smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COc1cc2c3c(c1)O[C@@](C)(C(=O)CBr)[C@@H](C2)C3=O 587414743 ODBBFLINHLWCOT-LKFCYVNXSA-N 325.158 2.165 50 1 EEGF Cc1nc(C(=O)NNC(=O)c2cccc(OC(F)(F)F)c2)cs1 1857647807 OLADYJLMRDZFKL-UHFFFAOYSA-N 345.302 2.425 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@@H](OCC(C)C)[C@@H]12 2356473208 XIQILJDZEXJZIC-OWSLCNJRSA-N 334.412 2.352 50 1 EEGF COC(=O)N/N=C/c1ccc2c(c1)[n+](=O)c1cc(C)c(C)cc1n2O 27299163 CZSMRXARIXTLDU-GIJQJNRQSA-O 341.347 2.253 50 1 EEGF N#CC1=C(SCC(N)=O)NC2=C(CCCC2)C1=C1C=CC(=O)C=C1 13126688 HMVUEXNSORIJDT-UHFFFAOYSA-N 339.420 2.363 50 3 EEGF Cc1c(C(=O)N/N=C/c2ccccc2)nnn1Nc1ccc(F)cc1 72116591 WZMKETCHSGIHIN-YBFXNURJSA-N 338.346 2.365 50 1 EEGF CN(C)CCSSCCNC(=O)[C@@H]1Cc2ccccc2N1 618007793 IJMOKDGBHURCKY-AWEZNQCLSA-N 325.503 2.082 50 1 EEGF COC1=CC=C/C(=C\NNC(=O)CSc2ccccc2C)C1=O 13119020 CEWUDVJITWUETB-JLHYYAGUSA-N 330.409 2.261 50 3 EEGF Cc1cc(=O)oc2cc(OCC(=O)NNCc3ccccc3)ccc12 1911579397 XMSOARCPGLXWKK-UHFFFAOYSA-N 338.363 2.301 50 1 EEGF COc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC3)cc(OC)c1OC 653822637 IUCXIBKYUFRZFX-OAHLLOKOSA-N 342.351 2.137 50 1 EEGF CCO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@]1(C)O)[C@]42OO3 136949832 QEZXEMZAZAJVRG-PNSVTYJHSA-N 328.405 2.346 50 1 EEGF CC1(C)[C@@H](Br)[C@@H](O)C[C@]2(O)C[C@@](C)(O)[C@@H]3CC[C@]12C3 200688868 MWFIODJGZKGRJI-FWRNSZFQSA-N 333.266 2.213 50 1 EEGF N#CC1=C2C3=CC=C(N4CCSCC4)C4=CC=C[C@@H](C2=NC1=O)[C@H]43 1857579953 GESSOJAUHWSJSK-CZUORRHYSA-N 333.416 2.403 50 1 EEGF O=[P@@]1(N(CCCl)CCCl)OCC[C@H](O)N1CCCl 29318974 RAXABQCFPAWRSY-YYSFKGJASA-N 339.587 2.154 50 1 EEGF COc1ccc(COC(=O)NNC(=S)c2ccc(O)cc2O)cc1 103194639 ZEKLFLWTSUHKMY-UHFFFAOYSA-N 348.380 2.213 50 1 EEGF CC1(C)[C@H](Br)[C@H](O)C[C@@]2(O)C[C@](C)(O)[C@H]3CC[C@]12C3 2356535051 MWFIODJGZKGRJI-MDNLKKFLSA-N 333.266 2.213 50 1 EEGF COc1ccc2c(c1)Cc1c-2n[nH]c1C(=O)N/N=C/c1ccc(O)cc1 1857562612 DYCVMBDVIZTBCI-KEBDBYFISA-N 348.362 2.459 50 1 EEGF CC(=NNC(N)=O)c1c(O)n(-c2ccccc2)c2ccccc2c1=O 2356811704 BQCIMLGXYMKGHU-UHFFFAOYSA-N 336.351 2.089 50 1 EEGF COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(C(=O)NN)cc3[nH]2)cc1 587935141 GMTLZMKYQLRZBX-QLJPJBMISA-N 340.383 2.012 50 1 EEGF N#CC1=C(N)[C@@H]2Cc3ccc(OCN4CCCC4)cc3O[C@@H]2CC1=N 34804518 VYKFPPSJVIFFTC-RDTXWAMCSA-N 338.411 2.198 50 1 EEGF CC(C)CSC[C@@H](N)[C@H](O)C(=O)NNc1cccc2ccccc12 27985198 GFWQFAPFMCBSHM-WBVHZDCISA-N 347.484 2.360 50 1 EEGF COc1ccccc1[C@@H]1[C@H](Cl)C(=O)N1NC(=O)Cc1ccccc1 1632065 HCZAJKQTRNGOQV-DLBZAZTESA-N 344.798 2.460 50 1 EEGF O=C(CCCCc1ccc(F)cc1)NNCc1ccc(O)c(O)c1O 1772643671 UFAOOOXRKXGDQK-UHFFFAOYSA-N 348.374 2.476 50 1 EEGF O=S(=O)(CCCl)N/N=C(\c1ccccc1)c1ccc(O)cc1 1857619989 RXEGCWQUNPTZJE-BMRADRMJSA-N 338.816 2.303 50 1 EEGF CC(=O)N(C)/N=N/c1nc(OCc2ccccc2)c2nc[nH]c2n1 5801368 WKJSBMAVXWVXPC-QZQOTICOSA-N 325.332 2.409 50 1 EEGF CC1(C)[C@@H](Br)[C@@H](O)C[C@@]2(O)C[C@](C)(O)[C@H]3CC[C@]12C3 2356535053 MWFIODJGZKGRJI-SFUQCAKLSA-N 333.266 2.213 50 1 EEGF O=C(N/N=C/c1ccc2c(c1)OCO2)c1nc(-c2ccccc2)no1 95578356 HNAFDDJAGWMBEH-GIJQJNRQSA-N 336.307 2.229 50 1 EEGF CC(C)(F)[C@H](Br)c1nc2ccc(C(=O)NN)cc2[nH]1 587086970 KNWZRLVUDHEKEF-SECBINFHSA-N 329.173 2.351 50 1 EEGF CN(C)CCSSCCNC(=O)c1ccc2nc(O)oc2c1 618011814 UMQYOZLNVDVPPQ-UHFFFAOYSA-N 341.458 2.206 50 1 EEGF N#CS/C(=C1\NCCN1Cc1ccc(C(F)(F)F)nc1)[N+](=O)[O-] 103160036 XLVWUSWEMYYQEZ-ZHACJKMWSA-N 345.306 2.123 50 1 EEGF CC(C)(O)[C@H]1CC[C@@](C)(N=C=S)[C@H]2CC[C@@]3(C)O[C@H](O)[C@]12O3 2356388191 WAWKSTXGMZGGDY-DHUIQQBUSA-N 327.446 2.259 50 1 EEGF O=C(N/N=C/c1cc(Cl)ccc1[N+](=O)[O-])c1cc(O)cc(O)c1 1857591825 SHVOVDZAPUJUKF-FRKPEAEDSA-N 335.703 2.423 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@]24OO3 169358359 VCMOVYRZBUORCV-YYNGKKJCSA-N 328.405 2.202 50 1 EEGF NC(N)=Nc1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2Cl)cc1 6535427 ICWKFRVMKDUCSO-UHFFFAOYSA-N 334.719 2.372 50 1 EEGF CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@@H](O)[C@H]1Br 29135446 DIBKKQIYKZQPKG-TZMCWYRMSA-N 337.169 2.253 50 1 EEGF C#C/C=C/C[C@H]1O[C@@H]2C[C@@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 114629756 NOYIFPKKLJWDFK-YFMCNMDQSA-N 329.234 2.415 50 1 EEGF CC(=O)c1ccc(NCc2ccc3sc(B(O)O)cc3c2)cc1 170095958 HSPMSGHIXSXVHR-UHFFFAOYSA-N 325.198 2.396 50 1 EEGF Cc1cc(=O)nc(NN2[C@@H](c3ccc(Cl)cc3)C(=O)[C@H]2Cl)[nH]1 17218997 UKZGBTCOHPEUIE-AAEUAGOBSA-N 339.182 2.250 50 1 EEGF C#CC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H]([C@@H](O)CC)C[C@H]2O1 2356808289 YQCPBXPXSQPWLE-WCBJTDJXSA-N 329.234 2.415 50 1 EEGF COC(=O)[C@]1([C@@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 587371473 DXHXYLUGIOWIEV-XLKFXECMSA-N 342.189 2.238 50 1 EEGF C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N/NC(=O)c1ccccn1 6014410 LITRKAVTZSYDIJ-BKUYFWCQSA-N 339.399 2.282 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 5759777 NTXXGPYGMQQSML-FKAFAWJWSA-N 328.320 2.183 50 1 EEGF endogenous,in-man CO[C@H]1OC=C(C(=O)OC(C)C)[C@H]2CC=C(C=O)CCCC(=O)[C@H]12 1857608443 VMSDEECJKFTTFS-QBIMZIAESA-N 336.384 2.325 50 1 EEGF N#CC1=C(NC(=S)Nc2ccccc2)NC(=S)N2CCC[C@H]12 103152781 SSPCCYFXOASGKF-GFCCVEGCSA-N 329.454 2.061 50 1 EEGF N[C@]1(C(=O)O)CCc2cc(N(CCCl)CCCl)ccc2C1 49777007 VSVFEHBWXVVJJD-OAHLLOKOSA-N 331.243 2.241 50 1 EEGF Cc1ccc(C(N)=O)cc1NC(=O)CCSSCCN(C)C 618007644 JMRLLLPTJMFVQR-UHFFFAOYSA-N 341.502 2.366 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOC[C@H]1Br)O2 587372292 KCMKWSNWMGGNOY-OCCSQVGLSA-N 326.190 2.465 50 1 EEGF N#C/C(=C\c1cc(O)c(O)c([N+](=O)[O-])c1)c1nc(C(=O)O)cs1 1857546683 WOVCYGKCVAQWQM-LREOWRDNSA-N 333.281 2.225 50 1 EEGF O=C/C=C\c1cc(O)c2c(c1)[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 13312762 CGSLPFBMGQUTKF-GNNPJONSSA-N 328.320 2.225 50 1 EEGF endogenous,in-man Cc1ccc2oc(=O)cc([C@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)c2c1 1772650653 IHPTZXIYRZMODP-INIZCTEOSA-N 334.335 2.351 50 1 EEGF COC1=CC=C/C(=C\NNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1=O 13121658 ZTMFOBODWMTGNW-CMDGGOBGSA-N 349.730 2.036 50 3 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@@]2(C)CC2=C(C(=O)OC2=O)[C@H](CC)C1 2356337068 UQDSFYQHSIUJQU-VOQFUICPSA-N 332.352 2.229 50 1 EEGF CCCOc1ccc(C(=O)N/N=C/c2ccc3c(c2)no[n+]3[O-])cc1 96928464 CBLHVKIQJGAGFA-WOJGMQOQSA-N 340.339 2.014 50 1 EEGF O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 1020943 BRSVWLGHMWMMJS-LICLKQGHSA-N 327.296 2.130 50 3 EEGF CCCCO[C@@H]1C=CC(=O)[C@@H](Cn2cc(CCCCl)nn2)O1 169353698 UNWXYSZFTJIYLD-CABCVRRESA-N 327.812 2.116 50 1 EEGF CCO[C@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@@]24OO3 195311734 WFIMQBUUYYWZTM-RFTJEHFWSA-N 328.405 2.202 50 1 EEGF CCOC(=O)C[C@@H]1CC[C@@]2(OCCC[C@@H]2CC(=O)OCC)OO1 299827370 GHPFIDWYRPTEMF-DVOMOZLQSA-N 330.377 2.126 50 1 EEGF NNC(=O)c1ccc2nc(C[C@H](N)c3ccccc3Cl)[nH]c2c1 587056055 GWSOZAJCONKPFB-LBPRGKRZSA-N 329.791 2.062 50 1 EEGF C=C(C)[C@@H]1CC[C@]23CO[C@@]4(OO2)C2=C(C(=O)C(C)=C[C@@H]1[C@@H]23)[C@H](O)[C@H]4C 102022743 AINNPETUGJFTND-MBLPLMDASA-N 344.407 2.468 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@H](CO)[C@H](c1ccc(O)c(O)c1)O2 2356549957 NTXXGPYGMQQSML-MSOLQXFVSA-N 328.320 2.183 50 1 EEGF COCc1cc(/C=N\NC(=O)COc2ccccc2)ccc1OC 33309705 OROPOZOOEUTDJW-ODLFYWEKSA-N 328.368 2.371 50 3 EEGF Cc1nc2cc(Cl)c(Cl)cc2n1Cc1ccc(B(O)O)cc1 653692032 LVIQYYPUDNLIKI-UHFFFAOYSA-N 334.999 2.380 50 1 EEGF O=C(CSc1nnc(-c2ccncc2)o1)N/N=C/c1ccccc1 103232054 XFCRGVUGTAVDQV-VCHYOVAHSA-N 339.380 2.374 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]1(C)O)[C@@]24OO3 195300617 QEZXEMZAZAJVRG-JXCOKUMFSA-N 328.405 2.346 50 1 EEGF COc1ccc(OC)c(CNC(=O)CCSSCCN)c1 618007953 VIHBZAAWTMFKQA-UHFFFAOYSA-N 330.475 2.050 50 1 EEGF CC1=CC(=O)/C(=C/NNC(=O)CO/N=C(\C)c2cccs2)C=C1 13118850 FNKHPGGYOGLDBL-TYZGEJJWSA-N 331.397 2.079 50 3 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@@H]1c1ccccc1O 1632056 OWSHVQCLIWFXCE-CVEARBPZSA-N 330.771 2.157 50 1 EEGF CCCN1N=C[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@@H](Cl)C1=O 587423307 WODSKEVBVQPWIM-XQAQDONZSA-N 348.786 2.027 50 1 EEGF N#Cc1cc(Cl)c2[nH]c(CCNC(=O)CBr)nc2c1 586970891 IAWPYQUYCWGICV-UHFFFAOYSA-N 341.596 2.142 50 1 EEGF COc1ccc(CC(=O)NNC(=O)Nc2ccccc2OC)cc1 10403584 OYYQUCCQCRJOOF-UHFFFAOYSA-N 329.356 2.099 50 1 EEGF O=C/C=C\c1cc(O)c2c(c1)[C@@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 13312758 CGSLPFBMGQUTKF-HTKFMBLPSA-N 328.320 2.225 50 1 EEGF endogenous,in-man C#C/C=C\C[C@H]1O[C@@H]2C[C@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 238787565 NOYIFPKKLJWDFK-FPZONJSYSA-N 329.234 2.415 50 1 EEGF COc1ccc2c(c1)C[C@@H](c1nc3ccc(C(=O)NN)cc3[nH]1)CC2 587947661 ZRFQFVYXJSGXOY-LBPRGKRZSA-N 336.395 2.448 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@H](Br)[C@H](C[C@@H]2O[C@H]2CC)O1 2356508116 CDQFURANXHAJLL-LZXPERKUSA-N 329.234 2.415 50 1 EEGF COc1ccc(/C=N/NC(=O)c2c[nH]c3c(F)cccc3c2=O)cc1 653861108 XVMMKZDGNGMHGI-ZVBGSRNCSA-N 339.326 2.440 50 1 EEGF Cc1nc(NC(=S)Nc2ccc(F)cc2)sc1C(=O)NN 103242848 IUPSYMCEYXMOMO-UHFFFAOYSA-N 325.394 2.003 50 1 EEGF COC1=C/C(=C/NNC(=O)NC23CC4CC(CC(C4)C2)C3)C=CC1=O 13122757 OALYJCXCSDSDJQ-VAWYXSNFSA-N 343.427 2.312 50 3 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@]2(C)CC2=C(C(=O)OC2=O)[C@@H](CC)C1 2356337066 UQDSFYQHSIUJQU-LXIMFEHMSA-N 332.352 2.229 50 1 EEGF O=C(Cc1ccc(Br)cc1)O[C@@H]1CS[S@](=O)C1 96283346 RGXGCYKBODEBNH-BMLIUANNSA-N 335.244 2.314 50 1 EEGF CC(=NNC(=O)c1ccccc1CO)c1cc2ccccc2oc1=O 1081818900 IBTJADNZCNIWGZ-UHFFFAOYSA-N 336.347 2.439 50 1 EEGF biogenic CN(C)S(=O)(=O)c1cc(NC(=O)CCl)ccc1C(F)(F)F 1857559217 DRRQLXBFQLEVCU-UHFFFAOYSA-N 344.742 2.133 50 1 EEGF C=C1C[C@H](O)[C@H](Br)C(C)(C)[C@@]12C=C[C@@](O)(CO)CC2 2356824595 GWKDEWRFZLOGGJ-NZBPQXDJSA-N 331.250 2.157 50 1 EEGF CCCCN(N=O)C(=O)Nc1ccc([C@H]2CC(=O)N(C)C2=O)cc1 5783468 KUEAUGOGAMLKAF-CYBMUJFWSA-N 332.360 2.474 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C(N)=O)co1)O2 587371227 FAWYYVBZXWLKMR-INIZCTEOSA-N 334.759 2.369 50 1 EEGF CC1(C)CC(O/C(O)=N\P(=O)(N2CC2)N2CC2)CC(C)(C)N1[O] 101965747 HWONODXXNAAZNZ-UHFFFAOYSA-N 345.360 2.023 50 1 EEGF O=C(CN1C(=O)c2ccccc2C1=O)N/N=C/c1ccc(Cl)cc1 96930171 ONRUZPNEMSIPDP-DJKKODMXSA-N 341.754 2.086 50 1 EEGF O=C/C=C/c1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](CO)O2 34175444 SDDXIQONGFZHJH-QLJMBOKNSA-N 328.320 2.183 50 1 EEGF CCOC(=O)C(=O)[C@@H](Cl)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 587371190 DSJMSPNAFBNHFS-GDBMZVCRSA-N 339.775 2.041 50 1 EEGF O=C(NO)C1CCC2(CC1)OOC1(OO2)C2CC3CC(C2)CC1C3 473117970 JGYAFMVNSFZGDK-UHFFFAOYSA-N 339.388 2.441 50 1 EEGF NNC(=O)c1ccc2nc(-c3cnc4c(F)cccc4c3N)[nH]c2c1 587175770 AYSICAHGKIMIOM-UHFFFAOYSA-N 336.330 2.103 50 1 EEGF CC1=NN(c2ccccc2)C(=O)/C1=C/NNC(=O)c1ccccc1F 103767887 WWNKHMRVLNBROA-RVDMUPIBSA-N 338.342 2.367 50 3 EEGF C[N+]1(C)CCN(C[Si](O)(c2ccccc2)C2CCCCC2)CC1 195752431 GBISIIAKUATURW-UHFFFAOYSA-N 333.572 2.097 50 1 EEGF in-vitro