXMQYKEDSA-N 292.273 -0.530 5 20 CBBD CCNS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 731647106 GJKSGJUGPNCFDX-UHFFFAOYSA-N 291.285 -0.143 5 20 CBBD Cn1nc(C(=O)OCCn2ccc([N+](=O)[O-])n2)ccc1=O 748118458 IDZYSTMOQZYWKA-UHFFFAOYSA-N 293.239 -0.258 5 20 CBBD Cn1cc(COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)nn1 759580220 SSPIFKKIVNDZHX-UHFFFAOYSA-N 293.239 -0.372 5 20 CBBD CCc1cc(=O)n2[nH]c(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])nc2n1 857685231 VGDIGHNWCIXCNR-RNFRBKRXSA-N 292.255 -0.416 5 20 CBBD CCN(CC)C(=O)CN1CCN(CC[N+](=O)[O-])CC1 929192722 UPQIGFGZHUYUNZ-UHFFFAOYSA-N 272.349 -0.251 5 20 CBBD C[C@@H]1[C@@H](C)N(CC[N+](=O)[O-])CCN1CC[N+](=O)[O-] 931074519 XJPFMFMOXDWWPT-NXEZZACHSA-N 260.294 -0.066 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@@H]2CN(CCO)C[C@@H]2CC1 946589250 OGYLFAFTVHQBQK-YVECIDJPSA-N 297.355 -0.186 5 20 CBBD COCC(=O)NCCN(C)c1ncc([N+](=O)[O-])c(N)n1 1099897097 QPOQIGPXZOZXPC-UHFFFAOYSA-N 284.276 -0.834 5 20 CBBD Cc1nnc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1 1126932077 HHTSZUBUIUGQOP-HTQZYQBOSA-N 269.261 -0.751 5 20 CBBD Cc1nc(CNCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])co1 1126936604 MQFLHBOQOWZDCM-NXEZZACHSA-N 268.273 -0.146 5 20 CBBD CN1CC[C@H](NC(=O)c2c([N+](=O)[O-])cnn2C)C1=O 1320655648 CBALMYCZYBMHLN-LURJTMIESA-N 267.245 -0.711 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCc2nn[nH]c2C1 1321714142 UFMDMBSOHLHZJL-UHFFFAOYSA-N 277.244 -0.506 5 20 CBBD CC(=O)N1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1 1519615045 UZDXHCBRXYKWNV-UHFFFAOYSA-N 268.277 -0.740 5 20 CBBD O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCNC[C@@H]1O 1580562413 RRZXPXRIIDIEGL-RYUDHWBXSA-N 295.295 -0.187 5 20 CBBD CCCNC(=O)CN(C)C(=O)Cn1cc([N+](=O)[O-])cn1 44669492 PIENFKKYHCIKMU-UHFFFAOYSA-N 283.288 -0.224 5 20 CBBD Cn1c(C(=O)N2CCCNC(=O)C2)ccc1[N+](=O)[O-] 112207762 LSNPIALXHZGIRR-UHFFFAOYSA-N 266.257 -0.105 5 20 CBBD Nc1c([N+](=O)[O-])cnn1Cc1nnnn1CC(F)(F)F 191506565 ISLFLDDKYNTXJW-UHFFFAOYSA-N 292.181 -0.029 5 20 CBBD O=C1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CN1 230655700 PRTCFZDNBMBQFP-SSDOTTSWSA-N 265.225 -0.081 5 20 CBBD Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1COCCO1 230685616 YZGWVUGYWSHMCW-MRVPVSSYSA-N 282.256 -0.283 5 20 CBBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CO)C(N)=O 286220985 GXAWBIIJITYGBD-VIFPVBQESA-N 296.283 -0.763 5 20 CBBD NS(=O)(=O)[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1 339848970 YYNRHDLYMIGLNJ-MRVPVSSYSA-N 289.317 -0.846 5 20 CBBD CN(Cc1c([N+](=O)[O-])ncn1C)CC(C)(CO)CO 340196925 GLLXQJUEOGSPMG-UHFFFAOYSA-N 272.305 -0.249 5 20 CBBD CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@H]1COC[C@@H]1O 343618337 FIXIXESSEPRKPS-YUMQZZPRSA-N 279.256 -0.167 5 20 CBBD COC(=O)CN1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 345252538 OUVKNMAVAMLPGO-UHFFFAOYSA-N 296.283 -0.146 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)NCCN1CCCC1 349522439 NAHNMUFHFOALSV-UHFFFAOYSA-N 268.277 -0.602 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Nc1ccc([N+](=O)[O-])cc1F 357267616 JRFXTNOGWQWYCA-QMMMGPOBSA-N 286.219 -0.298 5 20 CBBD O=C1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CN1 357464263 HNHYPLAYKCLZAL-ZETCQYMHSA-N 265.225 -0.081 5 20 CBBD Nc1nccc(C(=O)N2CC[C@@H](O)C2)c1[N+](=O)[O-] 548386699 UZIFCXSDWHMODO-ZCFIWIBFSA-N 252.230 -0.221 5 20 CBBD CN(C)C(=O)COC1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1 549201854 GPCAZXRINHFSRG-UHFFFAOYSA-N 297.271 -0.753 5 20 CBBD CCN1C[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)CC1=O 593825821 LSQJEPFVIWAPRL-SECBINFHSA-N 295.299 -0.224 5 20 CBBD COc1cccc(C(=O)N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 600217153 PVJQHHOTVDFVNW-IUCAKERBSA-N 282.252 -0.219 5 20 CBBD CN1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1 787269344 