NNC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)c1ccccc1 3654259 AHYSABJOPKIPCK-UHFFFAOYSA-N 349.799 2.258 50 1 EEGF CCOc1c(/C=N\NC(=O)c2ccncc2)cccc1CN(C)C 103223904 FZJPPSDLOUFDNY-NDENLUEZSA-N 326.400 2.306 50 1 EEGF O=C(O)CCC(=O)O[C@]12CCCC[C@@H]1[C@H]1CCCC[C@@]1(O)OO2 253633740 NMOQQEQDHSENLC-BHTHQVBYSA-N 328.361 2.122 50 1 EEGF COC(=O)Nc1ccc(-c2nc3cc(C(=O)NN)ccc3[nH]2)cc1 587243316 JGFWMYFHOWIPHV-UHFFFAOYSA-N 325.328 2.012 50 1 EEGF O=C(N/N=C/c1cn(-c2cccc(Cl)c2)nn1)c1ccncc1 72181496 WDUXSLYMFJGDCP-GIJQJNRQSA-N 326.747 2.080 50 1 EEGF Cc1ccc(/C=N/NC(=O)Cn2ncc3cc([N+](=O)[O-])ccc32)cc1 64503804 SGRCLFHZKBSYIO-GIJQJNRQSA-N 337.339 2.403 50 1 EEGF CCOC(=O)CC/C(=N\NC(N)=O)c1ccc(OC)c(Cl)c1 36386578 BTAURXSETOTVBM-GZTJUZNOSA-N 327.768 2.064 50 3 EEGF O=C/C=C\c1ccc2c(c1)O[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 5759776 NTXXGPYGMQQSML-QHNPVBQMSA-N 328.320 2.183 50 1 EEGF endogenous,in-man CC(=O)NNc1cc2[nH]c3c(c4n[nH]c(=O)c(c1)c24)CCCCC3 150095013 QGXROUUSCXGMPS-UHFFFAOYSA-N 325.372 2.136 50 1 EEGF CC/N=C1\C[C@@H]2Oc3cc(O)c(O)cc3C[C@@H]2C(NCC)=C1C#N 169718724 HJAILSWFRFAYEF-XUVBVORNSA-N 327.384 2.269 50 1 EEGF CC(C)(O)[C@H]1CC[C@@](C)(N=C=S)[C@H]2CC[C@@]3(C)O[C@@H](O)[C@]12O3 2356388194 WAWKSTXGMZGGDY-ZILWLKBJSA-N 327.446 2.259 50 1 EEGF C/C(=N/NC(=O)[C@H](C)Oc1ccc([N+](=O)[O-])cc1)c1ccccn1 6556161 YUZAKZNLTPXJGT-SJWFJVLYSA-N 328.328 2.298 50 1 EEGF CCCC[C@@H](/C=N/NC(=O)N1CCOCC1)NC(=O)OC(C)(C)C 28569537 LOTRMFMPZMRMGH-VLURKWGBSA-N 342.440 2.098 50 1 EEGF COc1ccc([C@@H]2C[C@]34OO[C@](C)(C=C3C(=O)O2)[C@@H](C)O4)cc1OC 96934021 KPWNQLYPOLDXNU-OSFLCWLCSA-N 348.351 2.454 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)c(O)c1 95808917 XXEGTTLRCBSDQC-LDADJPATSA-N 336.388 2.365 50 1 EEGF C#CC=CC[C@@H]1O[C@H]2C[C@H]1O[C@H](CC)[C@H](Br)C[C@@H]2O 2356501086 NOYIFPKKLJWDFK-BYGOPZEFSA-N 329.234 2.415 50 1 EEGF CCOC(=O)[C@@H](Cl)c1nc2nc(O)nc(O)c2cc1C(C)C 587365849 HWNGDKGTQMUMOV-VIFPVBQESA-N 325.752 2.402 50 1 EEGF COc1cc2c3c(c1)O[C@]1(CCOC[C@H]1Br)[C@@H](C2)C3=O 587416691 CGGQWFRWCHEPHX-JVLSTEMRSA-N 339.185 2.365 50 1 EEGF Cc1nnsc1C(=O)N/N=C/c1c(Cl)c2ccccc2oc1=O 1772592845 VKECZGGRTDWCCM-OMCISZLKSA-N 348.771 2.370 50 1 EEGF COBN1CC[C@@H](Cl)[C@H]1CCCc1ccc(C(=O)OC)s1 2356704739 GFUALJXBCRMIQS-VXGBXAGGSA-N 329.658 2.452 50 1 EEGF COc1ccc(C(=O)NCCSSCCN(C)C)cc1OC 618008388 ZPUHQLFIRPGTQQ-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF COc1cc2c3c(c1)O[C@]1(C=NN(C(C)C)C(=O)[C@@H]1Cl)[C@@H](C2)C3=O 587422189 SDAJNBARJNRRMX-XNJJOIOASA-N 348.786 2.025 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=NN(C(C)C)C(=O)[C@@H]1Cl)O2 587382095 NROLNGPUZOTXLO-HOCLYGCPSA-N 335.791 2.125 50 1 EEGF C=C(C)C(=O)O[C@@H]1CC(C=O)=CCC[C@]2(C)O[C@@H]2[C@H]2OC(=O)C(=C)[C@@H]21 2356562080 NGGWPCQJJXMSHR-FDQIELQPSA-N 346.379 2.039 50 1 EEGF CNCCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 43919879 UZPOTTLIUZBCEZ-QOBNMGNYSA-N 341.448 2.430 50 1 EEGF O=C(N/N=C\c1coc2ccccc2c1=O)c1cccc([N+](=O)[O-])c1 33340114 CYNDOHUWRYPYCT-NVMNQCDNSA-N 337.291 2.465 50 1 EEGF CCCCC(=O)N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 38205073 OOEPNUKMLXNQBF-ATVHPVEESA-N 334.376 2.072 50 1 EEGF CCOC(=O)c1[nH]c2ccccc2c1CNNC(=O)c1ccncc1 653769916 GLMXXTGEWQYXQY-UHFFFAOYSA-N 338.367 2.174 50 1 EEGF O=C(CBr)NCCc1nc2cc(F)c(F)c(F)c2[nH]1 586970431 AQCZXLRDCMLVBZ-UHFFFAOYSA-N 336.111 2.034 50 1 EEGF NNC(=O)c1ccc2nc([C@@H](N)Cc3ccccc3Cl)[nH]c2c1 587058131 DMPLONSTVPVSJL-LBPRGKRZSA-N 329.791 2.062 50 1 EEGF Cc1nn(C)c2c1[C@@H](c1ccc(-n3ccnc3)cc1)C(C#N)=C(N)O2 1772649294 KRCBRQYKLGVCAS-INIZCTEOSA-N 332.367 2.132 50 1 EEGF NC[C@@H](Cc1ccc(Cl)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 587071249 YAFSZAVCCBWZMH-GFCCVEGCSA-N 343.818 2.105 50 1 EEGF C[n+]1ccc(C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1 13556306 SSTLNZAIXMDGHU-UHFFFAOYSA-O 325.175 2.287 50 1 EEGF COC(=O)c1cccc(N2N=C3COC(C)(C)C=C3C(C#N)=C2N)c1 13838682 YTFKSIHKRPBTRH-UHFFFAOYSA-N 338.367 2.078 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@@]24OO3)[C@@]1(C)O 169358883 QEZXEMZAZAJVRG-KBCDKLAWSA-N 328.405 2.346 50 1 EEGF COc1ccc(-n2nnn(C/C(C#N)=C/c3ccccc3)c2=O)cc1 98082581 BOYFPHKRMMXXKV-RVDMUPIBSA-N 333.351 2.045 50 1 EEGF COc1cc(/C=C(\C#N)C(N)=O)cc(CSc2ccccn2)c1O 13833848 ALDCNHLMTCRENB-WUXMJOGZSA-N 341.392 2.480 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C)C(=O)C[C@@H]([C@H]1C)[C@@]42OO3 169364896 CTFKREBDWZQSCT-SRBLVAOZSA-N 326.389 2.410 50 1 EEGF COC(=O)[C@@H](Cl)[C@@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 587381238 DLNSKNRWGAJHRK-BXUZGUMPSA-N 333.718 2.327 50 1 EEGF CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N/N=C/c1ccccc1 13554699 OLHQJXCIPBJPCN-VVJWVBNBSA-N 348.406 2.365 50 3 EEGF O=C(CCl)Nc1ccc2c(c1)C(=O)c1nc3ccccc3c(=O)n1-2 26385331 PFYWIAHLKCURGM-UHFFFAOYSA-N 339.738 2.107 50 1 EEGF N#CC(C(=O)COC(=O)c1ccc(O)cc1)=C1Nc2ccccc2N1 3266813 WFZFROLMYINXRE-UHFFFAOYSA-N 335.319 2.391 50 3 EEGF C=C(C=O)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(COC(C)=O)=C2[C@@H]1OC(C)=O 2356440296 VUEXXQYNBHUERB-FZXCNUEYSA-N 348.395 2.168 50 1 EEGF O=C(N/N=C/c1ccc(O)c(O)c1)c1ccc2c(c1)OCCCO2 1772655423 YJEOUAKUDLQUFV-VCHYOVAHSA-N 328.324 2.023 50 1 EEGF CC(=O)NC(=O)Nc1cccc(NC(=O)[C@H](C)Br)c1 40975492 KJDYKJJVWPEHNY-ZETCQYMHSA-N 328.166 2.077 50 1 EEGF CCCCCC#C[C@@]1(C)O[C@@H]2OC(=O)N(C(=O)CCl)[C@@H]2C[C@H]1O 29231570 PGTUKQIWBABLOZ-UNIGVISCSA-N 343.807 2.022 50 1 EEGF COc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC3)cc(OC)c1OC 653822636 IUCXIBKYUFRZFX-HNNXBMFYSA-N 342.351 2.137 50 1 EEGF COC(=O)[C@H](Cl)[C@]1(C(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587418836 AVMNCMSTMYATCN-IPZIOGDXSA-N 346.713 2.227 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@@]42OO3 169368266 WFIMQBUUYYWZTM-NECQQQQTSA-N 328.405 2.202 50 1 EEGF C[C@H]1CC2=C(O1)c1ccccc1/C(=N/NC(=O)c1ccncc1)C2=O 1857535509 DSKOPALADDXEIB-UTSGGKDNSA-N 333.347 2.318 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@H]1c1ccccc1O 1632057 OWSHVQCLIWFXCE-HZPDHXFCSA-N 330.771 2.157 50 1 EEGF COc1cc(C(=O)NCCCSSCCN(C)C)ccc1O 618007811 JFPMHKJDSBWLGK-UHFFFAOYSA-N 344.502 2.464 50 1 EEGF COc1ccccc1[C@H]1[C@H](Cl)C(=O)N1NC(=O)Cc1ccccc1 1632064 HCZAJKQTRNGOQV-IRXDYDNUSA-N 344.798 2.460 50 1 EEGF O=C(O)CC[C@H](NC(=O)CCCC[C@@H]1CCSS1)C(=O)O 103229818 RIAHXAKSGTUVMS-ZJUUUORDSA-N 335.447 2.135 50 1 EEGF CCO[C@@H](CI)O[C@@H]1C=C[C@H](OC(C)=O)C1 5924668 MVJVDGIOLQOBLN-HBNTYKKESA-N 340.157 2.061 50 1 EEGF CNCCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 43919875 UZPOTTLIUZBCEZ-VTGMPIQNSA-N 341.448 2.430 50 1 EEGF CCCc1c(O)ccc2c1O[C@@]1(C=NN(C)C(=O)[C@@H]1Cl)CC2=O 587461525 NAHNMPNRDLZSJH-GOEBONIOSA-N 336.775 2.114 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@@]24OO3 195244704 JEAMUJGJFHFTDV-ASOODUIFSA-N 326.389 2.410 50 1 EEGF CN(C)CCOc1ccc(C(=O)N/N=C/c2ccccc2O)cc1 1772570373 RLMPTAFKQKLSAI-CPNJWEJPSA-N 327.384 2.097 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 42784697 VCMOVYRZBUORCV-PEISMGNISA-N 328.405 2.202 50 1 EEGF CN(C)CCSSCCNC(=O)[C@H]1Cc2ccccc2N1 618007794 IJMOKDGBHURCKY-CQSZACIVSA-N 325.503 2.082 50 1 EEGF CNC(=O)NNC(=O)n1nc(-c2ccccc2)nc1-c1ccccc1 1857568229 BUSJZTIMYICBNL-UHFFFAOYSA-N 336.355 2.014 50 1 EEGF C=C(C=O)[C@@H]1C[C@H](COC=Cc2ccc(O)cc2)C(CO)=C1C=O 2356340680 VHBCHQFWBGEKKL-WBVHZDCISA-N 328.364 2.259 50 1 EEGF C[C@]1(O)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 140055665 PFAJNVCFGCXGRB-OEAJRASXSA-N 326.414 2.101 50 1 EEGF COc1cccc(C(=O)N(NC(=O)c2snnc2C)C(C)(C)C)c1 103206565 HLEHNMSQWNUFRC-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF O=C1C(CN(CCCl)CCCl)=CS(=O)(=O)c2ccccc21 27984767 QGLYFLXTJUQZTL-UHFFFAOYSA-N 348.251 2.320 50 1 EEGF CCCc1cccc(C(=O)NNS(=O)(=O)c2ccccc2F)c1 1857575365 OEXABQQSXVLXCB-UHFFFAOYSA-N 336.388 2.402 50 1 EEGF O=C/C=C/c1cc(O)c2c(c1)[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 34093481 CGSLPFBMGQUTKF-GKVZFTJXSA-N 328.320 2.225 50 1 EEGF O=C(NNc1ncnc2sc3c(c12)CCCC3)c1cnccn1 1772621036 OBBIPZBLAXTBEB-UHFFFAOYSA-N 326.385 2.117 50 1 EEGF COc1ccc(Cl)cc1C#Cc1ccc(OCC(=O)NN)cc1C 587900220 KURDNCMTORNTLN-UHFFFAOYSA-N 344.798 2.426 50 1 EEGF O=C(CBr)Nc1cccc(NC(=O)NCCCl)c1 49872250 WJSLYQMUACUGIA-UHFFFAOYSA-N 334.601 2.380 50 1 EEGF CCCOc1ccc(CN/C(C)=C(/C#N)C(=O)OCCOCC)cn1 103180752 YZUUMYKJAOZVGK-PEZBUJJGSA-N 347.415 2.337 50 1 EEGF COc1ccc([C@H](O)[C@H](C)c2nc3ccc(C(=O)NN)cc3[nH]2)cc1 587935137 GMTLZMKYQLRZBX-MGPLVRAMSA-N 340.383 2.012 50 1 EEGF CCCCN(N=O)C(=O)Nc1ccc([C@@H]2CC(=O)N(C)C2=O)cc1 100876580 KUEAUGOGAMLKAF-ZDUSSCGKSA-N 332.360 2.474 50 1 EEGF C[C@H](Br)c1nc2ccc(S(=O)(=O)N(C)C)cc2[nH]1 587008027 FXUNWYBZRRWFKV-ZETCQYMHSA-N 332.223 2.269 50 1 EEGF C[C@H](CO)C1=C2C/C=C(\C=O)[C@@H]3C(=O)[C@@H](O)[C@@H](C)[C@H]3C[C@]2(C)CC1 169370503 NDSSXIGJWWQDCU-GNHUCQCMSA-N 332.440 2.443 50 1 EEGF CC1(C)CNP(=O)(NC(=O)Nc2ccccc2[N+](=O)[O-])NC1 103221932 OFIJEGSUDJSKME-UHFFFAOYSA-N 327.281 2.043 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OCC(=O)O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 103174701 VTJYEGQXIYSIGY-QLIYMYOWSA-N 342.388 2.296 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/CNC(=O)OC(C)(C)C 95808763 NDDVXEHJZLRJPE-LDADJPATSA-N 343.424 2.127 50 1 EEGF CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H](O)[C@H]1Br 40576144 SFECHFUZAGUXCD-TZMCWYRMSA-N 337.169 2.096 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H]([C@H](Br)CC)C[C@H]2O1 2356423628 IGGWUQFVBHRWOH-DBWOOVFOSA-N 329.234 2.415 50 1 EEGF C=C[C@@]1(C)[C@@H](C(=C)C=O)[C@H](OCC(C)C)[C@H]2C(=C)C(=O)O[C@H]2[C@H]1O 2356692172 MPMVQQPKRNZSDV-QCQTWIRCSA-N 334.412 2.064 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H](CC)[C@@H](Br)C[C@@H]2O1 2356459194 BYFHPYMVXVHPFO-LOVFCKMRSA-N 329.234 2.415 50 1 EEGF COc1ccc(/C=N/NC(=O)c2ccc(N3CCOCC3)cc2)cc1 45284535 NNRDWKQFFBTXFX-XSFVSMFZSA-N 339.395 2.296 50 1 EEGF C=C1C(=O)O[C@@H]2[C@@H]3C(=C(C)C[C@H](OC(C)=O)[C@@H]12)C[C@H](Cl)[C@@]3(C)O 142939946 ZSKBNZHYKGNZGI-OJTIBXMRSA-N 340.803 2.114 50 1 EEGF N#C/C(=C1/Nc2ccccc2S1)c1ccnc(NCc2nnn[nH]2)n1 13647748 FERKUGFMHHWOPO-NTEUORMPSA-N 349.383 2.012 50 1 EEGF O=C(N/N=C/c1ccccc1)c1ccc(CN2CCC[C@@H](O)C2)cc1 1857631107 PAKYUUZOUBAHNF-DBRLUCFCSA-N 337.423 2.407 50 1 EEGF NNC(=O)c1ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2c1 587034884 IKQNJOBHIQZPEO-ZDUSSCGKSA-N 328.397 2.084 50 1 EEGF CCCCCC#C[C@@]1(C)O[C@@H]2OC(=O)N(C(=O)CCl)[C@@H]2C[C@@H]1O 29234576 PGTUKQIWBABLOZ-TWJWRFFLSA-N 343.807 2.022 50 1 EEGF O=C(NO)c1cccc(C(=O)N/N=C/c2ccc(O)c3ccccc23)c1 95809708 QNOLVYNREJSKFV-RGVLZGJSSA-N 349.346 2.428 50 1 EEGF COc1ccc(-c2noc(C(=O)N/N=C/c3ccc(O)cc3)n2)cc1 45385663 JRUYDNXCJUWTIT-VCHYOVAHSA-N 338.323 2.215 50 1 EEGF CCCN1N=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)[C@@H](Cl)C1=O 587382944 UQCDRNPOLHNWQJ-HOCLYGCPSA-N 335.791 2.127 50 1 EEGF CCN(c1ccc([Si](C)(C)O)cc1)S(=O)(=O)c1ccccc1 1857652234 VTYNTIZIGYBROX-UHFFFAOYSA-N 335.501 2.306 50 1 EEGF CCCc1[nH]nc2c1[C@@H](c1ccc(O)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1857773516 