DDKPINPMXOSMAC-ZDUSSCGKSA-N 294.311 -0.027 5 20 CBBD CN(CC(=O)O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 818402477 OGBALDVAKGMWJA-MRVPVSSYSA-N 258.234 -0.831 5 20 CBBD CC(C)NS(=O)(=O)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839604372 MOXFLGQYKKCLHR-HTQZYQBOSA-N 279.318 -0.904 5 20 CBBD NC(=O)C(=O)NCCNCc1ccccc1[N+](=O)[O-] 1133206433 QJBCBZAVIWKAMB-UHFFFAOYSA-N 266.257 -0.714 5 20 CBBD Cc1nn(C)c(C(=O)N2C[C@@H](CO)OC[C@H]2C)c1[N+](=O)[O-] 1319815667 KNTJARKUIMLKOX-APPZFPTMSA-N 298.299 -0.141 5 20 CBBD CN(CSc1ncc([N+](=O)[O-])c(N)n1)S(C)(=O)=O 1327184735 PKZFCTIQPUGZFC-UHFFFAOYSA-N 293.330 -0.092 5 20 CBBD C[S@](=O)CCn1cc([N+](=O)[O-])c(-c2nn[nH]n2)n1 1605362286 FIMVNJVDHLFRKN-SFHVURJKSA-N 271.262 -0.650 5 20 CBBD Cc1nn(C)c(C(=O)NC[C@](C)(O)C(=O)O)c1[N+](=O)[O-] 1605433838 GXZLUQSPGUCIBD-JTQLQIEISA-N 286.244 -0.798 5 20 CBBD Cn1c(Cn2cnc([N+](=O)[O-])c2)cc(=O)n(C)c1=O 25586801 WHWDSPYMNBCIRX-UHFFFAOYSA-N 265.229 -0.763 5 20 CBBD O=[N+]([O-])c1cc(S(=O)(=O)NCCO)cs1 119803097 ARBAGWKTEOKWAH-UHFFFAOYSA-N 252.273 -0.073 5 20 CBBD C[C@@H]1CN(C(=O)Cn2cnc([N+](=O)[O-])n2)C[C@@H](C)N1 153312897 GWEJDZGKDBTGEH-HTQZYQBOSA-N 268.277 -0.605 5 20 CBBD CN1C[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)CC1=O 164469167 YZMOJOBJGKVYQS-QMMMGPOBSA-N 281.272 -0.614 5 20 CBBD C[C@H]1CO[C@@H](CO)CN1C(=O)Cn1ccc([N+](=O)[O-])n1 167585482 SCCMMDMIIGTYHG-DTWKUNHWSA-N 284.272 -0.601 5 20 CBBD COCCOCCN(C)C(=O)Cn1ccc([N+](=O)[O-])n1 289048712 XXIZBVFNIXNCKV-UHFFFAOYSA-N 286.288 -0.087 5 20 CBBD CNC(=O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356230874 WPAPMEIMCPMSDK-UHFFFAOYSA-N 253.214 -0.224 5 20 CBBD CCn1cc(S(=O)(=O)N(C)C2CNC2)c([N+](=O)[O-])n1 357488352 TUQGYKPBFLNUHV-UHFFFAOYSA-N 289.317 -0.597 5 20 CBBD NC[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCO1 358135806 KVEVQNZQYHTVSL-SECBINFHSA-N 255.278 -0.549 5 20 CBBD Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CN(C)NC1=O 446306773 XCMXPDUMGDDCKI-QMMMGPOBSA-N 278.268 -0.022 5 20 CBBD O=[N+]([O-])c1cnn(C[C@H](O)CNCc2cc[nH]n2)c1 566107673 PLYVDKUPPRNMNY-SNVBAGLBSA-N 266.261 -0.335 5 20 CBBD COC(=O)[C@@H]1C[C@H](O)CN1Cc1onc(C)c1[N+](=O)[O-] 595456753 FYFPWRDJWYICQP-YUMQZZPRSA-N 285.256 -0.001 5 20 CBBD CCNC(=O)CNS(=O)(=O)c1cccnc1[N+](=O)[O-] 610259517 GRPYGOUGSAIAOZ-UHFFFAOYSA-N 288.285 -0.596 5 20 CBBD CCCNC(=O)COC(=O)Cn1cc([N+](=O)[O-])ccc1=O 748915597 ANYZWZMKMUKCAL-UHFFFAOYSA-N 297.267 -0.174 5 20 CBBD CNC(=O)[C@@H](O)CNC(=O)CCc1cccc([N+](=O)[O-])c1 763701101 BJLZJFMYYBORJM-NSHDSACASA-N 295.295 -0.250 5 20 CBBD CC[C@@H](NC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1)C(=O)O 820410683 HHLBYYNSNPRBQY-SSDOTTSWSA-N 283.240 -0.264 5 20 CBBD C[C@@H](COC(=O)[C@H]1CC(=O)N(c2cnn(C)c2)C1)[N+](=O)[O-] 860777716 UDAFNYVAHUUWDY-IUCAKERBSA-N 296.283 -0.019 5 20 CBBD O=C(N[C@H]1C[C@@H](NCCn2cccn2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] 1022063749 LEIWLARXVYUXCC-WRWGMCAJSA-N 293.327 -0.215 5 20 CBBD Cn1c(S)nnc1CNC(=O)Cn1cc([N+](=O)[O-])cn1 1116012543 CMIPTNLKDKRCQF-UHFFFAOYSA-N 297.300 -0.475 5 20 CBBD O=C(NCCNCCOCC(F)(F)F)[C@@H]1C[C@H]1[N+](=O)[O-] 1126949146 NLXFAZDLIUUZBU-HTQZYQBOSA-N 299.249 -0.064 5 20 CBBD CCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 1261558921 UZGSKBIJHBUIAF-VIFPVBQESA-N 298.299 -0.832 5 20 CBBD COC(=O)c1cc([N+](=O)[O-])c(=O)n(C[C@@H]2CNC(=O)C2)c1 1261595409 SCZJFKGHTQQHCK-ZETCQYMHSA-N 295.251 -0.321 5 20 CBBD NC(=O)[C@H](CO)NC(=O)c1ccccc1[N+](=O)[O-] 1328505448 NSCCKBHPDLLJKW-ZETCQYMHSA-N 253.214 -0.829 5 20 CBBD CCOC(=O)[C@H]1CNCCN1C(=O)c1n[nH]cc1[N+](=O)[O-] 1329490502 LUDCUJVNCZJIRF-MRVPVSSYSA-N 297.271 -0.705 5 20 CBBD Cn1c(C[N+](=O)[O-])nnc1N1CCC(CC(N)=O)CC1 1515350716 IHPSVVBWNAFCQW-UHFFFAOYSA-N 282.304 -0.316 5 20 CBBD C[C@H]1CO[C@H](C)CN1C(=O)Cn1cnc([N+](=O)[O-])n1 49090215 NVQBXAOKSDSRLV-JGVFFNPUSA-N 269.261 -0.178 5 20 CBBD