VZIJGKGTUGOXGQ-ZDUSSCGKSA-N 341.327 2.194 50 1 EEGF CN(C)CCSSCCCNC(=O)[C@H](O)c1ccccc1 618007741 HDGRUMZYXKEHNO-CQSZACIVSA-N 328.503 2.169 50 1 EEGF C=C(C)n1c(=O)n(C(=O)CCl)c2cc(Br)cnc21 1857641364 ZBXAFYQQVBBZNO-UHFFFAOYSA-N 330.569 2.330 50 1 EEGF O=C(O)CCCCCC(=O)N/N=C/c1ccncc1Br 95809747 IWXIGPTXNSDRFN-LZYBPNLTSA-N 342.193 2.329 50 1 EEGF COc1cccc(CC(=O)NCCSSCCN(C)C)c1 618008314 XXLXVGJGLOVJQR-UHFFFAOYSA-N 328.503 2.297 50 1 EEGF CC(=CC=O)O[C@H]1[C@@H](O)c2c(ccc3ccc(=O)oc23)OC1(C)C 2356641515 SIHQKLUJMQEDIR-RDJZCZTQSA-N 330.336 2.485 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@H](CO)[C@H](c1ccc(O)c(O)c1)O2 5759775 NTXXGPYGMQQSML-ZSCXUVNLSA-N 328.320 2.183 50 1 EEGF endogenous,in-man Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOC[C@@H]1Br)O2 587372282 KCMKWSNWMGGNOY-GXTWGEPZSA-N 326.190 2.465 50 1 EEGF Cc1c(/C=N/NC(=O)c2ccccc2Nc2ccccc2)no[n+]1[O-] 169352098 BQYHNLVGSKDNGB-WOJGMQOQSA-N 337.339 2.124 50 1 EEGF O=C(CCCCC(=O)N/N=C/c1c(O)ccc2ccccc12)NO 95808760 WOETZGSGCOFZPP-WOJGMQOQSA-N 329.356 2.061 50 1 EEGF O=C1OC(=O)c2cc(-c3nc4cc(F)cc(C(=O)O)c4[nH]3)ccc21 586906768 QMOWDSUTJIWDJS-UHFFFAOYSA-N 326.239 2.378 50 1 EEGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(C)cc2B(O)O)N1 962944738 FCDHNRUYFXTDMS-BFUOFWGJSA-N 334.228 2.170 50 1 EEGF COc1ccc(C2=CC(=C3C=CC(=O)C=C3)NC(N)=C2C#N)cc1OC 100477400 YHOAQLKNMPGJMH-UHFFFAOYSA-N 347.374 2.333 50 3 EEGF C/C(=N\NC(=O)Nc1nnc(S)s1)c1ccc([N+](=O)[O-])cc1 28863662 FFTSFRVNCFVUPV-AWNIVKPZSA-N 338.374 2.281 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@@H]1c1cccc(O)c1 5838387 ZOLXELYLFMBTES-CVEARBPZSA-N 330.771 2.157 50 1 EEGF O=C1OC(=O)c2cc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)ccc21 586906296 AYYCSEVYIKSUTQ-UHFFFAOYSA-N 334.213 2.301 50 1 EEGF C#CC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H]([C@@H](O)CC)C[C@@H]2O1 2356808288 YQCPBXPXSQPWLE-LZXPERKUSA-N 329.234 2.415 50 1 EEGF CN(C)CCSSCCNC(=O)c1cnc(O)c(Cl)c1 618011794 LCQLVLFGNCNMFP-UHFFFAOYSA-N 335.882 2.113 50 1 EEGF COc1ccc(C#Cc2cc(Cl)ccc2OC)c(C(=O)NN)c1 587901327 ZIFFZAVREKJHQI-UHFFFAOYSA-N 330.771 2.361 50 1 EEGF CC(C)Oc1ccc2nc(CCNC(=O)CBr)[nH]c2c1 586970494 BVAHPXSOCIARQC-UHFFFAOYSA-N 340.221 2.404 50 1 EEGF CN1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O 587499813 NBNFZMUHXVXBTD-RDJZCZTQSA-N 332.787 2.335 50 1 EEGF NC(=O)c1cc2cc(Cl)ccc2o/c1=N/NC(=O)c1ccccc1 187613 KMVSICIPUFSABC-HEHNFIMWSA-N 341.754 2.431 50 1 EEGF CN(C)c1cccc(C(=O)NNC(=S)N[C@@H]2C[C@@H]3CC[C@@H]2C3)c1 101273491 TZLHGBGGZHARSI-LALPHHSUSA-N 332.473 2.050 50 1 EEGF CCCN1N=C[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@@H](Cl)C1=O 587423305 WODSKEVBVQPWIM-PJQXDXOGSA-N 348.786 2.027 50 1 EEGF N#CC1=C2C3=CC=C(N4CCSCC4)C4=CC=C[C@H](C2=NC1=O)[C@H]43 1857579954 GESSOJAUHWSJSK-XJKSGUPXSA-N 333.416 2.403 50 1 EEGF O=C(O)CCC(=O)O[C@@]12CCCC[C@H]1[C@@H]1CCCC[C@@]1(O)OO2 169314783 NMOQQEQDHSENLC-YXAMBPQSSA-N 328.361 2.122 50 1 EEGF Cn1cncc1/C=N/NC(=O)COc1ccc(Cl)cc1Cl 95771514 GRZCBIHAUWKIHJ-UBKPWBPPSA-N 327.171 2.256 50 1 EEGF O=C(CCCc1ccc(F)cc1)N/N=C/c1ccc(O)c(O)c1O 1772634171 RVYAEMGOIASURS-VXLYETTFSA-N 332.331 2.416 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H](CC)[C@@H](Br)C[C@H]2O1 2356459196 BYFHPYMVXVHPFO-UJOWSUJOSA-N 329.234 2.415 50 1 EEGF COC(=O)CCC(=O)Nc1cc2c3c(cccc3c1)C(=O)OC2=O 95584202 MNXUQYVOTOENAK-UHFFFAOYSA-N 327.292 2.042 50 1 EEGF Cc1nc2ccc(C(=O)N/N=C/c3ccc4c(c3)OCCO4)cc2[nH]1 1772579300 KXKKJMPULACOQW-VXLYETTFSA-N 336.351 2.406 50 1 EEGF CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)N(C)C#N 45390121 GZBOGFDHJAMENH-HNNXBMFYSA-N 332.404 2.114 50 1 EEGF O=C(CBr)NCCc1nc2cnc3ccccc3c2[nH]1 586971390 RORWORIUGABRGL-UHFFFAOYSA-N 333.189 2.165 50 1 EEGF Cc1ccc(Nc2nc(N)nc(C(=O)NNc3ccccc3)n2)cc1 103241505 HQLNYCVKSVEJRR-UHFFFAOYSA-N 335.371 2.263 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@H](OCC(C)C)[C@H]12 2356473210 XIQILJDZEXJZIC-ZJPYXAASSA-N 334.412 2.352 50 1 EEGF C[C@@H]1[C@H](O)C(=O)[C@H]2/C(C=O)=C/CC3=C([C@@H](C)CO)CC[C@@]3(C)C[C@H]12 169370502 NDSSXIGJWWQDCU-DEIVZCBESA-N 332.440 2.443 50 1 EEGF O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C\c1cccnc1 33304744 ZDVHIAYYBDHHHZ-MFOYZWKCSA-N 330.369 2.373 50 1 EEGF CC(=O)Nc1ccc(/C=N/NC(=O)c2nc(-c3ccccc3)no2)cc1 45349372 ZSFNWJVTZNXKBV-YBFXNURJSA-N 349.350 2.459 50 1 EEGF C#C/C=C\C[C@H]1O[C@H]2C[C@@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 238769227 NOYIFPKKLJWDFK-RMDNDNTRSA-N 329.234 2.415 50 1 EEGF CN1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O 587499812 NBNFZMUHXVXBTD-NVXWUHKLSA-N 332.787 2.335 50 1 EEGF C#C/C=C/C[C@@H](O)[C@H]1C[C@H]2O[C@@H](CC)[C@H](Br)C[C@H]2O1 238765594 BYFHPYMVXVHPFO-KIICCLJJSA-N 329.234 2.415 50 1 EEGF O=C(CSc1nnnn1-c1ccccc1)NN=C1CCCCC1 5517055 KSWJNNHXSMJPSI-UHFFFAOYSA-N 330.417 2.191 50 1 EEGF O=CC=Cc1cc(O)c2c(c1)[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 2356604674 CGSLPFBMGQUTKF-DYVFJYSZSA-N 328.320 2.225 50 1 EEGF CC(=CC=O)O[C@H]1[C@H](O)c2c(ccc3ccc(=O)oc23)OC1(C)C 2356641516 SIHQKLUJMQEDIR-WBVHZDCISA-N 330.336 2.485 50 1 EEGF Cc1sc2c(c1C)CCN[C@]2(C)c1ccc(Cl)c(B(O)O)c1 963008073 JBFTVWLBXVPVIF-MRXNPFEDSA-N 335.665 2.107 50 1 EEGF CCO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@@]1(C)O)[C@]42OO3 195304103 QEZXEMZAZAJVRG-QREYYQGZSA-N 328.405 2.346 50 1 EEGF CC(=O)Oc1ccc(C(=O)NCCSSCCN(C)C)cc1 618008285 XEWGCZQSTJPZKY-UHFFFAOYSA-N 342.486 2.285 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@H](CCl)[C@H]4[C@@H](C2)N(C)CC[C@]314 27767014 YYDGJYRFMZGTTH-UWVBBOOBSA-N 347.842 2.398 50 1 EEGF CCCCCCNC(=O)N/N=C/c1c(-c2ccccc2)no[n+]1[O-] 29559652 JTOZWRIDMLYPGG-LDADJPATSA-N 331.376 2.188 50 1 EEGF C=C[C@]1(C)[C@H](O)[C@@H]2OC(=O)C(=C)[C@@H]2[C@H](OCC(C)C)[C@H]1C(=C)C=O 2356692174 MPMVQQPKRNZSDV-ZXDRVLLCSA-N 334.412 2.064 50 1 EEGF COc1cc(/C=N/NC(=O)c2nc(-c3ccccc3)no2)ccc1O 95576774 YOGHGVFYHFDTOZ-VCHYOVAHSA-N 338.323 2.215 50 1 EEGF CCN(CC)CC/N=C(N)/C(C#N)=C/c1[nH]c2ccccc2c1O 71928347 QSDBAICXMRZITI-ACCUITESSA-N 325.416 2.479 50 1 EEGF [C-]#[N+]C1=C2COCCN2C2=C(C(=O)OC2)[C@@H]1c1ccc2[nH]nc(C)c2c1 144804630 RWVZNAHDKKVNTP-INIZCTEOSA-N 348.362 2.243 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccc(F)cc2)OO[C@H]2C[C@H]1CC[C@@]2(C)O 169328297 LHISGEJBLVJODQ-MSQAHXEGSA-N 344.404 2.240 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@]42OO3 169368264 WFIMQBUUYYWZTM-KHQAYJDYSA-N 328.405 2.202 50 1 EEGF C=C1[C@@H](OCCO)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 101593387 YPWTVAGOIFEWNG-UJLNSSGYSA-N 326.389 2.123 50 1 EEGF COc1cc(/C=N/NC(=O)c2n[nH]c3c2Cc2ccccc2-3)ccc1O 1857567206 VCQBUBSIFUXGPX-KEBDBYFISA-N 348.362 2.459 50 1 EEGF Cc1cc(O)c2c3c(c(O)c4c(c13)O[C@@](C)(O)C4(C)C)C(=O)OC2=O 2356801815 QVOBPXACBGUACY-GOSISDBHSA-N 344.319 2.249 50 1 EEGF CC(=O)C[C@@H]1O[C@H]2[C@@H]3[C@H]1C(C)=CC(=O)[C@@H]3[C@@H](C)CO[C@@]2(C)/C=C/C=O 136482201 SPGKLZOENIXNTQ-SUPQLNTRSA-N 346.423 2.291 50 1 EEGF NNC(=O)CCN1C(=O)c2ccccc2N[C@H]1c1ccc(Cl)cc1 473136114 XLEOGICALPFXRA-MRXNPFEDSA-N 344.802 2.287 50 1 EEGF C[C@]1(O)CC[C@@H]2C[C@@H]1OO[C@]2(C)CS(=O)(=O)c1ccccc1 169328780 PFAJNVCFGCXGRB-SYAUCNOPSA-N 326.414 2.101 50 1 EEGF C#C/C=C/C[C@H]1O[C@@H]2C[C@H]1O[C@@H](CC)[C@H](Br)C[C@@H]2O 143002495 NOYIFPKKLJWDFK-BKONYDDXSA-N 329.234 2.415 50 1 EEGF CCOC(=O)c1[nH]c2cc(Cl)ccc2c1/C=N/NC(=O)COC 1857573731 HWSIKTOTKUIQHY-REZTVBANSA-N 337.763 2.095 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccccc2)OO[C@@H]2C[C@@H]1CC[C@]2(C)O 100834569 PFAJNVCFGCXGRB-DRPJVOAASA-N 326.414 2.101 50 1 EEGF CC(C)NS(=O)(=O)c1cc(NC(=O)CCl)ccc1Cl 1857554865 KNMHYCCVNWINHU-UHFFFAOYSA-N 325.217 2.204 50 1 EEGF CN(C)CCNC(=O)C1CCC2(CC1)OOC1(CCCCC1)OO2 43617540 OPIHKFVQPXUBER-UHFFFAOYSA-N 342.436 2.121 50 1 EEGF CN(C)CCSSCCNC(=O)c1ccc2c(c1)OCO2 618007901 MHUUSURRDFMEKN-UHFFFAOYSA-N 328.459 2.088 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2cc(Br)ncc2[nH]1 587009150 XOHQIFHYWLAYJF-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF O=[P@@]1(N(CCCl)CCCl)OCC[C@@H](O)N1CCCl 29318969 RAXABQCFPAWRSY-LZVRBXCZSA-N 339.587 2.154 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2c(Br)ccnc2[nH]1 587008711 QVCHSTPPNBGJQO-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF COc1cc2c3c(c1)O[C@](C)(C(=O)CBr)[C@@H](C2)C3=O 587414751 ODBBFLINHLWCOT-XPTSAGLGSA-N 325.158 2.165 50 1 EEGF CCCSC[C@@H](N)[C@H](O)C(=O)NNc1cccc2ccccc12 27995659 RVCYRZKBMQLBPN-ZBFHGGJFSA-N 333.457 2.114 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@@H]1OO[C@]2(C)CS(=O)(=O)c1ccccc1 79277738 PFAJNVCFGCXGRB-QCEMKRCNSA-N 326.414 2.101 50 1 EEGF O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1ccc(Cl)s1 4867039 PLHMXBHYYNWJTI-CFMAKPDCSA-N 347.827 2.381 50 3 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)ccc1O 95808687 IDLGRTQEQXWVMM-LDADJPATSA-N 336.388 2.365 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1cccc(C(=O)O)c1 95809416 QBYQUJUMHRZDMW-LDADJPATSA-N 334.372 2.349 50 1 EEGF CCCN1N=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)[C@H](Cl)C1=O 587382941 UQCDRNPOLHNWQJ-GDBMZVCRSA-N 335.791 2.127 50 1 EEGF CO[C@@]12CCN(C)C[C@H]1[C@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 71295053 YBYWLVDTXRMLOL-ZMSDIMECSA-N 333.819 2.442 50 1 EEGF COc1cc2cc[n+](C)c3c2c(c1OC)[C@H](Br)OC3=O 28525363 KEIVQJZVBOSYMT-CYBMUJFWSA-N 339.165 2.245 50 1 EEGF O=C(CCCCc1ccc(O)cc1)N/N=C/c1ccc(O)c(O)c1O 1772582931 OVARUOYBYNKIBP-YBFXNURJSA-N 344.367 2.372 50 1 EEGF N#CC(C#N)=C(N)/C(C#N)=C/c1cc(O)c(O)c(Br)c1 17747283 RMDQRGMZCBNAHG-UNXLUWIOSA-N 331.129 2.027 50 1 EEGF CCN1CC[C@@]2(OC)OC(N)=C(C#N)[C@@H](c3ccc(OC)cc3)[C@@H]2C1 71295742 ZWEIHOWHQPZMDY-YQVWRLOYSA-N 343.427 2.187 50 1 EEGF CC(=O)C[C@@]1(CBr)Nc2ccc([N+](=O)[O-])cc2NC1=O 33629195 PQTRBKMIKGNFDH-LBPRGKRZSA-N 342.149 2.072 50 1 EEGF CC(C)(F)[C@@H](Br)c1nc2ccc(C(=O)NN)cc2[nH]1 587086971 KNWZRLVUDHEKEF-VIFPVBQESA-N 329.173 2.351 50 1 EEGF O=C(CCl)Sc1nnc(COc2cccc([N+](=O)[O-])c2)o1 82155226 YZKYWTLNIVIHEG-UHFFFAOYSA-N 329.721 2.414 50 1 EEGF N#CC1=C(N)[C@@H]2[C@@H](C=C1N)Oc1cc(O)ccc1[C@@H]2c1ccccc1 169346798 VIUWVURDHWPCKS-CEXWTWQISA-N 331.375 2.494 50 1 EEGF C[C@@H]1CC2=C(O1)c1ccccc1/C(=N/NC(=O)c1ccncc1)C2=O 1857535508 DSKOPALADDXEIB-CSQSHRMHSA-N 333.347 2.318 50 1 EEGF C[C@@H]1CC[C@H]2[C@H](Cn3ccnc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 101331057 NZOBFHPRHGUZAL-ZGFJPVJZSA-N 348.399 2.272 50 1 EEGF C=C1C[C@@H](O)[C@@H](Br)C(C)(C)[C@@]12C=C[C@](O)(CO)CC2 1772625683 GWKDEWRFZLOGGJ-QHSBEEBCSA-N 331.250 2.157 50 1 EEGF N#CCN1C(=O)N(Cc2ccccc2)S(=O)(=O)C2=C[C@H](Cl)C=C21 103274843 VYISCNLLIUHZKN-GFCCVEGCSA-N 349.799 2.166 50 1 EEGF CCOc1ccc([C@@H]2C[C@@H]2C(=O)NNC(=O)c2ccncc2)cc1 49110829 XZLCAXJGTXAHSN-HOTGVXAUSA-N 325.368 2.045 50 1 EEGF COc1cc2c3c(c1)O[C@@](CCl)(/C(C#N)=C\N(C)C)[C@@H](C2)C3=O 587417771 PYVGZKCOXSSLKA-SWYIWLARSA-N 332.787 2.389 50 1 EEGF O=C(NNC(=O)c1csc(-c2cccc(F)c2)n1)c1ccccn1 1857757653 DLTUUIVKEVBNCF-UHFFFAOYSA-N 342.355 2.419 50 1 EEGF OB(O)c1ccsc1-c1nc2ccc3n[nH]cc3c2c2c1CCC2 1857609908 BLLPPGSIIPVMOZ-UHFFFAOYSA-N 335.197 2.008 50 1 EEGF Cc1ccnc2c1CCN[C@]2(CCl)c1ccc2c(c1)oc(=O)n2C 963070507 NPNGIRCFULLGFM-GOSISDBHSA-N 343.814 2.463 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccccc2)OO[C@H]2C[C@@H]1CC[C@@]2(C)O 169328782 PFAJNVCFGCXGRB-ARLBYUKCSA-N 326.414 2.101 50 1 EEGF CN(C)c1cccc(C(=O)NNC(=S)N[C@H]2C[C@@H]3CC[C@@H]2C3)c1 101273494 TZLHGBGGZHARSI-JMSVASOKSA-N 332.473 2.050 50 1 EEGF CC1(C)[C@H](Br)[C@@H](O)C[C@@]2(O)C[C@](C)(O)[C@H]3CC[C@]12C3 2356535050 MWFIODJGZKGRJI-DXIVLCDLSA-N 333.266 2.213 50 1 EEGF CC(=O)N[C@@H](C)C(=O)N(C)/N=N/c1ccc(Br)cc1 40379122 ZTPTVLYOFPVSIR-BNCXAUQFSA-N 327.182 2.431 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 14557596 SDDXIQONGFZHJH-FKAFAWJWSA-N 328.320 2.183 50 1 EEGF endogenous,in-man C[C@]1(CS(=O)(=O)c2ccc(F)cc2)OO[C@@H]2C[C@@H]1CC[C@]2(C)O 100833920 LHISGEJBLVJODQ-BJKJVOPESA-N 344.404 2.240 50 1 EEGF Cn1c(=O)c(=O)n(CCCCCCl)c2ccc([N+](=O)[O-])cc21 473136935 VJMZXLYFVGYVOU-UHFFFAOYSA-N 325.752 2.018 50 1 EEGF CC(=O)NCc1ccc([C@]2(CCl)NCCc3c(C)ccnc32)o1 963071371 RHGKCRNQGYAIBS-KRWDZBQOSA-N 333.819 2.247 50 1 EEGF COc1cc2nc(CCNC(=O)CBr)[nH]c2cc1Cl 586971835 ZQDVVASKPRCFHE-UHFFFAOYSA-N 346.612 2.279 50 1 EEGF O=C(NN/C=C1\C=Nc2ccccc21)[C@H]1CC(=O)N(c2ccccc2)C1 13130375 VQYQAEBPYDEOBV-YEQVNJDRSA-N 346.390 2.417 50 3 EEGF CCOc1ccc([C@H]2C[C@@H]2C(=O)NNC(=O)c2ccncc2)cc1 49110831 XZLCAXJGTXAHSN-CVEARBPZSA-N 325.368 2.045 50 1 EEGF CCC[C@H]1C2=C(CCC3=C(C[C@H]1CC)C(=O)O[C@H]3O)C(=O)OC2=O 85836061 WPWIOEXPUQFLTC-IQMDTDKHSA-N 334.368 2.165 50 1 EEGF O=C(/C=C/c1ccc(F)c(Br)c1)c1ccc(B(O)O)cc1 195202129 LNQXIOXWDOTTJK-KRXBUXKQSA-N 348.964 2.164 50 1 EEGF C=C(C)[C@H]1CC[C@@]23CO[C@@]4(OO2)C2=C(C(=O)C(C)=C[C@H]1[C@H]23)[C@@H](O)[C@@H]4C 238768007 AINNPETUGJFTND-PYFMSPEWSA-N 344.407 2.468 50 1 EEGF CSc1ccc2nc(CCNC(=O)CBr)[nH]c2c1 586971620 UVOPVAJDZKNBKQ-UHFFFAOYSA-N 328.235 2.338 50 1 EEGF C=C(CCO)C(=O)[C@@H]1C[C@H]2C(=C)C(=O)O[C@@H]2C=C(C=O)CCC=C1C 2356709344 ZNQBXCCAMXIRHG-FGTMMUONSA-N 344.407 2.464 50 1 EEGF CO/N=C(/C(=O)NN)c1ccccc1COc1cc(C)ccc1C 103192497 UVOFDIIWIWQGBL-HEHNFIMWSA-N 327.384 2.223 50 1 EEGF COC(=O)[C@@]1([C@@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 587371463 DXHXYLUGIOWIEV-CLAHSXSESA-N 342.189 2.238 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@H](CCl)[C@@H]4[C@H](C2)N(C)CC[C@@]341 195008899 YYDGJYRFMZGTTH-WGEYAOBPSA-N 347.842 2.398 50 1 EEGF CN(C)S(=O)(=O)c1ccc2nc(/C=C/CBr)[nH]c2c1 586974190 SPUBIKUFDBMPTG-ONEGZZNKSA-N 344.234 2.221 50 1 EEGF O=C(N/N=C\c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1cccnc1 33490606 TWVCSGAIWZQENO-ODLFYWEKSA-N 339.355 2.354 50 1 EEGF COc1cc(C(=O)NCCSSCCN(C)C)ccc1O 618007639 CXIHEPRUGLODBU-UHFFFAOYSA-N 330.475 2.074 50 1 EEGF N#CC1=C2C3=CC=C(N4CCSCC4)C4=CC=C[C@H](C2=NC1=O)[C@@H]43 1857579951 GESSOJAUHWSJSK-BBRMVZONSA-N 333.416 2.403 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@@]2(C)CC2=C(C[C@@H]1CC)C(=O)OC2=O 2356657750 RUGDWJCVKKJESL-VOQFUICPSA-N 332.352 2.229 50 1 EEGF COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(C(=O)NN)cc3[nH]2)cc1 587935119 GMTLZMKYQLRZBX-HWPZZCPQSA-N 340.383 2.012 50 1 EEGF CCOC1=C/C(=C2/C=C(c3ccc(N)cc3)NC(N)=C2C#N)C=CC1=O 34209465 PEAABMJFSHRUGB-SQFISAMPSA-N 346.390 2.263 50 3 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@H]1c1ccc(O)cc1 5838450 FYMORAVOLCMQCC-HZPDHXFCSA-N 330.771 2.157 50 1 EEGF C=C(C)[C@H]1CC[C@]23CO[C@]4(OO2)C2=C(C(=O)C(C)=C[C@H]1[C@H]23)[C@@H](O)[C@@H]4C 197398054 AINNPETUGJFTND-VWGSFSBGSA-N 344.407 2.468 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=NN(C(C)C)C(=O)[C@H]1Cl)O2 587382093 NROLNGPUZOTXLO-GDBMZVCRSA-N 335.791 2.125 50 1 EEGF C=C1CC[C@H]2[C@@H](OC(=O)[C@@]2(O)CCl)[C@@H]2[C@@H](COC(C)=O)CC[C@H]12 238742239 HFACCBSBBKHWKB-LQCKPJBFSA-N 342.819 2.053 50 1 EEGF CCO[C@H](CI)O[C@@H]1C=C[C@H](OC(C)=O)C1 5924670 MVJVDGIOLQOBLN-AXFHLTTASA-N 340.157 2.061 50 1 EEGF N#CC1=C(C#N)C(=O)[C@H](Cl)C(=NCCCc2ccccc2)C1=O 2356842064 MKOGNADWXOYSGB-CQSZACIVSA-N 325.755 2.163 50 1 EEGF O=C(N/N=C\c1ccccc1Cl)c1ccc(-n2cnnn2)cc1 33499719 DPBHJPLSHAYIML-MFOYZWKCSA-N 326.747 2.080 50 1 EEGF C#CC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H]([C@H](O)CC)C[C@@H]2O1 2356808286 YQCPBXPXSQPWLE-IWTMDLJTSA-N 329.234 2.415 50 1 EEGF COC(=O)[C@]1([C@H](Cl)C(C)=O)N[C@H]2CC[C@@H]2c2ccc(OC)cc21 962990149 BBHBXSKIRNKXJM-JWDQPFGJSA-N 337.803 2.109 50 1 EEGF COc1cccc2[nH]c(/C(C#N)=C\c3ccc(OCC(N)=O)cc3)nc12 73366568 MIOHKYDEQWXVGV-LCYFTJDESA-N 348.362 2.500 50 1 EEGF N#CC1=COc2ccc(Cl)cc2[C@]12N[C@H]1Cc3c2ccnc3C1=O 963289231 JZDFFDMEZHTILR-KSSFIOAISA-N 335.750 2.489 50 1 EEGF NC[C@H](Cc1ccc(Cl)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 587071250 YAFSZAVCCBWZMH-LBPRGKRZSA-N 343.818 2.105 50 1 EEGF O=[N+]([O-])c1ccc(CO[S@](=O)N(CCCl)CCCl)cc1 95575616 RBVQKUIUMUAGGI-HXUWFJFHSA-N 341.216 2.470 50 1 EEGF O=C(CCCCC(=O)N/N=C/c1ccc(C(F)(F)F)cc1)NO 95809780 WGWDDXLTHQETEF-GIJQJNRQSA-N 331.294 2.221 50 1 EEGF C=C1C[C@H](O)[C@H](Br)C(C)(C)[C@]12C=C[C@@](O)(CO)CC2 2356824594 GWKDEWRFZLOGGJ-JURCDPSOSA-N 331.250 2.157 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@H](Br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c1cc(F)c2cn[nH]c2c1 618017116 FYDXDKRVPDCPHR-UHFFFAOYSA-N 342.465 2.375 50 1 EEGF O=[P@@]1(N(CCCl)CCCl)NC[C@H](Br)CO1 1559320 FANXZPANFQUGNC-ZIDLFYJRSA-N 339.985 2.257 50 1 EEGF COC(=O)c1cc(Br)c2[nH]c([C@H](N)CCl)nc2c1 587009352 BFSPNCNGKNMSJF-SSDOTTSWSA-N 332.585 2.351 50 1 EEGF CC[C@]1([C@@H](Cl)C(=O)OC)NC[C@@H]2CC(=O)N(C)c3cccc1c32 963038589 WLUNXLXQIXQZHS-QXKQMHMISA-N 336.819 2.126 50 1 EEGF COBN1CC[C@H](Cl)[C@@H]1CCCc1ccc(C(=O)OC)s1 2356704738 GFUALJXBCRMIQS-RYUDHWBXSA-N 329.658 2.452 50 1 EEGF O=C(CBr)NCCc1nc2cc(Cl)cc(F)c2[nH]1 586971656 VLOLCDURPQLCRZ-UHFFFAOYSA-N 334.576 2.409 50 1 EEGF C[C@@H]1C(=O)N(C(=O)CCl)[C@H]2CC[C@H](C(=O)OCc3ccccc3)[C@H]12 27518684 LHKIDMCVMWJFKQ-PCBIJLKTSA-N 349.814 2.368 50 1 EEGF COc1cc(OC)cc([C@H]2C(C#N)=C(N)Oc3c2ccc(N)c3N)c1 38153958 CHSNDOVNDLBURC-OAHLLOKOSA-N 338.367 2.086 50 1 EEGF CCOc1cc(-c2cccc(F)c2)nn1C(=O)CCCCC(=O)NN 587871082 ZDFPOVVHOZAYKQ-UHFFFAOYSA-N 348.378 2.278 50 1 EEGF C=C(C(=O)O)[C@@H]1CC[C@@]2(OO)C=C(OC(C)=O)C(=O)[C@H](C)[C@@]2(C)C1 85608479 ORRRVLHZUXGGCG-ZSRFRPKPSA-N 338.356 2.328 50 1 EEGF CCCN1N=C[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@H](Cl)C1=O 587423306 WODSKEVBVQPWIM-RGYTYGDFSA-N 348.786 2.027 50 1 EEGF NNC(=O)N1N=C(c2cccc3ccccc23)C[C@]1(O)C(F)(F)F 200297797 ZEOIMJIXHJMVPA-AWEZNQCLSA-N 338.289 2.084 50 1 EEGF C[C@@]1(CS(=O)(=O)c2ccc(F)cc2)OO[C@@H]2C[C@@H]1CC[C@@]2(C)O 100835294 LHISGEJBLVJODQ-SRMUXQRQSA-N 344.404 2.240 50 1 EEGF O=C(O)CCC(=O)O[C@@]12CCCC[C@@H]1[C@@H]1CCCC[C@@]1(O)OO2 169314779 NMOQQEQDHSENLC-UAXWRAGISA-N 328.361 2.122 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)C[C@@H](O)[C@H]4[C@@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 195286838 VCMOVYRZBUORCV-ZTRGUGGUSA-N 328.405 2.202 50 1 EEGF C=C(C)C(=O)OCCOc1ccc(O)n1-c1ccnc(CCl)n1 587939358 DRWYQUFFTNGHMS-UHFFFAOYSA-N 337.763 2.210 50 1 EEGF O=C(CCCCCC(=O)NN/C=C/c1ccccc1Cl)NO 40951907 BQLNACBDWMLDOW-ZHACJKMWSA-N 325.796 2.387 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@]23COC(=O)[C@H]13 2356518436 QCUXRKJBHSUAJV-HRYJEPKJSA-N 348.439 2.169 50 1 EEGF CN(C)CCSSCCCNC(=O)c1ccc2nn[nH]c2c1 618007608 BVOWKLGRSFTPOR-UHFFFAOYSA-N 339.490 2.021 50 1 EEGF C=C(CCO)C(=O)[C@@H]1C[C@@H]2C(=C)C(=O)O[C@@H]2/C=C(\C=O)CC/C=C/1C 100003269 ZNQBXCCAMXIRHG-PAVCNGPDSA-N 344.407 2.464 50 1 EEGF biogenic,in-vitro O=[P@]1(N(CCCl)CCCl)NC[C@@H](Br)CO1 1559319 FANXZPANFQUGNC-KWKYVRJSSA-N 339.985 2.257 50 1 EEGF C[C@@H]1CC[C@]2(C)C(C=O)=CCC[C@@H]2[C@]1(C)C[C@@H]1O[C@@H](O)C(=O)[C@]12CO2 2356475883 TYEWCIUNKYTNGK-UMOFYOLXSA-N 348.439 2.410 50 1 EEGF O=C(O)CCC(=O)O[C@]12CCCC[C@@H]1[C@@H]1CCCC[C@]1(O)OO2 253633742 NMOQQEQDHSENLC-VZAMPYOESA-N 328.361 2.122 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@@]2(C)CC2=C(C(=O)OC2=O)[C@@H](CC)C1 2356337067 UQDSFYQHSIUJQU-RAALSFIWSA-N 332.352 2.229 50 1 EEGF CC(=CC=O)O[C@@H]1[C@H](O)c2c(ccc3ccc(=O)oc23)OC1(C)C 2356641514 SIHQKLUJMQEDIR-NVXWUHKLSA-N 330.336 2.485 50 1 EEGF CCOC(=O)C[C@@H]1CC[C@]2(OCCC[C@@H]2CC(=O)OCC)OO1 299827373 GHPFIDWYRPTEMF-WWGRRREGSA-N 330.377 2.126 50 1 EEGF O=C(CBr)NCCc1nc2ccc3ncccc3c2[nH]1 586971662 VVDOUOIAMGLQFP-UHFFFAOYSA-N 333.189 2.165 50 1 EEGF CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H](O)[C@H]1Br 40576148 SFECHFUZAGUXCD-GXTWGEPZSA-N 337.169 2.096 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](Cn3ccnc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]32OO4 43911375 NZOBFHPRHGUZAL-DQHMTSTNSA-N 348.399 2.272 50 1 EEGF C=C1C[C@H](O)[C@H](Br)C(C)(C)[C@]12C=C[C@](O)(CO)CC2 2356824596 GWKDEWRFZLOGGJ-VIRABCJISA-N 331.250 2.157 50 1 EEGF COC(=O)[C@]1([C@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 587371471 DXHXYLUGIOWIEV-RMLUDKJBSA-N 342.189 2.238 50 1 EEGF O=C(CCCCc1ccc(O)cc1)NNCc1ccc(O)c(O)c1O 1772585732 PMKFMQLJQUPNJI-UHFFFAOYSA-N 346.383 2.043 50 1 EEGF C#C/C=C/C[C@@H](O)[C@H]1C[C@H](Br)[C@H](C[C@H]2O[C@@H]2CC)O1 140650989 CDQFURANXHAJLL-SMUGRMHISA-N 329.234 2.415 50 1 EEGF CC1=C(C)[C@@H]2CC(=O)C3=C(C(=O)OC(=O)[C@@]4(C[C@H]4C)[C@@H]3O)[C@@]2(C)CC1 299852012 LZBFFUIMRBNBSD-VCQJUBLQSA-N 344.407 2.479 50 1 EEGF O=C(O)c1cc2nc(-c3ccc4c(c3)C(=O)OC4=O)[nH]c2cc1F 586906071 IDXZNMZHLRALKN-UHFFFAOYSA-N 326.239 2.378 50 1 EEGF CCN(CC)C(=S)SS(=O)(=O)c1ccccc1C(=O)O 1860822 VTOARZRCEHQXJY-UHFFFAOYSA-N 333.456 2.433 50 1 EEGF Fc1ccc(CN(CCBr)CCn2cncn2)c(F)c1 95597201 XYGJYVNWGFTMFN-UHFFFAOYSA-N 345.191 2.453 50 1 EEGF C=C(C)O[C@H]1C[C@@](C)(O)[C@]23CC[C@](C)(OO2)[C@H]3[C@H]2OC(=O)C(=C)[C@@H]12 238740042 KRHWRXFBYHSTFI-DKIXKERFSA-N 336.384 2.027 50 1 EEGF CC1=Nc2ccccc2/C1=C/NNC(=O)CNC(=O)c1ccccc1 104007061 ZWHRDGMTPUFPTP-LFIBNONCSA-N 334.379 2.184 50 3 EEGF O=C(CCl)Nc1ccc(-c2nc(O)cc(C(F)(F)F)n2)nc1 64527378 YKJLXBHEZBZUHA-UHFFFAOYSA-N 332.669 2.440 50 1 EEGF O=CC=Cc1cc(O)c2c(c1)[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 2356604676 CGSLPFBMGQUTKF-SUMWQHHRSA-N 328.320 2.225 50 1 EEGF COc1ccc(SSC[C@H](CO[N+](=O)[O-])O[N+](=O)[O-])cc1 34280314 CCUVMPCVTKVPNN-VIFPVBQESA-N 336.347 2.221 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@@]1(C)O)[C@]42OO3 43379933 QEZXEMZAZAJVRG-NILWJSOBSA-N 328.405 2.346 50 1 EEGF COc1cc(/C=C(\C#N)n2nnc3ncccc32)cc(OC)c1OC 1857633397 HIZISTLDWAILKG-KPKJPENVSA-N 337.339 2.374 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)[C@H](O)C[C@@H]([C@H]1C)[C@]42OO3 42784674 WFIMQBUUYYWZTM-YKXKEMOVSA-N 328.405 2.202 50 1 EEGF COc1ccc2c(c1)[C@]1(C=NN(C)C(=O)[C@H]1Cl)N(C(C)C)CC2 962091106 LJABMLNKGOSGSO-WBVHZDCISA-N 335.835 2.222 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@@H](C)CC[C@@H]([C@H]1C)[C@]24OO3 169358361 VCMOVYRZBUORCV-YKXKEMOVSA-N 328.405 2.202 50 1 EEGF O=C(/C=C\c1ccc(O)c(O)c1)OC(=O)/C=C\c1ccc(O)c(O)c1 200323773 QDPOOGQUCJJZAO-VHOZIDCHSA-N 342.303 2.305 