Cc1nn(C)c(NCCCNS(C)(=O)=O)c1[N+](=O)[O-] 51767519 OTFUQQWLIYKBJJ-UHFFFAOYSA-N 291.333 -0.012 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCNC(=O)C1 65835134 MPJCFVCRIFBHLQ-UHFFFAOYSA-N 267.245 -0.942 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CNCc2ccon2)c1 148874507 NBUVUAHSKNKIBK-JTQLQIEISA-N 267.245 -0.070 5 20 CBBD Cc1nn(CC(=O)N2CCC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] 181835292 ZGQDIFIYMLAXAL-SECBINFHSA-N 295.299 -0.176 5 20 CBBD NS(=O)(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1O 225797510 SXPYGLJSJUSICM-UHFFFAOYSA-N 289.269 -0.681 5 20 CBBD NC(=O)[C@H](O)CNC[C@H](O)c1ccc([N+](=O)[O-])cc1 228681539 IUXRARSVPVCQJO-VHSXEESVSA-N 269.257 -0.936 5 20 CBBD Cn1nnnc1CNC(=O)Cc1cccc([N+](=O)[O-])c1 352197459 RYBXJNJQVQLEKI-UHFFFAOYSA-N 276.256 -0.023 5 20 CBBD CCCNC(=O)CNC(=O)c1ccnc(N)c1[N+](=O)[O-] 548384183 PFOJHZRVVZUNGQ-UHFFFAOYSA-N 281.272 -0.172 5 20 CBBD N[C@H]1C[C@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 578787363 MHXXJTGEGNADMQ-IUCAKERBSA-N 277.284 -0.262 5 20 CBBD O=[N+]([O-])c1cnc(NCCN2CC[C@H](O)C2)s1 599198917 AUPGIDGRYNBHBA-ZETCQYMHSA-N 258.303 0.530 5 20 CBBD COC(=O)C[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1 600458989 BLKBEXIAUFMSQN-MRVPVSSYSA-N 298.251 -0.046 5 20 CBBD NC(=O)[C@@H]1CN(c2cccnc2[N+](=O)[O-])CCN1 603845110 PULSWCXNAOMNJG-ZETCQYMHSA-N 251.246 -0.747 5 20 CBBD Cn1nnnc1CCNC(=O)c1cccc([N+](=O)[O-])c1N 611334562 SVTKQRMSRWIUNM-UHFFFAOYSA-N 291.271 -0.327 5 20 CBBD CC(C)[C@@H](OC(=O)Cn1ccc([N+](=O)[O-])n1)C(N)=O 725923967 MAOOATXCVDXVJF-SECBINFHSA-N 270.245 -0.156 5 20 CBBD CC(C)(C)C(=O)NCC(=O)OCCn1cnc([N+](=O)[O-])n1 749079613 MOSRTYVUNOJGFR-UHFFFAOYSA-N 299.287 -0.108 5 20 CBBD COC[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])C(N)=O 760043555 DESXRRVVILQCFI-MRVPVSSYSA-N 267.241 -0.175 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H](C)CS(C)(=O)=O 839680012 CVWWOGJMQWWCIF-DJLDLDEBSA-N 278.330 -0.067 5 20 CBBD COC(=O)[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1N 841421769 RPLKNRRNKVZNPV-GFCCVEGCSA-N 297.267 -0.169 5 20 CBBD CCC(=O)N1C[C@H]2[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])[C@H]2C1 976484501 RYPAGCACTJFAMM-DZEUPHNYSA-N 267.285 -0.365 5 20 CBBD Cc1ccnc(N[C@H]2C[C@@H](NC(=O)C(N)=O)C2)c1[N+](=O)[O-] 1059803958 MSWZOVFHJKQPHX-OCAPTIKFSA-N 293.283 -0.157 5 20 CBBD Cn1ncc(C(=O)NCCNc2ccc([N+](=O)[O-])cn2)n1 1093726489 NWFBNJPRJYTJOE-UHFFFAOYSA-N 291.271 -0.040 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@H](C)S(C)(=O)=O)c1[N+](=O)[O-] 1319685988 CMVWPTATXUIJEM-YFKPBYRVSA-N 290.301 -0.211 5 20 CBBD C[C@H]1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)[C@H]1CO 1338724917 XCPKFEQPBZJWPY-ONGXEEELSA-N 295.295 -0.014 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])cn1)NCCCN1CCNCC1 178334212 YHSLVEHJBKHOTC-UHFFFAOYSA-N 296.331 -0.797 5 20 CBBD CCN1CCN(CCNC(=O)c2cc([N+](=O)[O-])[nH]n2)CC1 285688272 VHGZJPWMDKDOIG-UHFFFAOYSA-N 296.331 -0.315 5 20 CBBD C[C@@H](NC(=O)Cn1ccc([N+](=O)[O-])n1)C(=O)NCCF 336989664 KJTMNXCBDJWSDW-SSDOTTSWSA-N 287.251 -0.618 5 20 CBBD O=c1ccc([N+](=O)[O-])cn1CCN[C@@H](CO)[C@@H]1CCCO1 447921119 JLQSDNVIMBPPGB-RYUDHWBXSA-N 297.311 -0.114 5 20 CBBD CNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C 536023303 ZEMYSCMAJSXHGB-LURJTMIESA-N 254.246 -0.202 5 20 CBBD COC(=O)[C@H]1C[C@H](O)CN(CCn2cc([N+](=O)[O-])cn2)C1 592195158 JKKBIOBMKWRSQW-ONGXEEELSA-N 298.299 -0.353 5 20 CBBD Cc1ccc([N+](=O)[O-])c(N2CCN(C(=O)CO)CC2)n1 611152643 DENKCRHUHUQVBC-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD CCN(C)C(=O)COC(=O)Cn1ccc([N+](=O)[O-])n1 746577103 JHMSACULAZJGAS-UHFFFAOYSA-N 270.245 -0.187 5 20 CBBD Cn1ncc(COC(=O)c2c([N+](=O)[O-])cnn2C)n1 802974299 OEZAJEICGRKJQI-UHFFFAOYSA-N 266.217 -0.186 5 20 CBBD CC(=O)NCC(=O)NCCNc1ncc([N+](=O)[O-])cc1C 1093455474 KZWNEFPJBCKWPI-UHFFFAOYSA-N 295.299 -0.038 5 20 CBBD NC(=O)CC(=O)NCCCNc1ccnc(O)c1[N+](=O)[O-] 1094345651 CVTMNSDUUWDZLD-UHFFFAOYSA-N 297.271 -0.511 5 20 CBBD Cc1nnc(CNC(=O)CCn2cc([N+](=O)[O-])cn2)n1C 1319804911 PKLCDPVJXSVDQT-UHFFFAOYSA-N 293.287 -0.065 5 20 CBBD Cc1nc(=NC(=O)c2c[nH]nc2[N+](=O)[O-])n(C)[nH]1 1324864190 FAIHBTLIHFFVSI-UHFFFAOYSA-N 251.206 -0.571 5 20 CBBD C[C@@](O)(CNC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)O 1589144118 AXPZOXYQFBHHEM-LLVKDONJSA-N 284.224 -0.134 5 20 CBBD O=[N+]([O-])c1cn([C@@H]2CCOC2)nc1-c1nn[nH]n1 1593487119 UZFBFFBGTMBOBQ-RXMQYKEDSA-N 251.206 -0.067 5 20 CBBD C[C@@H](O)[C@H](O)CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1604378855 NYQTZLDMBLLBHC-LHLIQPBNSA-N 298.251 -0.236 5 20 CBBD COC(=O)[C@H](CC(=O)O)NC(=O)c1ccc([N+](=O)[O-])n1C 1606324580 VALFHOOZTGIGOY-LURJTMIESA-N 299.239 -0.321 5 20 CBBD CN1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](CN)C1 124324286 JMXPEBDZMVWQFN-JTQLQIEISA-N 281.316 -0.352 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1(C(=O)O)CC1 138933769 RQHRRXBDPJRMCO-UHFFFAOYSA-N 268.229 -0.228 5 20 CBBD C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CN(C)CCO1 160621976 ZLZBDONREFTLQX-APPZFPTMSA-N 283.288 -0.233 5 20 CBBD NC(=O)CCNC(=O)Nc1ccncc1[N+](=O)[O-] 183554971 RGXJVXDMFJDQRO-UHFFFAOYSA-N 253.218 -0.013 5 20 CBBD COCCNCCNC(=O)c1n[nH]c(C)c1[N+](=O)[O-] 262176208 VVWAYGZHUDKJDG-UHFFFAOYSA-N 271.277 -0.408 5 20 CBBD C[C@@H](O)CCN(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 266512029 BMQQXPAEODFRPC-MWLCHTKSSA-N 272.305 -0.145 5 20 CBBD Cc1cnc(OCC(=O)N2CCNC(=O)C2)c([N+](=O)[O-])c1 267339923 DJJUDZUEYDKNDE-UHFFFAOYSA-N 294.267 -0.365 5 20 CBBD CC(=O)C[C@@H]1COCCN1C(=O)Cn1ccc([N+](=O)[O-])n1 273418888 XFTXPSGJPOULSH-SNVBAGLBSA-N 296.283 -0.002 5 20 CBBD C[C@H](NC(=O)c1cc([N+](=O)[O-])cnc1N)C(=O)N(C)C 350009902 KYQQZIXDWWNLLX-LURJTMIESA-N 281.272 -0.222 5 20 CBBD Cc1cccc(C(=O)NCC(=O)NCCO)c1[N+](=O)[O-] 356515538 LYMWWCZIBIIRGF-UHFFFAOYSA-N 281.268 -0.258 5 20 CBBD COC(=O)[C@H](O)CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 356726204 LCMGMGFLRVKFNC-SECBINFHSA-N 284.224 -0.436 5 20 CBBD CN(CC(C)(CO)CO)C(=O)c1cc([N+](=O)[O-])cn1C 543746537 OUCIUXLLGIAYPU-UHFFFAOYSA-N 285.300 -0.004 5 20 CBBD O=[N+]([O-])c1ncccc1S(=O)(=O)NC[C@@H](O)C(F)F 575978311 LPIAIKAMVFZYHW-RXMQYKEDSA-N 297.239 -0.106 5 20 CBBD Nc1ccc(N[C@@H]2C[C@@H](C(=O)O)C[C@H]2O)nc1[N+](=O)[O-] 595981990 ZOWOQWRWVYVMHO-LPBLVHEISA-N 282.256 0.208 5 20 CBBD COC[C@@H](NC(=O)c1cc(OC)ccc1[N+](=O)[O-])C(N)=O 760043077 KKEWOBAKGZRYSP-SECBINFHSA-N 297.267 -0.167 5 20 CBBD Cn1nnnc1COC(=O)c1cc([N+](=O)[O-])cnc1N 781669775 QLVFOCVGNGCZCU-UHFFFAOYSA-N 279.216 -0.548 5 20 CBBD C[C@@H](COC(=O)C(C)(C)NS(C)(=O)=O)[N+](=O)[O-] 813110758 ITNFTKVCVFSDLY-LURJTMIESA-N 268.291 -0.477 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)NCCCC(=O)O)n1 821298681 WIRUEXJJJVSEGR-UHFFFAOYSA-N 256.218 -0.077 5 20 CBBD CNc1nccc(C(=O)OCc2nnn(C)n2)c1[N+](=O)[O-] 848791337 YGGDJPKPPWFRJM-UHFFFAOYSA-N 293.243 -0.088 5 20 CBBD O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC(O)(CO)C1 854672085 CGOXFJOEIUIRHC-UHFFFAOYSA-N 297.223 -0.318 5 20 CBBD CC(=O)N1CCC(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 943054517 JLHZTXHNSQNQHT-NXEZZACHSA-N 255.274 -0.221 5 20 CBBD CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CN(CC(=O)N(C)C)C1 950055653 JPTHPPANUXDSJA-GHMZBOCLSA-N 298.343 -0.728 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N[C@@H]1CCN2CCC[C@H]2C1 1317997162 SSIZHSYTGCGMIM-ZJUUUORDSA-N 294.315 -0.071 5 20 CBBD C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)S(C)(=O)=O 1324393767 LSJNKVWKGRGPEK-ZETCQYMHSA-N 290.301 -0.659 5 20 CBBD NC(=O)NC(=O)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 28004890 MQYIBPNXXNOSDU-UHFFFAOYSA-N 280.196 -0.302 5 20 CBBD COC[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CCO1 78343328 RRYLZUNVOHLIOW-SSDOTTSWSA-N 269.261 -0.181 5 20 