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@]341 169336932 YYDGJYRFMZGTTH-GZDPUBOHSA-N 347.842 2.398 50 1 EEGF CN1C(=O)CN=C(OCCBr)c2cc(Cl)ccc21 169344217 VVAIRBDPXCAHEH-UHFFFAOYSA-N 331.597 2.475 50 1 EEGF COBN1CC[C@@H](Cl)[C@@H]1CCCc1ccc(C(=O)OC)s1 2356704736 GFUALJXBCRMIQS-NEPJUHHUSA-N 329.658 2.452 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 2356594376 SDDXIQONGFZHJH-MSOLQXFVSA-N 328.320 2.183 50 1 EEGF COBN1CC[C@@H](Cl)[C@H]1C=CCc1ccc(C(=O)OC)s1 2356629944 WBEBIWGZXCXPAQ-VXGBXAGGSA-N 327.642 2.228 50 1 EEGF COc1cc2c3c(c1)O[C@](/C=C\N1CCOCC1)(CCl)[C@@H](C2)C3=O 587417090 JDQGEYIGDXEKDG-LUHWXXHMSA-N 349.814 2.266 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 587009559 LFYCLWHRPQNBLZ-UHFFFAOYSA-N 335.770 2.478 50 1 EEGF N#CC(=C1NC(=O)c2ccccc21)c1nc2ccccc2n1CCO 1857621855 OGERPIZNHRNITB-UHFFFAOYSA-N 330.347 2.164 50 1 EEGF O=C(N/N=C/CCC/C=N/NC(=O)c1ccncc1)c1ccccc1 1857775373 ZKNBJOVRNGYXSR-HGEIODPWSA-N 337.383 2.383 50 1 EEGF N[C@]1(C(=O)O)CCc2cccc(N(CCCl)CCCl)c2C1 49777345 DCALVZNJOJZUFO-OAHLLOKOSA-N 331.243 2.241 50 1 EEGF COc1ccccc1CC(=O)NCCSSCCN(C)C 618008192 UENJXJNCYRCUGP-UHFFFAOYSA-N 328.503 2.297 50 1 EEGF COc1cc2c3c(c1)O[C@](CCl)(/C(C#N)=C\N(C)C)[C@@H](C2)C3=O 587417770 PYVGZKCOXSSLKA-QZBKATBPSA-N 332.787 2.389 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](Cn3ccnc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 101331059 NZOBFHPRHGUZAL-QNHMRRABSA-N 348.399 2.272 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N1CCOCC1)(CCl)O2 587373115 PTWXHOOOSVNMCL-YATRRXNKSA-N 336.819 2.366 50 1 EEGF CC1(C)[C@@H](Br)[C@H](O)C[C@@]2(O)C[C@](C)(O)[C@H]3CC[C@]12C3 2356535052 MWFIODJGZKGRJI-OOGIVXTNSA-N 333.266 2.213 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]24OO3 169358362 VCMOVYRZBUORCV-UTIGNYLQSA-N 328.405 2.202 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)C[C@@H](O)[C@H]4[C@@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 195286845 VCMOVYRZBUORCV-IBAGJQFLSA-N 328.405 2.202 50 1 EEGF CCCCC1=C(Br)[C@](O)(CBr)OC1=O 2356808545 YXPCCFJPLSRLKJ-VIFPVBQESA-N 328.000 2.466 50 1 EEGF CCC=CC1=C2CCC3=C(C(=O)OC3=O)[C@@H](CCC)[C@@]2(O)OC1=O 2356722092 XYCWVVKRGCDXIK-ACJLOTCBSA-N 332.352 2.085 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@]23C(=O)OC[C@H]13 2356398141 MINYUKIOXDRRRQ-AFJOWOCMSA-N 348.439 2.169 50 1 EEGF O=C(NO)c1cccc(C(=O)N/N=C/c2ccc3ccccc3n2)c1 95808777 HHPTZVSHJQHIMG-YBFXNURJSA-N 334.335 2.118 50 1 EEGF COC(=O)[C@@H](Cl)[C@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 587381240 DLNSKNRWGAJHRK-RISCZKNCSA-N 333.718 2.327 50 1 EEGF CSC1=C(C#N)C(=S)N=C(N)[C@H]1C(=O)Nc1ccc(C)cc1 6522553 SEHNHLRJEZEOPM-NSHDSACASA-N 330.438 2.389 50 1 EEGF CCCC[C@@H](/C=N/NC(=O)NC(=O)OC)NC(=O)OC(C)(C)C 28569530 YBAKWZAABWFUSD-CNOAHFENSA-N 330.385 2.121 50 1 EEGF CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\NC(=O)CC#N 103289657 PFKFHISSKWOGIS-ZTZLBLTJSA-N 327.340 2.380 50 1 EEGF COc1cccc(CC(=O)NNC(=O)Nc2ccccc2OC)c1 103215706 TWVXKBICRKJPEX-UHFFFAOYSA-N 329.356 2.099 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@@H](OC(=O)CCC)[C@H]12 2356696186 NSSIFSOSOVNSCJ-BGTYHANMSA-N 348.395 2.022 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@]42OO3 169340897 JEAMUJGJFHFTDV-KVHVZWHCSA-N 326.389 2.410 50 1 EEGF CC(C)=C[C@@H]1C=C(C=O)[C@@H]2CC[C@@]3(C)C[C@@]4(O[C@@H]4C[C@@H]3O)[C@@H]2[C@@H]1O 15160416 GFEUOMWJSRIDTL-SRVJNQFMSA-N 332.440 2.393 50 1 EEGF biogenic C[C@@H](CO)C1=C2CC=C(C=O)[C@H]3C(=O)[C@H](O)[C@H](C)[C@@H]3C[C@@]2(C)CC1 15109023 NDSSXIGJWWQDCU-CGXVUTKLSA-N 332.440 2.443 50 1 EEGF CCOc1ccc(NC(=O)C/C(C)=N/NC(=O)c2cnccn2)cc1 5336496 FOLNLOIFRIVAFB-CIAFOILYSA-N 341.371 2.010 50 3 EEGF C=C(CCO)C(=O)[C@@H]1C[C@H]2C(=C)C(=O)O[C@H]2C=C(C=O)CCC=C1C 2356709347 ZNQBXCCAMXIRHG-SQNIBIBYSA-N 344.407 2.464 50 1 EEGF CCOC(=O)C[C@@H]1CC[C@@]2(OCCC[C@H]2CC(=O)OCC)OO1 299827372 GHPFIDWYRPTEMF-HEHGZKQESA-N 330.377 2.126 50 1 EEGF CN(C)c1ccc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)cc1 1020939 WTAQGOMWUXSCDU-XDHOZWIPSA-N 325.368 2.288 50 3 EEGF Cc1nn(C)c2c1[C@H](c1ccc(-n3ccnc3)cc1)C(C#N)=C(N)O2 1772649399 KRCBRQYKLGVCAS-MRXNPFEDSA-N 332.367 2.132 50 1 EEGF CCOC(=O)C1=C(CCl)NC(=O)N(C(C)=O)[C@@H]1c1ccccc1 36382009 FTTRTCXAIINYAQ-CQSZACIVSA-N 336.775 2.355 50 1 EEGF O=C(Cc1ccncc1)N/N=C1\C(=O)Nc2c(Cl)ccc(Cl)c21 72179556 HIURSLKURPBLRF-UHFFFAOYSA-N 349.177 2.404 50 1 EEGF CC(=O)OCC1=CO[C@H](OC(C)=O)[C@H]2C(C=O)=CC[C@H]3[C@@H]([C@@H]12)C3(C)C 238755683 QSTPSLPUPAFWRJ-KFGODFMUSA-N 348.395 2.386 50 1 EEGF NCCSSCCNC(=O)c1cc2cccc(O)c2cc1O 618007782 QBBHWCJTHLOZMK-UHFFFAOYSA-N 338.454 2.321 50 1 EEGF CN(C)S(=O)(=O)c1cccc2nc(/C=C\CBr)[nH]c12 586973447 KBYSFYPVPALUAU-DAXSKMNVSA-N 344.234 2.221 50 1 EEGF Cc1[nH]nc2ccc3nc(-c4sccc4B(O)O)c4c(c3c12)CCC4 1857536177 WGUSLEXIIILOSO-UHFFFAOYSA-N 349.224 2.317 50 1 EEGF Cc1cccc2c1NC(=O)/C2=N\NC(=O)Cc1ccc(O)c(Cl)c1 72178444 SSVVHEPJWXSRJY-UHFFFAOYSA-N 343.770 2.369 50 1 EEGF Fc1ccccc1CN(CCBr)CCn1cncn1 95593803 NXXRKUOATDOLJD-UHFFFAOYSA-N 327.201 2.314 50 1 EEGF O=C(O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)CCl)[C@@H]23 72113487 UCKSWBJGKMRSBG-CFAJVAMVSA-N 342.867 2.182 50 1 EEGF CC[C@]1([C@H](Cl)C(=O)OC)NC[C@@H]2CC(=O)N(C)c3cccc1c32 963038586 WLUNXLXQIXQZHS-FGDXXIHYSA-N 336.819 2.126 50 1 EEGF CCOC(=O)/C(CCc1ccccc1)=N\NC(=O)c1ccncc1 36460150 NZBVGWHCISCVBF-SILNSSARSA-N 325.368 2.363 50 1 EEGF CC[C@]1([C@H](Cl)C(=O)OC)NC[C@H]2CC(=O)N(C)c3cccc1c32 963038587 WLUNXLXQIXQZHS-FNDUUJAJSA-N 336.819 2.126 50 1 EEGF CC(=O)C[C@@H]1O[C@@H]2[C@@H]3[C@H](C(=O)C=C(C)[C@H]13)[C@H](C)CO[C@@]2(C)C=CC=O 2356651591 SPGKLZOENIXNTQ-BUIUMOGMSA-N 346.423 2.291 50 1 EEGF COc1cc2c3c(c1)O[C@@]1(CCOC[C@H]1Br)[C@@H](C2)C3=O 587416692 CGGQWFRWCHEPHX-NVBFEUDRSA-N 339.185 2.365 50 1 EEGF O=C(CNC(=O)c1ccccc1F)N/N=C\C=C\c1ccccc1 15967953 YHVCVPVYYBRMTA-MIAABOGCSA-N 325.343 2.371 50 3 EEGF C=C(C)O[C@@H]1C[C@](C)(O)[C@@]23CC[C@@](C)(OO2)[C@@H]3[C@H]2OC(=O)C(=C)[C@H]21 2356745571 KRHWRXFBYHSTFI-LGLJPOHYSA-N 336.384 2.027 50 1 EEGF Cn1cc(/C=N/NC(=O)CCCCCC(=O)NO)c2ccccc21 95809376 IXGYFAQFZPQCER-WOJGMQOQSA-N 330.388 2.084 50 1 EEGF CC(=O)Nc1ccc(Cl)c(-c2nc3ccc(C(=O)NN)cc3[nH]2)c1 587048869 BTNSZIBWGYHOKY-UHFFFAOYSA-N 343.774 2.445 50 1 EEGF C=C(C)O[C@@H]1C[C@](C)(O)[C@@]23CC[C@@](C)(OO2)[C@@H]3[C@H]2OC(=O)C(=C)[C@@H]21 2356745569 KRHWRXFBYHSTFI-DQHMTSTNSA-N 336.384 2.027 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@@H]1c1cccc(O)c1 1632058 ZOLXELYLFMBTES-HOTGVXAUSA-N 330.771 2.157 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOC[C@@H]1Br)O2 587372291 KCMKWSNWMGGNOY-JSGCOSHPSA-N 326.190 2.465 50 1 EEGF Cc1nn(C)c2c1[C@@H](c1cccc(Br)n1)C(C#N)=C(N)O2 1772623037 LVGJLAODIMNLEM-GFCCVEGCSA-N 346.188 2.104 50 1 EEGF O=C(O[C@H]1CSS(=O)(=O)C1)c1cccc(Br)c1 96283353 DFWLDJBLOHVNKZ-VIFPVBQESA-N 337.216 2.051 50 1 EEGF CN1CCc2cn(C)nc2[C@]12CC(C)(C)CC(=O)[C@H]2Br 963956521 XVQJVHYQDUXFGG-IUODEOHRSA-N 340.265 2.256 50 1 EEGF C[C@@]12CC[C@@H](O)[C@@](C)(CO)[C@H]1CCC(C=O)=C2CCC1=CCOC1=O 73277569 IPLCBUUDZLVSAQ-HNJRGHQBSA-N 348.439 2.315 50 1 EEGF CC(=O)[C@]1(C)[C@H](C)O[C@](C)(CO)[C@H]1O[Si](C)(C)c1ccccc1 195495764 MMCUZIIBJNFDQR-DZOHQFGASA-N 336.504 2.249 50 1 EEGF COc1cc2c3c(c1)O[C@@](CCl)(c1cc(C(N)=O)co1)[C@@H](C2)C3=O 587423242 UIRUVWGRMZUMKQ-APPDUMDISA-N 347.754 2.269 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](CO)O2 14557597 SDDXIQONGFZHJH-QHNPVBQMSA-N 328.320 2.183 50 1 EEGF endogenous,in-man C[C@]1(CS(=O)(=O)c2ccccc2)OO[C@H]2C[C@H]1CC[C@@]2(C)O 169328779 PFAJNVCFGCXGRB-SLBVQIDZSA-N 326.414 2.101 50 1 EEGF COC(=O)[C@H](Cl)[C@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 587381239 DLNSKNRWGAJHRK-FZMZJTMJSA-N 333.718 2.327 50 1 EEGF CC[C@H]1CC2=C(C[C@@]3(C)C(=O)OC(=O)/C3=C/[C@@H]1CC)C(=O)OC2=O 85801277 RUGDWJCVKKJESL-RWNRDZQUSA-N 332.352 2.229 50 1 EEGF COc1cccc(C(=O)N/N=C/c2cc(OC)cc(OC)c2O)c1 49068160 OYRKOIQBKPVKDX-VCHYOVAHSA-N 330.340 2.182 50 1 EEGF COCC(=O)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 43552603 MRHDLMHIDOLBQR-UHFFFAOYSA-N 337.416 2.082 50 1 EEGF COc1ccc([C@H]2C[C@]34OO[C@](C)(C=C3C(=O)O2)[C@H](C)O4)cc1OC 96934024 KPWNQLYPOLDXNU-IMKJFWDFSA-N 348.351 2.454 50 1 EEGF O=C(/C=C\c1ccc(O)c(O)c1)OC(=O)/C=C/c1ccc(O)c(O)c1 200323803 QDPOOGQUCJJZAO-KYPMKJFLSA-N 342.303 2.305 50 1 EEGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(C)cc2B(O)O)N1 962944740 FCDHNRUYFXTDMS-DJJJIMSYSA-N 334.228 2.170 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H]([C@@H](C)[N+](=O)[O-])C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 44388464 HCFKFIURHYVHFM-PRUZWZHBSA-N 341.360 2.040 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@@H](C)C(=O)C[C@@H]([C@H]1C)[C@@]42OO3 169364895 CTFKREBDWZQSCT-AIXMNOFRSA-N 326.389 2.410 50 1 EEGF N[C@H](CCl)c1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 587009919 DBPRXXGWXOEINN-ZCFIWIBFSA-N 327.715 2.095 50 1 EEGF C=CCC1=CC=C/C(=C\NNC(=O)CNc2ccccc2OC)C1=O 13119009 ZCVLEVWZCHVKKG-NTCAYCPXSA-N 339.395 2.253 50 3 EEGF COc1cccc(/C=N/NC(=O)c2c[nH]c3c(F)cccc3c2=O)c1 653861069 NNYQYLPTQMTSDE-ZVBGSRNCSA-N 339.326 2.440 50 1 EEGF CC1=NN(CC(=O)N/N=C/c2ccc(C(F)(F)F)cc2)C(=O)CC1 103220041 DNOWGZBCRFUUSW-UFWORHAWSA-N 340.305 2.154 50 1 EEGF CC1=NN(CC(=O)N/N=C/c2ccc(Cl)cc2Cl)C(=O)CC1 103218764 VKUMRPHKEMAYEW-REZTVBANSA-N 341.198 2.442 50 1 EEGF C#CC=CC[C@@H]1O[C@H]2C[C@H]1O[C@H](CC)[C@H](Br)C[C@H]2O 2356501087 NOYIFPKKLJWDFK-PMXAPFLYSA-N 329.234 2.415 50 1 EEGF O=C1NC[C@@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1ccc(Cl)s1 4867036 PLHMXBHYYNWJTI-GJMKPKGPSA-N 347.827 2.381 50 3 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@H]1c1cccc(O)c1 5838384 ZOLXELYLFMBTES-HZPDHXFCSA-N 330.771 2.157 50 1 EEGF O=C(N/N=C\c1ccncc1)c1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 33285599 MPYGUNIVOFEYMB-ZDLGFXPLSA-N 336.311 2.144 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 140055958 PFAJNVCFGCXGRB-TUUVXOQKSA-N 326.414 2.101 50 1 EEGF O=C(NNC(=S)Nc1ccc(Cl)cc1)c1cc([N+](=O)[O-])c[nH]1 299839753 TVMGZUMSGDYDSF-UHFFFAOYSA-N 339.764 2.208 50 1 EEGF N#C/C(=C\c1ccc(O)c(O)c1)C(=O)N1CCN(c2ccccc2)CC1 12352689 LKHXJJMDMFKAPD-FOWTUZBSSA-N 349.390 2.354 50 1 EEGF COC1=C/C(=C2/C=C(c3ccc(F)cc3)NC(N)=C2C#N)C=CC1=O 34209443 AECVPESPVQRYCC-OWBHPGMISA-N 335.338 2.429 50 3 EEGF CCCc1[nH]nc2c1[C@H](c1ccc(O)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1857773515 VZIJGKGTUGOXGQ-CYBMUJFWSA-N 341.327 2.194 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@]2(C)CC2=C(C[C@@H]1CC)C(=O)OC2=O 2356657751 RUGDWJCVKKJESL-XVYUCKLSSA-N 332.352 2.229 50 1 EEGF CCOC(=O)C(=O)[C@H](Cl)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 587371205 DSJMSPNAFBNHFS-HOCLYGCPSA-N 339.775 2.041 50 1 EEGF O=c1ccc2c3c(c4ccccc4n13)=CCN2CCBr 2356871108 XXJDLUWSMKWGEX-UHFFFAOYSA-N 329.197 2.167 50 1 EEGF O=C(N/N=C/c1ccc(O)cc1)c1nc(-c2ccc(F)cc2)no1 45392386 ASSDKBKJDKSVLT-GIJQJNRQSA-N 326.287 2.345 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2c(F)cnc(Br)c2[nH]1 587009948 XPKCPHVMPSMGHZ-UHFFFAOYSA-N 