CBBD CC(C)(C)[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C(N)=O 154766290 OHEBTZMIJZRMLF-SSDOTTSWSA-N 269.261 -0.052 5 20 CBBD NC(=O)C1CCN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 174648959 UWNJQWQWFXDEBJ-NSHDSACASA-N 297.315 -0.651 5 20 CBBD CNC(=O)CNC(=O)Nc1ccncc1[N+](=O)[O-] 183614820 GIBAMYJCKCOTMU-UHFFFAOYSA-N 253.218 -0.143 5 20 CBBD CC(=O)NC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCO1 344501086 YKMSGEFPXHXXTD-SECBINFHSA-N 296.283 -0.100 5 20 CBBD Cn1nnnc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N 357102872 RSIQUCHMYZEYNJ-UHFFFAOYSA-N 295.234 -0.230 5 20 CBBD CN[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1 428449530 UDXKSHABSLUMQA-QMMMGPOBSA-N 253.262 -0.388 5 20 CBBD CNc1nc(C(=O)NCC(=O)OC)ccc1[N+](=O)[O-] 454193033 LYKLTTIAXNVTJA-UHFFFAOYSA-N 268.229 -0.066 5 20 CBBD CNc1nccc(C(=O)N2CC(=O)N[C@@H](C)C2)c1[N+](=O)[O-] 567061490 YIWDRSQQGNUZCS-ZETCQYMHSA-N 293.283 -0.008 5 20 CBBD C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCC(=O)N1 599697636 RBAYVPPNMVFBHJ-PSASIEDQSA-N 295.299 -0.178 5 20 CBBD CCOC(=O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])cn1C 611857082 DJYHXHBLKLEXRL-QMMMGPOBSA-N 285.256 -0.413 5 20 CBBD Cn1cc([N+](=O)[O-])c(C(=O)OCc2nc(O)n[nH]2)n1 775012165 PCJJQBSLNDGSLM-UHFFFAOYSA-N 268.189 -0.491 5 20 CBBD CS(=O)(=O)CCNCCn1cc([N+](=O)[O-])cn1 819176740 MWFSPTPWUIMSJX-UHFFFAOYSA-N 262.291 -0.575 5 20 CBBD O=C(NCC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)C1CC1 1000592103 YIKOHNYVFTXPQB-NXEZZACHSA-N 267.285 -0.364 5 20 CBBD COCCO[C@H]1CCN(c2nnc(C[N+](=O)[O-])n2C)C1 1121299569 PEEFDSGBKQKCKL-VIFPVBQESA-N 285.304 -0.167 5 20 CBBD Cc1nn(C)cc1CNCCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1157766963 CIMQYEFCTSMUKY-VXGBXAGGSA-N 295.343 -0.010 5 20 CBBD COCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(N)=O 1319828853 OMWKIYMPZBUWKL-ZCFIWIBFSA-N 271.229 -0.192 5 20 CBBD CN(CC1(O)CCOCC1)C(=O)c1c[nH]nc1[N+](=O)[O-] 1325610850 QBIVDLSLRMGGFO-UHFFFAOYSA-N 284.272 -0.069 5 20 CBBD C[C@@H]1OCC[C@]1(O)CNC(=O)c1c([N+](=O)[O-])cnn1C 1344097404 FAKMPLURQBUNCX-CPCISQLKSA-N 284.272 -0.402 5 20 CBBD O=C(CCn1ccnn1)OCCn1cnc([N+](=O)[O-])n1 1344644703 UAZPELZVRXOIFD-UHFFFAOYSA-N 281.232 -0.589 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H]1C[C@@H](O)C1 1348411283 JVGHBOSICCYWLJ-WAAGHKOSSA-N 281.268 -0.356 5 20 CBBD O=C(N[C@H]1CNOC1)c1cc2c(cc1[N+](=O)[O-])OCO2 1580754221 JLZNPFDRZWGBJT-LURJTMIESA-N 281.224 -0.043 5 20 CBBD C[C@@H](C[N+](=O)[O-])OC(=O)[C@H](C)n1cnc(-c2nn[nH]n2)n1 1603571652 IPKMARXQBNPCHD-WDSKDSINSA-N 296.247 -0.772 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CN3CCC2CC3)c1 37883518 RWIPLSSDLAJEDQ-STQMWFEESA-N 295.343 -0.164 5 20 CBBD Cc1cc(=O)n(CC(=O)N2CCNCC2)cc1[N+](=O)[O-] 57839077 OQZOVDDQLMLJPH-UHFFFAOYSA-N 280.284 -0.503 5 20 CBBD Nc1nc(NCC(=O)NC2CC2)ncc1[N+](=O)[O-] 76610516 YHQOAQHLPFVEOM-UHFFFAOYSA-N 252.234 -0.343 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CCOC2)c1 131563276 KGSWCONSTOOJOI-SCZZXKLOSA-N 256.262 -0.469 5 20 CBBD C[C@H]1C(=O)NCCN1C(=O)NCCn1cc([N+](=O)[O-])cn1 161500091 CHLZZFJPPALJIN-QMMMGPOBSA-N 296.287 -0.679 5 20 CBBD C[C@H]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)[C@H](C(N)=O)C1 186971000 CGSNJUHBVYALTK-IUCAKERBSA-N 295.299 -0.096 5 20 CBBD COC(=O)CNC(=O)Cn1cc([N+](=O)[O-])c(C2CC2)n1 195043727 IDOBSUCOMJQAKT-UHFFFAOYSA-N 282.256 -0.042 5 20 CBBD CCOC(=O)NCC(=O)NCCn1cc([N+](=O)[O-])cn1 269182778 KEAXPCCOYVNABX-UHFFFAOYSA-N 285.260 -0.346 5 20 CBBD CN1C[C@H]2CN(c3ncc([N+](=O)[O-])c(N)n3)C[C@H]2C1 278718253 JVKRFGRCPTWWRC-OCAPTIKFSA-N 264.289 -0.035 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@@H]1C[C@H](F)CN1 366465538 YDIIGKCPKPMPNG-IUCAKERBSA-N 298.274 -0.427 5 20 CBBD CC(CO)(CO)NC(=O)c1ccc([N+](=O)[O-])cc1O 436900436 IHJUBQJQSMDZEF-UHFFFAOYSA-N 270.241 -0.227 5 20 CBBD COC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 495717475 OSDHGOLTRDMAKS-UHFFFAOYSA-N 283.244 -0.158 5 20 CBBD CNc1nccc(C(=O)NC(C)(C)CO)c1[N+](=O)[O-] 567912053 GJKSGBAMOULMSR-UHFFFAOYSA-N 268.273 0.532 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)NCC1CCNCC1 569958821 ZZAOMRJUVUQALJ-UHFFFAOYSA-N 267.289 -0.093 5 20 CBBD CN(C)C[C@H](CO)NC(=O)CCn1cc([N+](=O)[O-])cn1 588863655 BIZLZDCHSJZIEZ-SECBINFHSA-N 285.304 -0.780 5 20 CBBD C[C@@H](CNc1ccc(N)c([N+](=O)[O-])n1)S(C)(=O)=O 596172821 MPXDJNGPSKQXKK-LURJTMIESA-N 274.302 0.417 5 20 CBBD COC[C@H](O)C(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 766149090 QAZPTTJTGGKYMF-JTQLQIEISA-N 298.251 -0.256 5 20 CBBD CC(=O)N[C@@H](C)C(=O)OCCn1ccc([N+](=O)[O-])n1 801186251 GHSSQAOCAKHMBP-ZETCQYMHSA-N 270.245 -0.141 5 20 CBBD C[C@H](COC(=O)Cn1nnc2ccccc2c1=O)[N+](=O)[O-] 813113587 GRUHQXQYZWGAHR-MRVPVSSYSA-N 292.251 0.000 5 20 CBBD CN1CN(c2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC1=O 826045326 UWLWQDWUBBDSCD-UHFFFAOYSA-N 290.243 -0.594 5 20 CBBD Cn1cnn(CCC(=O)OCC(C)(C)[N+](=O)[O-])c1=O 851129575 QCHDWTKRTDRZHT-UHFFFAOYSA-N 272.261 -0.430 5 20 CBBD CCC(=O)NCC1(O)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1074583463 FPJHGXCDFQVWIW-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD CN(CCCN(C)c1ncccc1[N+](=O)[O-])C(=O)C(N)=O 1112164938 PTWTVDKRXSCYSN-UHFFFAOYSA-N 295.299 -0.240 5 20 CBBD NC(=O)c1cccc([N+](=O)[O-])c1N1C[C@@H](CO)[C@H](CO)C1 1331312172 GSNNOIRMDNKDEL-IUCAKERBSA-N 295.295 -0.269 5 20 CBBD O=[N+]([O-])c1c(N2CC[C@@H](CO)[C@H](O)C2)ccnc1O 1333710852 XISDAIODZXVHNN-IONNQARKSA-N 269.257 -0.125 5 20 CBBD CC(C)OC[C@H](C(=O)O)N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1591710186 SMLPCIYVCWWMAS-IWSPIJDZSA-N 274.273 -0.012 5 20 CBBD CONC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 25825013 NZVIIVAIRSVJKS-UHFFFAOYSA-N 281.224 -0.002 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H](C)O 158930617 ULXGLZFSVCSDJK-ZETCQYMHSA-N 256.262 -0.013 5 20 CBBD NC(=O)NC(=O)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1 267817774 GBRYHKQMIJMYPG-UHFFFAOYSA-N 294.267 -0.162 5 20 CBBD O=C1C[C@@H](N(C(=O)c2cc([N+](=O)[O-])[nH]n2)C2CC2)C(=O)N1 286082147 TTXRGZUDAOIBAG-SSDOTTSWSA-N 293.239 -0.662 5 20 CBBD CCc1nn(C)c(N2CCO[C@@H](C(=O)NC)C2)c1[N+](=O)[O-] 302046027 KRLSGSHGPHTELR-SECBINFHSA-N 297.315 -0.158 5 20 CBBD CNC(=O)C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 330498437 BBRZGYZYGBIMJF-QMMMGPOBSA-N 293.283 -0.251 5 20 CBBD CN(C(=O)NCCn1cc([N+](=O)[O-])cn1)C1CC(O)C1 354135146 CADQOXRTKSJHFU-UHFFFAOYSA-N 283.288 -0.044 5 20 CBBD C[C@H](CC(N)=O)NC(=O)CCn1cc([N+](=O)[O-])cn1 361027899 BSGZGZBJSOFSHL-SSDOTTSWSA-N 269.261 -0.439 5 20 CBBD C[C@@H]1OC(=O)N[C@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1 496988703 YSUDCFBOZCSIPK-POYBYMJQSA-N 284.228 -0.169 5 20 CBBD O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)N1 593406363 CERYFOQURNWCNL-SECBINFHSA-N 299.308 -0.097 5 20 CBBD COC(=O)c1ccnc(N2C[C@H](O)[C@@H](O)C2)c1[N+](=O)[O-] 599125197 LUCAZOPQTMLHMR-YUMQZZPRSA-N 283.240 -0.682 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC2(C1)OCCO2 701242436 CSCGVIRPDBODLX-UHFFFAOYSA-N 282.256 -0.233 5 20 CBBD CNC(=O)COC(=O)c1cc([N+](=O)[O-])cnc1N 779104059 LDOIPVPKECGROF-UHFFFAOYSA-N 254.202 -0.525 5 20 CBBD Nc1c(C(=O)NCCn2cnnn2)cccc1[N+](=O)[O-] 807920115 DIXPRJDPHQZFJA-UHFFFAOYSA-N 277.244 -0.407 5 20 CBBD CCNC(=O)CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 855525631 FUAJVBJRZNSELE-NSHDSACASA-N 281.268 -0.120 5 20 CBBD C[C@@H]1NC(=O)[C@@H](C)N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1C 911805515 AQFWTKGSNGSMMR-OFPUPOEVSA-N 255.274 -0.225 5 20 CBBD O=C(N[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1cnon1 974114969 LWPIRTQHDWARFU-JVZYCSMKSA-N 295.255 -0.888 5 20 CBBD O=C(NC1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1)c1ccccn1 990046712 