349.591 2.450 50 1 EEGF COC(=O)[C@]1([C@H](Cl)C(C)=O)N[C@@H]2CC[C@H]2c2ccc(OC)cc21 962990144 BBHBXSKIRNKXJM-CRNXPOROSA-N 337.803 2.109 50 1 EEGF Cc1ccc(/C=N/NC(=O)Cn2c(=O)c(C)nc3ccccc32)cc1 207930148 CAGIKYSTGJHLQH-RGVLZGJSSA-N 334.379 2.164 50 1 EEGF O=C(CCCC[C@H]1CCSS1)NCCCCS(=O)(=O)O 1772575541 AUFOYOYAWBEMDY-NSHDSACASA-N 341.520 2.485 50 1 EEGF OC[C@H]1[C@@H]2C[C@H](n3cnc4c(NC5CC5)ncnc43)[C@H]1C[C@@H]2Cl 103231999 WUJBVISELVFJMZ-VLJOUNFMSA-N 333.823 2.197 50 1 EEGF CC(=O)OCC1=CO[C@H](OC(C)=O)[C@@H]2C(C=O)=CC[C@@H]3[C@@H]([C@H]12)C3(C)C 14618791 QSTPSLPUPAFWRJ-HSFUPAIVSA-N 348.395 2.386 50 1 EEGF biogenic O=C(O)CCCCCC(=O)N/N=C/c1cccnc1Br 95808598 NYANMCSKLAGLBC-CXUHLZMHSA-N 342.193 2.329 50 1 EEGF CN(C)CCSSCCNC(=O)[C@H]1CC(=O)c2ccccc21 618008282 XEUOEMRJANIPNB-AWEZNQCLSA-N 338.498 2.416 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 14557600 SDDXIQONGFZHJH-ZSCXUVNLSA-N 328.320 2.183 50 1 EEGF endogenous,in-man O=C(CCCSCCCl)Nc1ccc(P(=O)(O)O)cc1 1559210 FOBPLCXYOBBQMI-UHFFFAOYSA-N 337.765 2.180 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@@H]1c1ccc(O)cc1 1632068 FYMORAVOLCMQCC-HOTGVXAUSA-N 330.771 2.157 50 1 EEGF O=c1cc(CCl)oc(CN2CCN(Cc3ccccc3)CC2)c1O 96922712 PEUBMCZLKYWXLW-UHFFFAOYSA-N 348.830 2.402 50 1 EEGF Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCSSCCN 618007547 DILJKEFEZBJDNW-UHFFFAOYSA-N 329.447 2.363 50 1 EEGF N#CC1=C(N)[C@H]2[C@@H](C=C1N)Oc1cc(O)ccc1[C@H]2c1ccccc1 101011714 VIUWVURDHWPCKS-QRVBRYPASA-N 331.375 2.494 50 1 EEGF COc1ccc(Cl)cc1C#Cc1c(C)nn([C@@H](C)C(=O)NN)c1C 587902396 DMBINNGBSDMKET-LBPRGKRZSA-N 346.818 2.113 50 1 EEGF COc1cccc(CCC(=O)NNC(=O)Nc2cccc(OC)c2)c1 103223687 OBWMXDHPZMJIFT-UHFFFAOYSA-N 343.383 2.489 50 1 EEGF O=C1C=CC([N+](=O)[O-])=C/C1=C\NNC(=O)C12CC3CC(CC(C3)C1)C2 13122136 KCNYWLBKWLFCAV-GXDHUFHOSA-N 343.383 2.007 50 3 EEGF CCCc1c(O)ccc2c1O[C@]1(C=NN(C)C(=O)[C@H]1Cl)CC2=O 587461529 NAHNMPNRDLZSJH-ZBFHGGJFSA-N 336.775 2.114 50 1 EEGF CC(=O)NC(=O)Nc1cccc(NC(=O)[C@@H](C)Br)c1 40975494 KJDYKJJVWPEHNY-SSDOTTSWSA-N 328.166 2.077 50 1 EEGF CNCCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 143946179 UZPOTTLIUZBCEZ-ZZUVJJEMSA-N 341.448 2.430 50 1 EEGF C=C(C=O)[C@@H]1CC[C@@H](C)[C@H]2CC(=O)C(COC(C)=O)=C2[C@@H]1OC(C)=O 238750027 VUEXXQYNBHUERB-NYGAIPDWSA-N 348.395 2.168 50 1 EEGF CCOc1ccc2sc(S(C)(=O)=O)nc2c1NC(=O)CCl 1772578520 UYMMYNDZJZSZPB-UHFFFAOYSA-N 348.833 2.276 50 1 EEGF CCCOc1ccc2[nH]c3cnc(C(=O)NN)c(COC)c3c2c1 13803708 LPKBUGHEXSSVCI-UHFFFAOYSA-N 328.372 2.255 50 1 EEGF NC(=S)NNC(=O)c1ccc(C(=O)c2ccccc2Cl)cc1 73222365 KZNLWBPLBIAWKK-UHFFFAOYSA-N 333.800 2.049 50 1 EEGF CN(C)CCSSCCCNC(=O)CSc1ncccn1 618007903 MJTUVTRILGRLMG-UHFFFAOYSA-N 346.547 2.018 50 1 EEGF C[C@]1(O)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccc(F)cc1 169329301 LHISGEJBLVJODQ-MEYUZBJRSA-N 344.404 2.240 50 1 EEGF CC[C@@H]1/C=C2/C(=O)OC(=O)[C@]2(C)CC2=C(C[C@@H]1CC)C(=O)OC2=O 85550657 RUGDWJCVKKJESL-UXTAJBLDSA-N 332.352 2.229 50 1 EEGF O=C(CCCC[C@@H]1CCSS1)NCCCS(=O)(=O)O 1772570986 SZYIEKXYLQGLFW-SNVBAGLBSA-N 327.493 2.095 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]24OO3)[C@@]1(C)O 102185776 QEZXEMZAZAJVRG-DCIDONQNSA-N 328.405 2.346 50 1 EEGF C#C/C=C/C[C@H]1O[C@@H]2C[C@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 114629754 NOYIFPKKLJWDFK-SIALDNDWSA-N 329.234 2.415 50 1 EEGF COc1ccc(C(=O)O[C@@H]2CC(C)=C(C=O)[C@@H]2CC=O)cc1OC 33968701 OYFYFVQAQPRUMI-XJKSGUPXSA-N 332.352 2.354 50 1 EEGF biogenic O=c1cc(CCl)oc(CN2CCN(c3ccccc3)CC2)c1O 96922700 VCAARCPXUJWVIU-UHFFFAOYSA-N 334.803 2.406 50 1 EEGF CCOC(=O)/C(C#N)=C\C=C1C=CN(CC(=O)N(CC)CC)C=C1 95595406 YDHHIMIERCZUBA-PXNMLYILSA-N 329.400 2.137 50 1 EEGF O=C/C=C/c1ccc2c(c1)O[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 33913507 NTXXGPYGMQQSML-QLJMBOKNSA-N 328.320 2.183 50 1 EEGF biogenic,in-vitro COC(=O)[C@H](Cl)[C@@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 587381241 DLNSKNRWGAJHRK-SMDDNHRTSA-N 333.718 2.327 50 1 EEGF COc1ccc(C=NNC(=O)c2cnn(-c3ccccc3)c2N)cc1 957994843 UCJBHUKBUXPXEA-UHFFFAOYSA-N 335.367 2.227 50 1 EEGF Nc1nc(NNC(=O)c2ccncc2)nc2sc3c(c12)CCCC3 1857745997 KDXJFHZDVCFITP-UHFFFAOYSA-N 340.412 2.304 50 1 EEGF COc1ccc(N/C=C(\C#N)C(=O)NC(=O)Cc2ccccc2)cc1 6624963 SNTMDFSXAHCCHL-FYWRMAATSA-N 335.363 2.400 50 1 EEGF CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)NN/C=C1/C=CC=N1)CO2 15934882 YYYWWTOMMQWIMR-IVOILVROSA-N 327.384 2.227 50 3 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)C(=O)C[C@@H]([C@H]1C)[C@]42OO3 43872244 CTFKREBDWZQSCT-NTJHIOENSA-N 326.389 2.410 50 1 EEGF O=C(N/N=C/c1cc(O)c(O)c(O)c1)c1cc2ccccc2cc1O 141631962 NMBXBCTVFAOQDF-DJKKODMXSA-N 338.319 2.426 50 1 EEGF CC(=O)c1ccc(N2C[C@H](CNC(=O)C(Cl)Cl)OC2=O)cc1 29411077 LRXVJIYZBFVGAM-NSHDSACASA-N 345.182 2.134 50 1 EEGF C=C(CCO)C(=O)[C@@H]1C[C@@H]2C(=C)C(=O)O[C@@H]2C=C(C=O)CCC=C1C 2356709346 ZNQBXCCAMXIRHG-KZNAEPCWSA-N 344.407 2.464 50 1 EEGF Cn1cc(C(=O)C(=O)NNc2ccccc2)c2cc([N+](=O)[O-])ccc21 27215292 YPPURGSCFDJRGX-UHFFFAOYSA-N 338.323 2.413 50 1 EEGF CN1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O 587499811 NBNFZMUHXVXBTD-DOTOQJQBSA-N 332.787 2.335 50 1 EEGF O=C(N/N=C/c1ccc(O)cc1)c1cc[n+](Cc2ccccc2)cc1 436365 BVJUTNGYBIYTCH-UHFFFAOYSA-O 332.383 2.492 50 3 EEGF O=C(CCCCc1ccccc1)NNCc1ccc(O)c(O)c1O 1772599138 CQOBRJZTCBMPTI-UHFFFAOYSA-N 330.384 2.337 50 1 EEGF N#C/C(=C1/Nc2ccccc2S1)c1ccnc(N2CCNCC2)n1 13647693 GPFQNWAFDISNFD-FOWTUZBSSA-N 336.424 2.296 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@@H](C)CC[C@H]([C@H]1C)[C@]24OO3 169358357 VCMOVYRZBUORCV-CYZGLRLQSA-N 328.405 2.202 50 1 EEGF CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C[C@@H]1F 170069608 UCKHKSBXKBGHKE-GMXVVIOVSA-N 344.459 2.184 50 1 EEGF N#C/C(C(=O)c1cscn1)=C(/O)c1cc(O)c(O)c([N+](=O)[O-])c1 1857581697 NZRFNTZIUQKIED-XFFZJAGNSA-N 333.281 2.138 50 1 EEGF COBN1CC[C@H](Cl)[C@@H]1C=CCc1ccc(C(=O)OC)s1 2356629943 WBEBIWGZXCXPAQ-RYUDHWBXSA-N 327.642 2.228 50 1 EEGF N#CC1=C(N)[C@H]2Cc3ccc(OCN4CCCC4)cc3O[C@@H]2CC1=N 34804524 VYKFPPSJVIFFTC-KBXCAEBGSA-N 338.411 2.198 50 1 EEGF O=C/C=C\c1cc(O)c2c(c1)[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 13312760 CGSLPFBMGQUTKF-CPPLEKLPSA-N 328.320 2.225 50 1 EEGF endogenous,in-man O=C(O[C@@H]1CSS(=O)(=O)C1)c1cccc(Br)c1 96283352 DFWLDJBLOHVNKZ-SECBINFHSA-N 337.216 2.051 50 1 EEGF COc1ccc(Cl)cc1C#Cc1ccccc1OCC(=O)NN 587903288 ZACRNGPJGIHNJX-UHFFFAOYSA-N 330.771 2.117 50 1 EEGF CC1(C)[C@@H](Br)CC[C@]2(C)O[C@H]3COC(=O)C3=C[C@@H](O)[C@@H]12 5963918 YGUXFWBBYGJSHK-SQRMYFJTSA-N 345.233 2.188 50 1 EEGF biogenic CCOC(=O)C(=O)[C@H](Cl)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 587371203 DSJMSPNAFBNHFS-GOEBONIOSA-N 339.775 2.041 50 1 EEGF CC(=O)Oc1cccc(C(=O)NCCSSCCN(C)C)c1 618007655 DMFGAEGFQRJFRZ-UHFFFAOYSA-N 342.486 2.285 50 1 EEGF C=C(C)C(=O)O[C@H]1C/C(C=O)=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)C(=C)[C@H]12 101672258 NGGWPCQJJXMSHR-WSFMCSFISA-N 346.379 2.039 50 1 EEGF CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)N(C)C#N 66101069 KQYFHIPAAHRARB-ZFWWWQNUSA-N 332.404 2.114 50 1 EEGF CN(C)CCSSCCNC(=O)Nc1ccc(CCO)cc1 618007732 NEQWDMLLKBFMNW-UHFFFAOYSA-N 343.518 2.286 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C=O)CC[C@@H]([C@H]1C)[C@]42OO3 43379947 JEAMUJGJFHFTDV-TWPHGLHBSA-N 326.389 2.410 50 1 EEGF O=C(CCCCC(=O)N/N=C/c1cc(Br)cs1)NO 95809394 VSYHQSOMBHVMAO-AWNIVKPZSA-N 348.222 2.027 50 1 EEGF COc1ccc(C(=O)O[C@@H]2CC(C)=C(C=O)[C@H]2CC=O)cc1OC 33968702 OYFYFVQAQPRUMI-CZUORRHYSA-N 332.352 2.354 50 1 EEGF biogenic C[C@@H]1CC[C@]2(C)C(C=O)=CCC[C@@H]2[C@]1(C)C[C@@H]1O[C@H](O)C(=O)[C@]12CO2 2356475881 TYEWCIUNKYTNGK-JYSJSCSISA-N 348.439 2.410 50 1 EEGF CCOC(=O)c1c(C)[nH]c(C(=O)N/N=C\c2ccccc2O)c1C 22573539 VATKTUGIORRSPI-NVMNQCDNSA-N 329.356 2.278 50 1 EEGF C=C(C)[C@@H]1CC[C@@]23CO[C@@]4(OO2)C2=C(C(=O)C(C)=C[C@@H]1[C@@H]23)[C@H](O)[C@H]4C 238767755 AINNPETUGJFTND-CKQJUXFJSA-N 344.407 2.468 50 1 EEGF C#CCOC(=O)[C@@]1(C)c2[nH]c3ccccc3c2CCN1C(=O)CCl 96174901 FCBGSDAUOVDSHM-GOSISDBHSA-N 344.798 2.183 50 1 EEGF CN(C)CCSSCCNC(=O)Cc1ccc(N(C)C)cc1 618008084 RHGVRJBGXBKEKL-UHFFFAOYSA-N 341.546 2.354 50 1 EEGF CN(C)C(=O)c1ccc2nc(-c3ccc4c(c3)C(=O)OC4=O)[nH]c2c1 586905781 BVCSXNYEZZUUEY-UHFFFAOYSA-N 335.319 2.242 50 1 EEGF CC(C)(O)[C@@H]1CC[C@@](C)(N=C=S)[C@H]2CC[C@@]3(C)O[C@@H](O)[C@]12O3 2356388192 WAWKSTXGMZGGDY-DIEKJCKJSA-N 327.446 2.259 50 1 EEGF Cc1ccc(C(=O)NCCCSSCCN)c([N+](=O)[O-])c1 618007906 UMPDYPRMMJNKRJ-UHFFFAOYSA-N 329.447 2.363 50 1 EEGF C=C[C@]1(C)[C@H](O)[C@@H]2OC(=O)C(=C)[C@@H]2[C@H](OCC(C)C)[C@@H]1C(=C)C=O 2356692171 MPMVQQPKRNZSDV-DFUGEXAVSA-N 334.412 2.064 50 1 EEGF BrCc1nc2cc(I)cnc2[nH]1 586972216 KAWFTXULXZOPAY-UHFFFAOYSA-N 337.946 2.457 50 1 EEGF C=C(C)[C@H]1CC[C@@]23CO[C@@]4(OO2)C2=C(C(=O)C(C)=C[C@H]1[C@H]23)[C@@H](O)[C@H]4C 169652783 AINNPETUGJFTND-MZUJIBFDSA-N 344.407 2.468 50 1 EEGF O=C1[C@H](Cl)[C@@]2(C(=O)Nc3ccccc32)N1c1ccccc1[N+](=O)[O-] 103174361 BNCADPSEIFMMCJ-BBRMVZONSA-N 343.726 2.396 50 1 EEGF CN(C)NC(=O)Nc1cccc2c1C(=O)c1c(-c3ccco3)n[nH]c1-2 13588752 SVDSBNPNJXQKMN-UHFFFAOYSA-N 337.339 2.479 50 1 EEGF COc1ccc(C(=O)NN(C(=O)c2snnc2C)C(C)(C)C)cc1 103214517 SJNUIFNNIIAMCA-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF COc1ccc(SSC[C@@H](CO[N+](=O)[O-])O[N+](=O)[O-])cc1 34280313 CCUVMPCVTKVPNN-SECBINFHSA-N 336.347 2.221 50 1 EEGF C[C@H](Br)C(=O)Nc1ccc(C2=NNC(=O)C[C@@H]2C)cc1 27881545 BJBIKCDDHROHFL-IUCAKERBSA-N 338.205 2.269 50 1 EEGF NNC(=O)c1ccc2nc(C[C@@H](N)c3ccccc3Cl)[nH]c2c1 587056049 GWSOZAJCONKPFB-GFCCVEGCSA-N 329.791 2.062 50 1 EEGF CCc1ccc(OCC(=O)NN/C(C)=C2\C=CC(=O)C=C2O)cc1 103980702 NIKVCBWTSWYOJM-FOWTUZBSSA-N 328.368 2.103 50 3 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]24OO3)[C@]1(C)O 102183536 QEZXEMZAZAJVRG-GNBQBNJVSA-N 328.405 2.346 50 1 EEGF C#C/C=C\C[C@H]1O[C@@H]2C[C@H]1O[C@@H](CC)[C@H](Br)C[C@@H]2O 143002284 NOYIFPKKLJWDFK-WEIRLIPGSA-N 329.234 2.415 50 1 EEGF O=C1NC(=O)c2ccc(N3CC[N+](CCCl)=N3)c3cccc1c23 1772598866 KCPNEQGWPHDRSX-UHFFFAOYSA-O 329.767 2.162 50 1 EEGF CNC(=O)CSc1nc2ccc(NC(=O)CCl)cc2s1 66102270 LHZIKEQTXUIBOS-UHFFFAOYSA-N 329.834 2.312 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@@]23COC(=O)[C@H]13 2356518437 QCUXRKJBHSUAJV-RQQUZUBOSA-N 348.439 2.169 50 1 EEGF COc1cc(C(=O)NNC2=CC(=O)CC(C)(C)C2)cc(OC)c1OC 18325176 XANJYQNNYBZLEZ-UHFFFAOYSA-N 348.399 2.220 50 3 EEGF COc1ccc(-n2nnn(C/C(C#N)=C/c3ccc(C)cc3)c2=O)cc1 98084570 FRDBYXSOFAUMKG-LFIBNONCSA-N 347.378 2.353 50 1 EEGF N#Cc1c(NC(=O)CCCCl)[n+](=O)c2ccc(Cl)cc2n1O 377797419 WDWOTNYAHOXSPP-UHFFFAOYSA-O 342.162 2.276 50 1 EEGF CN1CCc2cn(C)nc2[C@]12CC(C)(C)CC(=O)[C@@H]2Br 963956522 XVQJVHYQDUXFGG-SWLSCSKDSA-N 340.265 2.256 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@H](Br)[C@H](C[C@H]2O[C@@H]2CC)O1 2356508117 CDQFURANXHAJLL-RODWMJHOSA-N 329.234 2.415 50 1 EEGF COc1ccc(/C(N)=N/OC(=O)Oc2ccc([N+](=O)[O-])cc2)cc1 4293435 QQTOGMIGLJEWQO-UHFFFAOYSA-N 331.284 2.439 50 1 EEGF biogenic O=C(CCc1nc(O)c2ccccc2n1)N/N=C/c1ccc(O)cc1 