JQDSXLVZHOGWLH-MWLCHTKSSA-N 290.279 -0.313 5 20 CBBD CN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)CC(N)=O 1101537215 TXOHJAOJLYMNHN-UHFFFAOYSA-N 281.272 -0.265 5 20 CBBD C[C@H](O)C[C@@H]1COCCN1C(=O)c1c([N+](=O)[O-])cnn1C 1320414055 YYPDNUJMFNZGTG-DTWKUNHWSA-N 298.299 -0.060 5 20 CBBD CON1CCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)CC1 1328341935 WEMQBJIYUZMRRZ-UHFFFAOYSA-N 296.283 -0.538 5 20 CBBD NC(=O)N1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1 1328355187 BRCXRHLKWXZGKD-QMMMGPOBSA-N 296.287 -0.549 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2[C@H]3CNC[C@H]32)c1[N+](=O)[O-] 1579514785 WNCDVZLQLWHCOO-JIGDXULJSA-N 265.273 -0.178 5 20 CBBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1CCNC1 179071492 KIFMIIOSUURAKD-SECBINFHSA-N 267.289 -0.080 5 20 CBBD O=C(CN1C[C@@H](O)C[C@H]1CO)Nc1ccccc1[N+](=O)[O-] 186534499 LAXFLQPKVOEJIT-UWVGGRQHSA-N 295.295 -0.039 5 20 CBBD CN1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)CC1=O 263741183 AOKBNOURNOUEKD-MRVPVSSYSA-N 281.272 -0.472 5 20 CBBD O=C1NC[C@H]2CN(c3ncccc3[N+](=O)[O-])CCN2C1=O 267520099 XPCZZOHLQBDUOB-QMMMGPOBSA-N 291.267 -0.863 5 20 CBBD O=C(NN1CCOCC1)c1cnc(O)c([N+](=O)[O-])c1 277838893 RVAATBAINNTUSK-UHFFFAOYSA-N 268.229 -0.328 5 20 CBBD CCN(c1ncc([N+](=O)[O-])c(N)n1)[C@H]1CCNC1=O 281761701 RUIKALFZCGXVSY-LURJTMIESA-N 266.261 -0.318 5 20 CBBD O=C(NCCCN1CCC(O)CC1)c1cc([N+](=O)[O-])[nH]n1 285382468 CTXPHCXIELBTLP-UHFFFAOYSA-N 297.315 -0.106 5 20 CBBD CC1(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)OCCO1 285817543 RDVUNLOQERGYNZ-UHFFFAOYSA-N 256.218 -0.189 5 20 CBBD Cc1nc(N2CCN(C(=O)CO)CC2)ccc1[N+](=O)[O-] 301971825 STIBWFHRUDZAQU-UHFFFAOYSA-N 280.284 -0.061 5 20 CBBD NC(=O)CN1CCN(c2ccc([N+](=O)[O-])c(N)c2F)CC1 356191063 LOUMLHWVTIIFCD-UHFFFAOYSA-N 297.290 -0.077 5 20 CBBD COC(=O)[C@@](C)(O)CNC(=O)c1cccc([N+](=O)[O-])c1N 358908888 UGXRKCOSGCYFNW-LBPRGKRZSA-N 297.267 -0.169 5 20 CBBD C[C@H]1CO[C@H](CO)CN1Cc1c([N+](=O)[O-])ncn1C 361685454 FAIWDTDRSPFYSV-IUCAKERBSA-N 270.289 -0.090 5 20 CBBD C[C@H]1CS(=O)(=O)CCN1Cc1c([N+](=O)[O-])ncn1C 408259414 LBLBWXMRZKGROA-QMMMGPOBSA-N 288.329 -0.053 5 20 CBBD CNC(=O)NC(=O)Cn1c(C)c([N+](=O)[O-])ccc1=O 436473404 IQGCLXALZCTKRR-UHFFFAOYSA-N 268.229 -0.479 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])C(=O)NCCN(C)C 563732673 MOUDWOZWOFEDCN-ZETCQYMHSA-N 298.303 -0.886 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)N[C@H](C(=O)O)C1CC1 574282111 YQXDZSFNLKQOAX-VIFPVBQESA-N 297.271 -0.046 5 20 CBBD CC(=O)NCCN(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 576277139 QPMJWYGMCIIXDQ-NSHDSACASA-N 285.304 -0.780 5 20 CBBD CC1(C(N)=O)CN(c2ncc([N+](=O)[O-])c(N)n2)C1 591959373 BOCUVGLQZVZSPD-UHFFFAOYSA-N 252.234 -0.721 5 20 CBBD O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H](O)C1CC1 597410523 OLDLPGWFDDLQFX-SECBINFHSA-N 254.246 -0.322 5 20 CBBD CO[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CCO1 619249913 ZAZKYMDAMWDUOF-SNVBAGLBSA-N 270.245 -0.377 5 20 CBBD C[C@@H]1CN(C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCN1C 743272075 MANSSKMJJGVFOF-PWSUYJOCSA-N 283.332 -0.212 5 20 CBBD COC[C@H](NC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C(N)=O 760066101 UJLOIBZLYUMJHX-QMMMGPOBSA-N 297.267 -0.167 5 20 CBBD O=C(O)[C@H](O)C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 833770432 GFDOIXWCYKQCHG-LLVKDONJSA-N 298.299 -0.051 5 20 CBBD O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCCN(Cc2cnon2)CC1 981138437 SFCGPZAEKBGUMH-GHMZBOCLSA-N 295.299 -0.231 5 20 CBBD O=C(Cn1cnc([N+](=O)[O-])n1)N1CC[C@H](n2cccn2)C1 1324370209 KPFHZXDISCIZRA-VIFPVBQESA-N 291.271 -0.144 5 20 CBBD O=C(O)[C@]1(C(=O)Nc2cc([N+](=O)[O-])n[nH]2)CCCO1 1574633107 KAUJRRSOXCIYRM-SECBINFHSA-N 270.201 -0.110 5 20 CBBD COC(=O)[C@H](CO)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1 35160441 UZYPXIMOMBYSNJ-QMMMGPOBSA-N 298.251 -0.133 5 20 CBBD NS(=O)(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1 48976598 HZZFPQJOQYCWQP-UHFFFAOYSA-N 287.301 -0.685 5 20 CBBD NC(=O)CN1CCN(c2ccc([N+](=O)[O-])cn2)CC1 49320724 MWANHONDJVAHCT-UHFFFAOYSA-N 265.273 -0.403 5 20 CBBD CCNC(=O)CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 61924539 CJCHYZFBJXNOON-UHFFFAOYSA-N 294.267 -0.214 5 20 CBBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCCCO 120467745 LKOAESQVPWVDED-UHFFFAOYSA-N 281.268 -0.177 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCO[C@@H](CO)C1 168332732 YWUSKOIZCKTXFZ-MRVPVSSYSA-N 270.245 -0.989 5 20 CBBD NC(=O)[C@@H](O)CNC(=O)Cc1ccccc1[N+](=O)[O-] 227872807 DAOWIPIKKRKZGB-VIFPVBQESA-N 267.241 -0.900 5 20 CBBD CN1CC[C@@H]2OCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])[C@H]2C1 285642837 FLVBLHBFVKPUGN-UWVGGRQHSA-N 295.299 -0.137 5 20 CBBD O=C(NC[C@@H](O)C(F)(F)F)c1cc([N+](=O)[O-])[nH]n1 287468208 MGZSIZURLDUJHW-SCSAIBSYSA-N 268.151 -0.029 5 20 CBBD Cc1cn(CC(=O)N[C@H](C)C(=O)N(C)C)nc1[N+](=O)[O-] 337939336 RMTKEKHKZHFOKP-MRVPVSSYSA-N 283.288 -0.307 5 20 CBBD CCn1cc(S(=O)(=O)N[C@@H]2CCOC2)c([N+](=O)[O-])n1 339046358 CVSOCUXFZKLJOV-SSDOTTSWSA-N 290.301 -0.122 5 20 CBBD C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)n1cncn1 348564220 SCVNJKIGRKVONN-MRVPVSSYSA-N 279.260 -0.240 5 20 CBBD O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCn2ncnc2C1 354886990 DRXRXWNRTXRFFR-UHFFFAOYSA-N 263.217 -0.435 5 20 CBBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC[C@H](O)C(F)F 355151693 ICYKQAWHCSYKHU-ZETCQYMHSA-N 291.210 -0.501 5 20 CBBD NC(=O)c1ccnc(NCCc2cnccn2)c1[N+](=O)[O-] 357484676 RNXYJJUSSDDOHL-UHFFFAOYSA-N 288.267 0.533 5 20 CBBD NC(=O)CNC(=O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 505362160 LTRXNDXICWURQB-UHFFFAOYSA-N 295.251 -0.490 5 20 CBBD CC(=O)N1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1 547751697 CDVHQSHSQRDWDH-UHFFFAOYSA-N 267.245 -0.378 5 20 CBBD Cc1[nH]nc(C(=O)NC[C@@H]2CNCCN2C)c1[N+](=O)[O-] 575802863 WRMNCWKCQCXPPM-QMMMGPOBSA-N 282.304 -0.740 5 20 CBBD Cn1ncc([N+](=O)[O-])c1C(=O)N1CCO[C@@H]2C[C@@H]21 590433967 XTEVZGZJJFXLPI-POYBYMJQSA-N 252.230 -0.058 5 20 CBBD NC(=O)c1cc(N(CCO)CCCO)ccc1[N+](=O)[O-] 596137540 LOJVXAXXQMHIKK-UHFFFAOYSA-N 283.284 -0.125 5 20 CBBD O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H](CO)CC(F)F)c1 717712344 IYWCQJHRJMTPEM-APPZFPTMSA-N 294.258 -0.242 5 20 CBBD CN1CC[C@H](C(=O)OCCn2cc([N+](=O)[O-])cn2)C1=O 772514980 USDYJHADATWVRO-VIFPVBQESA-N 282.256 -0.187 5 20 CBBD COC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H](C)O1 839734574 SKHHXFGGWYOEEC-UTINFBMNSA-N 258.274 -0.086 5 20 CBBD CN1CCN(C)[C@H](CNc2c([N+](=O)[O-])cnn2C)C1 892467662 KCARCXMSNOFGQK-SECBINFHSA-N 268.321 -0.014 5 20 CBBD C/C=C(\C)C(=O)N(CCO)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 1057304570 XHALEQIPZVEHNV-VIXUHMKYSA-N 299.327 -0.445 5 20 CBBD CCC(=O)NC1(CO)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 1080642364 ZJOOWYULOVIHFR-NXEZZACHSA-N 299.327 -0.469 5 20 CBBD Cn1cc([C@H](CO)NC(=O)c2n[nH]cc2[N+](=O)[O-])cn1 1116502803 CYTDSPMOUKUHIQ-ZETCQYMHSA-N 280.244 -0.485 5 20 CBBD C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])c1ncn(C)n1 1256712340 GQVGHFHWQMARAU-YFKPBYRVSA-N 265.233 -0.063 5 20 CBBD O=C(Cn1ccc([N+](=O)[O-])n1)N1CCS(=O)(=O)CC1 1318284749 NKSTXNROIZITST-UHFFFAOYSA-N 288.285 -0.952 5 20 CBBD C[C@@H](O)CN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H](C)CO 1320923815 VRZRMYJCWXTFIM-HTQZYQBOSA-N 286.288 -0.468 5 20 CBBD O=[N+]([O-])c1ncn(Cc2nnn(CC(F)(F)F)n2)n1 1339875110 NZHYNYOVNCXJGB-UHFFFAOYSA-N 278.154 -0.217 5 20 CBBD O=C(O)[C@@H](O)CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 1601523323 DJEBATXCOHXHLD-DTWKUNHWSA-N 284.224 -0.810 5 20 CBBD O=C(N[C@H](C(=O)O)C1CC1)c1n[nH]cc1[N+](=O)[O-] 1608384871 WXPMZGVXFROZOI-LURJTMIESA-N 254.202 -0.089 5 20 CBBD