299856883 KPPCTASRHKCKNC-YBFXNURJSA-N 336.351 2.124 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@@H]1OO[C@]2(C)CS(=O)(=O)c1ccc(F)cc1 169328300 LHISGEJBLVJODQ-VCOSZWKGSA-N 344.404 2.240 50 1 EEGF Cc1ccc2c(n1)C(=O)C(NCCBr)=C(Cl)C2=O 102030998 GXGLVQRMXXBVFF-UHFFFAOYSA-N 329.581 2.204 50 1 EEGF NC(=O)c1[nH]c2ccc(Cl)cc2c1[P@@](=O)(O)c1ccccc1 59425501 NLOYHFPXKZDKFR-UHFFFAOYSA-N 334.699 2.141 50 1 EEGF C=C[C@]1(C)[C@H](O)[C@@H]2OC(=O)C(=C)[C@@H]2[C@@H](OCC(C)C)[C@H]1C(=C)C=O 2356692173 MPMVQQPKRNZSDV-UXAGXGOUSA-N 334.412 2.064 50 1 EEGF O=C(N/N=C/c1cccc(O)c1)c1c[nH]c2c(F)cccc2c1=O 653890342 YWEXMFVQOOGJIZ-DNTJNYDQSA-N 325.299 2.137 50 1 EEGF Cc1ccnc2c1CCN[C@@]2(CCl)c1ccc2c(c1)oc(=O)n2C 963070511 NPNGIRCFULLGFM-SFHVURJKSA-N 343.814 2.463 50 1 EEGF O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(B(O)O)cc1 653709181 ZMAGOGCRJOYAIY-UHFFFAOYSA-N 331.180 2.215 50 1 EEGF CCN1C(=O)/C(=N\NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 96900174 XYDJEGQPZHCVKM-SDXDJHTJSA-N 338.323 2.095 50 1 EEGF C[C@@]1(O)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 140055807 PFAJNVCFGCXGRB-BVUBDWEXSA-N 326.414 2.101 50 1 EEGF COc1ccc(C(=O)O[C@H]2CC(C)=C(C=O)[C@@H]2CC=O)cc1OC 33968703 OYFYFVQAQPRUMI-BBRMVZONSA-N 332.352 2.354 50 1 EEGF biogenic O=C1C=CC=C/C1=C\NNC(=O)C(O)(c1ccccc1)c1ccccc1 11592491 DWAVWVHFJDITPR-FOCLMDBBSA-N 346.386 2.122 50 3 EEGF COc1ccc(C(=O)NCCCSSCCN(C)C)cn1 618017260 JVQOVVBMIMHJQF-UHFFFAOYSA-N 329.491 2.153 50 1 EEGF CC(C)(C(=O)NCC(F)F)c1ccc(S(=O)(=O)/C=C/C#N)cc1 147636235 HGSRDVPDDVTITP-YCRREMRBSA-N 342.367 2.156 50 1 EEGF C/C(=C/COc1cc(O)c2c3c(c(O)cc(C)c13)C(=O)OC2=O)CO 198421041 NHJQBXCLDCRFQD-BAQGIRSFSA-N 344.319 2.187 50 1 EEGF CN(C)CCSSCCNC(=O)COc1ccc(F)cc1 618009275 VAIZALKRSPASEW-UHFFFAOYSA-N 332.466 2.264 50 1 EEGF C=C(C=O)[C@@H]1CC[C@H](C)[C@H]2CC(=O)C(COC(C)=O)=C2[C@H]1OC(C)=O 2356440298 VUEXXQYNBHUERB-UPCNBGPOSA-N 348.395 2.168 50 1 EEGF COc1cc(OC)cc([C@@H]2C(C#N)=C(N)Oc3c2ccc(N)c3N)c1 38153959 CHSNDOVNDLBURC-HNNXBMFYSA-N 338.367 2.086 50 1 EEGF N#CC(=C\c1ccccc1)/C=C1\SC(=S)N(CC(=O)O)C1=O 103229610 YXZJUAVIQRDPBU-IODUZNRKSA-N 330.390 2.422 50 1 EEGF O=C(CCCCCC(=O)N/N=C/c1c(O)ccc2ccccc12)NO 62233514 MGFWCLLOOQRTHP-XDHOZWIPSA-N 343.383 2.451 50 1 EEGF O=C(O[C@H]1CSS(=O)(=O)C1)c1ccc(Br)cc1 96911540 NTHXZDNUXPKRSH-VIFPVBQESA-N 337.216 2.051 50 1 EEGF COC(=O)[C@]1([C@H](Cl)C(C)=O)N[C@H]2CC[C@H]2c2ccc(OC)cc21 962990147 BBHBXSKIRNKXJM-FAYQHZLMSA-N 337.803 2.109 50 1 EEGF COc1cc(/C=C(\C#N)C(N)=O)cc(CSC2=NCCS2)c1O 12352673 AEZUIGRHDSRYGK-ONNFQVAWSA-N 349.437 2.129 50 1 EEGF COc1ccc(CSCC(=O)NN/C=C2\C=CC=CC2=O)cc1 13130257 ZZSJQQMYIWTOIT-GXDHUFHOSA-N 330.409 2.128 50 3 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C)C(=O)C[C@@H]([C@H]1C)[C@]42OO3 169364894 CTFKREBDWZQSCT-QLIYMYOWSA-N 326.389 2.410 50 1 EEGF COc1ccccc1C(=O)NN(C(=O)c1snnc1C)C(C)(C)C 103214520 MZSLOHVCCCJOME-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF Cc1cc(/C=N/NC(=O)Cn2c([N+](=O)[O-])cnc2C)cc(C)c1C 96927657 QMXLKULOMWBWCP-CNHKJKLMSA-N 329.360 2.175 50 1 EEGF O=C(NNc1ncnc2sc3c(c12)CCC3)c1cc(O)ccc1O 1772652670 HJJLUUSVJGQGRD-UHFFFAOYSA-N 342.380 2.348 50 1 EEGF Cc1ccc(C)c2c1NC(=O)/C2=N\NC(=O)CCc1ccc(O)cc1 72180377 SKVJZZMBRYYAGT-UHFFFAOYSA-N 337.379 2.414 50 1 EEGF CCN(CC)S(=O)(=O)c1ccc2nc(CBr)[nH]c2c1 586971884 AASCJAMFUXEAFO-UHFFFAOYSA-N 346.250 2.488 50 1 EEGF CCCCC1=C(Br)[C@@](O)(CBr)OC1=O 2356808544 YXPCCFJPLSRLKJ-SECBINFHSA-N 328.000 2.466 50 1 EEGF COc1cccc(CC(=O)NNC(=O)Nc2cccc(OC)c2)c1 103202966 GNDSTFRVYRFRKL-UHFFFAOYSA-N 329.356 2.099 50 1 EEGF COc1ccc(NCc2ccc3sc(B(O)O)cc3c2)cc1OC 170095949 IQEFBPFYMDWCHP-UHFFFAOYSA-N 343.213 2.210 50 1 EEGF NNC(=O)CC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 49784245 VTALJJONSKALMC-UHFFFAOYSA-N 336.432 2.384 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@@]24OO3)[C@@]1(C)O 169358882 QEZXEMZAZAJVRG-BXQYZQJKSA-N 328.405 2.346 50 1 EEGF CN(C)CCSSCCCn1cc(-c2cncn2C)nn1 618010409 WVTUIUWJDZBPMA-UHFFFAOYSA-N 326.495 2.012 50 1 EEGF COc1cc(/C=C/C(=O)N/N=C/c2ccc(O)c(OC)c2)ccc1O 1857598211 ZCKUVHXHXUYSSE-CEGJKDKLSA-N 342.351 2.279 50 1 EEGF O=C(Cc1ccc2ccccc2c1)NNC(=O)c1ccc([N+](=O)[O-])o1 13649163 UCJQERPCMJXITB-UHFFFAOYSA-N 339.307 2.345 50 1 EEGF O=C(CI)C(Br)Br 85951974 UDPFVNCNMONXIZ-UHFFFAOYSA-N 341.768 2.106 50 1 EEGF endogenous,in-man CCOC(=O)[C@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587376357 WZVQCRASXDIGHT-CQSZACIVSA-N 342.189 2.239 50 1 EEGF CSc1nc(NNC=O)cc(Oc2ccc(NC(C)=O)cc2)n1 2182903 DIDCJTWPGGDDBW-UHFFFAOYSA-N 333.373 2.022 50 3 EEGF Cc1ccc2c([C@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)cc(=O)oc2c1 1772605400 CDCYSNFIXIDFRY-INIZCTEOSA-N 334.335 2.351 50 1 EEGF Cc1nn(C)c2c1[C@H](c1cccc(Br)n1)C(C#N)=C(N)O2 1772623038 LVGJLAODIMNLEM-LBPRGKRZSA-N 346.188 2.104 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H](CC)[C@H](Br)C[C@@H]2O1 2356459195 BYFHPYMVXVHPFO-QZOBBIQNSA-N 329.234 2.415 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](CC[N+](=O)[O-])C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 42876569 VCPJCCFAEYRMGE-GYDAVGPASA-N 341.360 2.042 50 1 EEGF COc1ccc(/C=N/NC(=O)c2ccc(OCCN(C)C)cc2)cc1 1772581334 FTACZSPNKNLXBP-XSFVSMFZSA-N 341.411 2.400 50 1 EEGF CCc1cc(C(=O)NN/C=C2\C=CC(=O)C=C2O)c2ccccc2n1 15885214 CUYSUGXWRPEEJT-VAWYXSNFSA-N 335.363 2.496 50 3 EEGF CCOc1ccc2c(c1)sc(=N)n2CCSS(=O)(=O)O 101837977 PPTRIINIKAPFFE-UHFFFAOYSA-N 334.444 2.117 50 1 EEGF C[C@@H](Br)C(=O)Nc1ccc(C2=NNC(=O)C[C@H]2C)cc1 27881552 BJBIKCDDHROHFL-RKDXNWHRSA-N 338.205 2.269 50 1 EEGF CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H](O)[C@@H]1Br 40576146 SFECHFUZAGUXCD-OCCSQVGLSA-N 337.169 2.096 50 1 EEGF CC(/C=N/Nc1ccc([N+](=O)[O-])cc1)=N\NC(=O)c1ccc(N)cc1 1857757363 VEHWQNUOGAADID-XOBNHNQQSA-N 340.343 2.381 50 1 EEGF C[C@@]12CCCC(/C=N/NC(=O)CC#N)=C1C(=O)O[C@H]2c1ccoc1 103289733 SUSOOMYACNCGOV-BKXMXULZSA-N 327.340 2.380 50 1 EEGF O=C(O[C@@H]1CSS(=O)(=O)C1)c1ccc(Br)cc1 96911537 NTHXZDNUXPKRSH-SECBINFHSA-N 337.216 2.051 50 1 EEGF CCOC(=O)c1nc2nc(O)nc(O)c2cc1CCCCCl 587368406 JTVRDDCLGYERKH-UHFFFAOYSA-N 325.752 2.174 50 1 EEGF C=CCN1C(=O)/C(=N\NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 103914824 JPRGYJBAVFULFQ-JZJYNLBNSA-N 349.346 2.082 50 3 EEGF CCOc1ccc([C@@H]2C[C@H]2C(=O)NNC(=O)c2ccncc2)cc1 49110833 XZLCAXJGTXAHSN-JKSUJKDBSA-N 325.368 2.045 50 1 EEGF N#CCN1C(=O)N(Cc2ccccc2)S(=O)(=O)C2=C[C@@H](Cl)C=C21 103274842 VYISCNLLIUHZKN-LBPRGKRZSA-N 349.799 2.166 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@H](Br)[C@H](C[C@H]2O[C@H]2CC)O1 2356508120 CDQFURANXHAJLL-WCBJTDJXSA-N 329.234 2.415 50 1 EEGF CCCc1c(O)ccc2c1O[C@@]1(C=NN(C)C(=O)[C@H]1Cl)CC2=O 587461509 NAHNMPNRDLZSJH-GDBMZVCRSA-N 336.775 2.114 50 1 EEGF O=C(N/N=C\c1cccc([N+](=O)[O-])c1)c1nc(O)c2ccccc2n1 33661309 IFPCDJLGQZGKKE-MFOYZWKCSA-N 337.295 2.008 50 1 EEGF Cc1nc2cc(C(=O)N/N=C\c3ccc(C)o3)c([N+](=O)[O-])cc2[nH]1 40943630 AZYBEYNCXVADDH-APSNUPSMSA-N 327.300 2.445 50 1 EEGF CC(C)=C[C@@H]1C=C(C=O)[C@H]2CC[C@@]3(C)C[C@@](O)(CC[C@@H]3O)[C@@H]2[C@H]1O 238740539 NNYDKNNENGAMBY-IHTGJJIASA-N 334.456 2.377 50 1 EEGF NNC(=O)c1ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c2c1 587034877 IKQNJOBHIQZPEO-CYBMUJFWSA-N 328.397 2.084 50 1 EEGF CC(C)(O)[C@@H]1CC[C@](C)(N=C=S)[C@@H]2CC[C@@]3(C)O[C@H](O)[C@@]12O3 143685261 WAWKSTXGMZGGDY-CCRZTJIVSA-N 327.446 2.259 50 1 EEGF COC(=O)[C@@H](Cl)[C@@]1(C(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587418834 AVMNCMSTMYATCN-ICDUWSABSA-N 346.713 2.227 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@H]1c1ccc(O)cc1 1632069 FYMORAVOLCMQCC-JKSUJKDBSA-N 330.771 2.157 50 1 EEGF N#CC(=Cc1ccc(O)c(O)c1)C(=Cc1ccc(O)c(O)c1)NC=O 2356691723 VDPHYDSLIYDKAP-UHFFFAOYSA-N 338.319 2.203 50 1 EEGF CN(C)CCOc1ccc2nc(C(C)(C)NC(=O)CCl)[nH]c2c1 587009654 OQBFKFPABUWFSD-UHFFFAOYSA-N 338.839 2.093 50 1 EEGF NNC(=O)c1ccc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c2c1 587017123 RYXIHOHXYSTEFW-GFCCVEGCSA-N 329.385 2.141 50 1 EEGF N[C@](S)(/C=C/c1ccc(Cl)cc1)NNC(=O)c1ccncc1 96910747 FDHCZUVBMJWIDW-SBJJXXPASA-N 334.832 2.225 50 1 EEGF O=C(N/N=C/c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 45285898 DVXIJBYNJYQFOZ-DEDYPNTBSA-N 327.359 2.426 50 1 EEGF NCCSSCCCNC(=O)C(=O)c1c[nH]c2ccccc12 618007656 JUVXCLYAGWVMFW-UHFFFAOYSA-N 337.470 2.197 50 1 EEGF COc1cccc(CCC(=O)NNC(=O)Nc2ccccc2OC)c1 103202978 NEWCDTUKMBYHME-UHFFFAOYSA-N 343.383 2.489 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](CO)O2 2356594379 SDDXIQONGFZHJH-ZWKOTPCHSA-N 328.320 2.183 50 1 EEGF O=C(Cc1ccc(O)cc1)N/N=C1\C(=O)Nc2c(Cl)cccc21 72180338 HNVOBOIYCNVTSG-UHFFFAOYSA-N 329.743 2.061 50 1 EEGF NNC(=O)c1ccc2nc(CCc3cc(F)c(F)c(F)c3)[nH]c2c1 587138854 UBXBQQAWPPKWEC-UHFFFAOYSA-N 334.301 2.369 50 1 EEGF Cc1cc(C)n(CCC(=O)NN/C=C2\C(=O)C=Cc3ccccc32)n1 13126343 BAXMEDJLOFGWOO-ATVHPVEESA-N 336.395 2.148 50 3 EEGF COc1ccc2c(c1)[C@@]1(C=NN(C)C(=O)[C@H]1Cl)N(C(C)C)CC2 962091104 LJABMLNKGOSGSO-NVXWUHKLSA-N 335.835 2.222 50 1 EEGF COC(=O)[C@@H](Cl)[C@]1(C(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587418823 AVMNCMSTMYATCN-AOAMOSOWSA-N 346.713 2.227 50 1 EEGF COc1cccc2[nH]c(/C(C#N)=C/c3ccc(OCC(N)=O)cc3)nc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c1ccc2c(c1)O[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 2356549959 NTXXGPYGMQQSML-ROUUACIJSA-N 328.320 2.183 50 1 EEGF NNC(=O)c1ccc2nc([C@H]3Cc4cc(Cl)ccc4O3)[nH]c2c1 587079292 CCGGSGZONUYGJR-CQSZACIVSA-N 328.759 2.496 50 1 EEGF COC(=O)[C@]1([C@H](Cl)C(C)=O)N[C@@H]2CC[C@@H]2c2ccc(OC)cc21 962990151 BBHBXSKIRNKXJM-MMTVNHQJSA-N 337.803 2.109 50 1 EEGF CS/C(N)=N/NC(=O)CCC(=O)Nc1ccccc1C(F)(F)F 17176549 PURRQGDREFMXPE-UHFFFAOYSA-N 348.350 2.133 50 1 EEGF CC(/C=N/Nc1ccc([N+](=O)[O-])cc1)=N\NC(=O)c1ccccc1N 1857756659 NYOJYQSEEAQOGS-XOBNHNQQSA-N 340.343 2.381 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@]314 253714178 YYDGJYRFMZGTTH-LTDZFSOHSA-N 347.842 2.398 50 1 EEGF CC1=NN(c2nc(N)nc(/C(C#N)=C/c3ccncc3)n2)C(C)(C)C1 5582346 KVORLFQBKNOGOP-MDWZMJQESA-N 334.387 2.278 50 1 EEGF C/C(=N\NC(=O)c1ccc(N(C)C)cc1)c1ccc(C(=O)NO)cc1 653785034 YBJMRJLHXVKOOB-XDHOZWIPSA-N 340.383 2.026 50 1 EEGF COC1=C/C(=N/Nc2ccc(Br)cc2)C=C(C=O)C1=O 104011921 GJEBARMLZSSRAJ-SFQUDFHCSA-N 335.157 2.455 50 3 EEGF CCN1CC[C@@]2(OC)OC(N)=C(C#N)[C@@H](c3ccc(C)cc3)[C@@H]2C1 299839266 SBMYVLOZABURHL-YQVWRLOYSA-N 327.428 2.487 50 1 EEGF CCOc1cc(-c2cccc(F)c2)nn1-c1cc(C(=O)NN)ccn1 587871131 BAWTZRPALPVVOR-UHFFFAOYSA-N 341.346 2.076 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@@]341 27767021 YYDGJYRFMZGTTH-GJIOXVOLSA-N 347.842 2.398 50 1 EEGF COc1cc2c3c(c1)O[C@]1(C=NN(C(C)C)C(=O)[C@H]1Cl)[C@@H](C2)C3=O 587422187 SDAJNBARJNRRMX-UXEPBGEESA-N 348.786 2.025 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@@H](OC(=O)CCC)[C@@H]12 2356696189 NSSIFSOSOVNSCJ-UBDQQSCGSA-N 348.395 2.022 50 1 EEGF CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@H](O)[C@H]1Br 29135451 DIBKKQIYKZQPKG-GXTWGEPZSA-N 337.169 2.253 50 1 EEGF Fc1cccc(CN(CCBr)CCn2cncn2)c1 95595298 LILGYYKVYHJQAK-UHFFFAOYSA-N 327.201 2.314 50 1 EEGF CN(C)CCSSCCNC(=O)CCC(=O)c1ccccn1 618007790 IHUMRSLYFAERIZ-UHFFFAOYSA-N 341.502 2.104 50 1 EEGF N#CC1=COc2ccc(Cl)cc2[C@@]12N[C@H]1Cc3c2ccnc3C1=O 963289230 JZDFFDMEZHTILR-KBXCAEBGSA-N 335.750 2.489 50 1 EEGF COc1cccc(C(=O)NCCSSCCN(C)C)c1O 618007737 GWFHTTRAMWZEJA-UHFFFAOYSA-N 330.475 2.074 50 1 EEGF O=C(N/N=C\c1ccc(O)cc1O)Nc1cccc2nsnc12 84615341 RLBVMDNZMOAABQ-CHHVJCJISA-N 329.341 2.258 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@H]1c1cccc(O)c1 1632059 ZOLXELYLFMBTES-JKSUJKDBSA-N 330.771 2.157 50 1 EEGF COc1ccc(Cl)cc1C#Cc1c(C)nn([C@H](C)C(=O)NN)c1C 587902390 DMBINNGBSDMKET-GFCCVEGCSA-N 346.818 2.113 50 1 EEGF CCN1C(=O)/C(=N\NC(=O)CNc2cccc(C)c2)c2ccccc21 102655301 LRRGIESDOOOFBR-PYCFMQQDSA-N 336.395 2.294 50 3 EEGF NNC(=O)c1ccc2[nH]c(C(=O)Cc3ccc(Cl)cc3)nc2c1 587072720 VNMQVIHGEBXMPM-UHFFFAOYSA-N 328.759 2.245 50 1 EEGF Cc1cc([N+](=O)[O-])ccc1C(=O)NCCCSSCCN 618007584 GUBIOTHHNLBWDP-UHFFFAOYSA-N 329.447 2.363 50 1 EEGF COc1cc(C)ccc1OCc1nc2ccc(C(=O)NN)cc2[nH]1 587564157 LGBFRYXPLPTJDT-UHFFFAOYSA-N 326.356 2.062 50 1 EEGF CN(C)CCSSCCC(=O)Nc1ccc(CCO)cc1 618008140 ZQWVYIYFFJKKET-UHFFFAOYSA-N 328.503 2.493 50 1 EEGF CN(C)S(=O)(=O)c1ccc2nc(/C=C\CBr)[nH]c2c1 586974188 SPUBIKUFDBMPTG-ARJAWSKDSA-N 344.234 2.221 50 1 EEGF CCOC(=O)[C@H](Cl)c1nc2nc(O)nc(O)c2cc1C(C)C 587365847 HWNGDKGTQMUMOV-SECBINFHSA-N 325.752 2.402 50 1 EEGF CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@@H](O)[C@@H]1Br 29135434 DIBKKQIYKZQPKG-OCCSQVGLSA-N 337.169 2.253 50 1 EEGF Cc1nnc2sc(SSc3nn4c(C)nnc4s3)nn12 31910375 UOQYPBAIFIZUMC-UHFFFAOYSA-N 342.460 2.101 50 1 EEGF NNC(=O)CCN1C(=O)c2ccccc2N[C@@H]1c1ccc(Cl)cc1 473136113 XLEOGICALPFXRA-INIZCTEOSA-N 344.802 2.287 50 1 EEGF COc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)c(OC)c1 1020916 HOCDKFISXHYBEQ-YBFXNURJSA-N 342.351 2.239 50 3 EEGF CCOc1ccc(C(=O)NNC(=S)c2ccc(O)cc2O)cc1 103196229 LOJBEHUZXBJVMY-UHFFFAOYSA-N 332.381 2.107 50 1 EEGF Cn1c(=O)c2c(Cl)cccc2c(=O)n1CCCBr 169350376 ZQAUCFHALXVHNO-UHFFFAOYSA-N 331.597 2.139 50 1 EEGF Cc1cc(=O)nc(NN2[C@@H](c3cccc(Cl)c3)C(=O)[C@H]2Cl)[nH]1 17219002 WELQOSZRBQEHGS-AAEUAGOBSA-N 339.182 2.250 50 1 EEGF O=C(CCc1ccc(O)cc1)N/N=C1\C(=O)Nc2cccc(Cl)c21 72181215 NTOBYBGMVRZSPA-UHFFFAOYSA-N 343.770 2.451 50 1 EEGF O=C(O[C@H]1CSS(=O)(=O)C1)c1ccccc1Br 96911543 FPQUJPJFTNXDPS-ZETCQYMHSA-N 337.216 2.051 50 1 EEGF Cc1ccc(NC(=O)c2ccc3c(c2)C(=O)OC3=O)c(C(=O)O)c1 653780383 KMXVWNSZSJZBRK-UHFFFAOYSA-N 325.276 2.256 50 1 EEGF CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N/N=C/c1ccccc1 13554697 OLHQJXCIPBJPCN-OZNZCJATSA-N 348.406 2.365 50 3 EEGF O=C1C=C/C(=C\NNC(=O)NC23CC4CC(CC(C4)C2)C3)C(O)=C1 15952889 LPAXZEWZMVLOOV-GXDHUFHOSA-N 329.400 2.224 50 3 EEGF CC[C@@H]1Cc2c([nH]c3ccccc23)[C@H](c2ccc(C)cc2B(O)O)N1 962944744 FCDHNRUYFXTDMS-YJYMSZOUSA-N 334.228 2.170 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)cc1O 95808688 JDXXLHQLKYTSFG-LDADJPATSA-N 336.388 2.365 50 1 EEGF N#C/C(=C\c1cc(O)c(O)c([N+](=O)[O-])c1)C(=O)NC1CCCCC1 1857609175 YHEWKABWMFLGGM-IZZDOVSWSA-N 331.328 2.362 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C\N1CCOCC1)(CCl)O2 587373103 PTWXHOOOSVNMCL-BAHPRDJBSA-N 336.819 2.366 50 1 EEGF Cc1c(Sc2ccccc2)n(COCCCl)c(=O)[nH]c1=O 6520180 HITMYBFSWYFIHA-UHFFFAOYSA-N 326.805 2.209 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@H]3COC(=O)[C@@]132 2356695105 TVXYJSQJIDMDKV-GPEJODLCSA-N 348.439 2.169 50 1 EEGF COc1ccc2c(c1)[C@]1(C=NN(C)C(=O)[C@@H]1Cl)N(C(C)C)CC2 962091105 LJABMLNKGOSGSO-RDJZCZTQSA-N 335.835 2.222 50 1 EEGF COc1ccc2c(c1)c(CC(=O)NN)c(C)n2Cc1cccc(O)c1 13445887 AJAUJPWVSXHLLJ-UHFFFAOYSA-N 339.395 2.245 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OCCN)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 97654296 HPGHCIXRRLNXRN-XQLAAWPRSA-N 327.421 2.170 50 1 EEGF in-vitro COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(OC)c1 95809400 CNGFAPQKLMAGKI-LDADJPATSA-N 336.388 2.365 50 1 EEGF C[C@](O)(CBr)C(=O)Nc1ccc(N)c(C(F)(F)F)c1 13581057 XXIAFJWOWGWCTE-JTQLQIEISA-N 341.127 2.372 50 1 EEGF CC(=O)Nc1cccc(N2N=C3COC(C)(C)C=C3C(C#N)=C2N)c1 13838688 HURKZYFXAPIDQF-UHFFFAOYSA-N 337.383 2.250 50 1 EEGF COc1ccc2c(c1OC)[C@@]13C=C(C#N)CC[C@@]1(O)[C@H](C2)N(C)CC3 101047238 MNCVRVFRFKEAMM-PWIZWCRZSA-N 340.423 2.177 50 1 EEGF CC(C)CCO[C@@H]1C=CC(=O)[C@@H](Cn2cc(CCCCl)nn2)O1 169353696 UCFDILKXNMBXQQ-CVEARBPZSA-N 341.839 2.362 50 1 EEGF CC(=O)C[C@@H]1O[C@@H]2[C@H]3[C@@H]1C(C)=CC(=O)[C@@H]3[C@@H](C)CO[C@]2(C)C=CC=O 2356651593 SPGKLZOENIXNTQ-IBLJLCKYSA-N 346.423 2.291 50 1 EEGF C#CC=CC[C@H](Br)[C@@H]1C[C@@H]2O[C@H]([C@H](O)CC)C[C@H]2O1 2356808287 YQCPBXPXSQPWLE-JLZCTACVSA-N 329.234 2.415 50 1 EEGF O=[P@]1(N(CCCl)CCCl)NC[C@H](Br)CO1 1559321 FANXZPANFQUGNC-NZFNHWASSA-N 339.985 2.257 50 1 EEGF C/C(=N\NC(=O)c1ccn(C)n1)c1ccc(NC(=O)C2CCC2)cc1 6780512 PUFQSQOWXSBKQI-UDWIEESQSA-N 339.399 2.313 50 3 EEGF CC(=O)NCc1ccc([C@@]2(CCl)NCCc3c(C)ccnc32)o1 963071372 RHGKCRNQGYAIBS-QGZVFWFLSA-N 333.819 2.247 50 1 EEGF Cc1ccc2oc(=O)cc([C@@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)c2c1 1772650654 IHPTZXIYRZMODP-MRXNPFEDSA-N 334.335 2.351 50 1 EEGF COc1ccc2c(c1)c(CC(=O)NN)c(C)n2Cc1cccc(N)c1 13445885 AABQTLBBLQKBGK-UHFFFAOYSA-N 338.411 2.121 50 1 EEGF CC1(C)OB(c2ccc(N(CCO)CCCl)cc2)OC1(C)C 1857600390 LIEUFGPMPTWSMU-UHFFFAOYSA-N 325.645 2.023 50 1 EEGF CC(=O)C[C@]1(CBr)Nc2ccc([N+](=O)[O-])cc2NC1=O 5582714 PQTRBKMIKGNFDH-GFCCVEGCSA-N 342.149 2.072 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 2356549960 NTXXGPYGMQQSML-ZWKOTPCHSA-N 328.320 2.183 50 1 EEGF COc1ccc(/C=N/NC(=O)c2cc3ccccc3oc2=O)c(O)c1 1857574306 DRIGIDIXJPCUAI-VXLYETTFSA-N 338.319 2.271 50 1 EEGF C=C(CCO)C(=O)[C@@H]1C[C@@H]2C(=C)C(=O)O[C@H]2C=C(C=O)CCC=C1C 2356709345 ZNQBXCCAMXIRHG-KURKYZTESA-N 344.407 2.464 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@@]23C(=O)OC[C@@H]13 2356398146 MINYUKIOXDRRRQ-RHVZCBDQSA-N 348.439 2.169 50 1 EEGF CN(C)CCSSCCCNC(=O)c1ccc(N(C)C)nc1 618017270 KUDIZCFPGNUNRK-UHFFFAOYSA-N 342.534 2.211 50 1 EEGF CCOC(=O)Cc1ccc2nc(C(C)(C)NC(=O)CCl)[nH]c2c1 587009968 YEIMWKJBSNZCSI-UHFFFAOYSA-N 337.807 2.259 50 1 EEGF CCCc1c(O)ccc2c1O[C@]1(C=NN(C)C(=O)[C@@H]1Cl)CC2=O 587461527 NAHNMPNRDLZSJH-HOCLYGCPSA-N 336.775 2.114 50 1 EEGF CC1(C)C=C2C(=NN(c3ccccc3[N+](=O)[O-])C(N)=C2C#N)CO1 13838679 RYEXBFMKVPYTIZ-UHFFFAOYSA-N 325.328 2.200 50 1 EEGF CN(C)CCSSCCNC(=O)c1ccc2oc(O)nc2c1 618017518 MAMANUIDZQVHPQ-UHFFFAOYSA-N 341.458 2.206 50 1 EEGF COc1ccc(Cl)cc1C#Cc1ccc(OCC(=O)NN)c(F)c1 587916819 VSMQOSACRUEGOQ-UHFFFAOYSA-N 348.761 2.256 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@]23C(=O)OC[C@@H]13 2356398145 MINYUKIOXDRRRQ-GPEJODLCSA-N 348.439 2.169 50 1 EEGF COc1ccc2nc(Cl)c(/C=N/NC(=O)c3cnccn3)cc2c1 58598784 UTAWVLDKGZBPHI-DNTJNYDQSA-N 341.758 2.451 50 1 EEGF CC(C)(C)c1ccc2nc(CCNC(=O)CBr)[nH]c2n1 586971169 NKXMJHQVDUOFES-UHFFFAOYSA-N 339.237 2.309 50 1 EEGF NNC(=O)c1ccc2nc(Cc3csc(-c4ccco4)n3)[nH]c2c1 587016973 GATYXBUDXMBMHR-UHFFFAOYSA-N 339.380 2.474 50 1 EEGF CCOC(=O)[C@@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 587376356 WZVQCRASXDIGHT-AWEZNQCLSA-N 342.189 2.239 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@@]314 169336924 YYDGJYRFMZGTTH-VLBUOGOSSA-N 347.842 2.398 50 1 EEGF COc1c2c(c(OC)c3occc13)OC(C)(C)C/C2=N\NC(N)=O 64448582 FPOMISDHKOSPAL-GIJQJNRQSA-N 333.344 2.384 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@@]24OO3 195311724 WFIMQBUUYYWZTM-UFPRHCBYSA-N 328.405 2.202 50 1 EEGF COc1ccc(-c2nc3ccc(C(=O)NN)cc3[nH]2)c(OC)c1C 587786012 AQFGGISZDIMPFI-UHFFFAOYSA-N 326.356 2.159 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@@H]1c1ccc(O)cc1 5838456 FYMORAVOLCMQCC-CVEARBPZSA-N 330.771 2.157 50 1 EEGF CC(C)=C[C@@H]1C=C(C=O)[C@H]2CC[C@@]3(C)C[C@](O)(CC[C@H]3O)[C@@H]2[C@H]1O 166189997 NNYDKNNENGAMBY-FQALRZLUSA-N 334.456 2.377 50 1 EEGF O=C(O[C@@H]1CSS(=O)(=O)C1)c1ccccc1Br 96911542 FPQUJPJFTNXDPS-SSDOTTSWSA-N 337.216 2.051 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2ccc(Br)nc2[nH]1 587006963 AFRXHKVQCNETMV-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF OB(O)c1csc(-c2nc3ccc4n[nH]cc4c3c3c2CCCC3)c1 1857594783 HJMUCWBLANIZRB-UHFFFAOYSA-N 349.224 2.398 50 1 EEGF O=C(C=Cc1ccc(O)c(O)c1)OC(=O)C=Cc1ccc(O)c(O)c1 2356398328 QDPOOGQUCJJZAO-UHFFFAOYSA-N 342.303 2.305 50 1 EEGF Cc1sc2c(c1C)CCN[C@@]2(C)c1ccc(Cl)c(B(O)O)c1 963008063 JBFTVWLBXVPVIF-INIZCTEOSA-N 335.665 2.107 50 1 EEGF CC(=N)/C(C#N)=C(/O)CSc1nnc(Cc2ccccc2F)n1N 101483678 WKQLYJZSJSPQFF-CDBTUVHQSA-N 346.391 2.189 50 1 EEGF O=C(N/N=C/c1ccc(Br)cc1O)c1n[nH]c2c1CCC2 75270944 RHPKONIINNCQTK-FRKPEAEDSA-N 349.188 2.130 50 1 EEGF CNCCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3 43919873 UZPOTTLIUZBCEZ-NZXMNIOVSA-N 341.448 2.430 50 1 EEGF CCOC(=O)C/C(Cc1ccccc1)=N/NC(=O)c1ccncc1 101875809 IAAKBJOQJDKPLT-CAPFRKAQSA-N 325.368 2.363 50 1 EEGF O=C(N/N=C/c1cc2c3c(c1O)CCCN3CCC2)c1ccncc1 1508261 GWWIEDPKDIEFHF-CIAFOILYSA-N 336.395 2.250 50 1 EEGF N#CS/C(=C1\NCCCN1Cc1ccc(Cl)nc1)[N+](=O)[O-] 103285330 DIYKOOAMMRTVPC-VAWYXSNFSA-N 325.781 2.148 50 1 EEGF COOCc1ncn(CC(=O)CCc2ccccc2)c1COOC 89455754 GFPNBIVMIQBVEY-UHFFFAOYSA-N 334.372 2.241 50 1 EEGF CC/N=C1\C[C@H]2Oc3cc(O)c(O)cc3C[C@H]2C(NCC)=C1C#N 169718727 HJAILSWFRFAYEF-WPCYDHCGSA-N 327.384 2.269 50 1 EEGF N#C/C(=C\c1cc(O)c(O)c([N+](=O)[O-])c1)C(=O)NCc1ccccc1 218885829 YMFLHJHFLCZLTD-AWNIVKPZSA-N 339.307 2.229 50 1 EEGF O=C(CNc1ccc(F)cc1)NN/C=C1\C(=O)C=Cc2ccccc21 12475145 DVGZXEJNUFGEPP-BOPFTXTBSA-N 337.354 2.495 50 3 EEGF CC1(C)C(=O)C(C#N)=C[C@]2(C)C3=CC(=O)C(C(N)=O)=C[C@]3(C)CC[C@@H]12 43393897 QQGPVVSUXSCYGB-GKCIPKSASA-N 338.407 2.389 50 1 EEGF CSc1ncccc1C(=O)NCCSSCCN(C)C 618008105 ROPJUAQAROCIMF-UHFFFAOYSA-N 331.532 2.476 50 1 EEGF O=C/C=C/c1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 33831956 SDDXIQONGFZHJH-ZHEVZCJESA-N 328.320 2.183 50 1 EEGF biogenic,in-vitro C#CC=CC[C@@H]1O[C@H]2C[C@H]1O[C@H](CC)[C@@H](Br)C[C@@H]2O 2356501088 NOYIFPKKLJWDFK-RODWMJHOSA-N 329.234 2.415 50 1 EEGF O=C(CCCCCCCCN=C=S)CC(=O)N[C@H]1CCOC1=O 72180856 NBIUMCFAVYHTJQ-AWEZNQCLSA-N 340.445 2.211 50 1 EEGF CN(C)/C=C(\C#N)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 49067952 KBPKXIOBUODARC-VAWYXSNFSA-N 345.358 2.370 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@H]3COC(=O)[C@]132 2356695107 TVXYJSQJIDMDKV-RHVZCBDQSA-N 348.439 2.169 50 1 EEGF CN(C)CCSSCCCNC(=O)CCc1ccccn1 618017997 RTFKIJRCQQIRLF-UHFFFAOYSA-N 327.519 2.464 50 1 EEGF O=C(N/N=C/c1cn(-c2ccccc2Cl)nn1)c1ccncc1 72181228 MCTIOKJPYILRFM-GIJQJNRQSA-N 326.747 2.080 50 1 EEGF O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1CCN=C=S 72178027 QYHFKZSFABCINS-UHFFFAOYSA-N 327.321 2.447 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=NN(C(C)C)C(=O)[C@H]1Cl)O2 587382097 NROLNGPUZOTXLO-ZBFHGGJFSA-N 335.791 2.125 50 1 EEGF C=C(C)C(=O)O[C@H]1C/C(C=O)=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)C(=C)[C@H]12 85889901 NGGWPCQJJXMSHR-HLEMRYDMSA-N 346.379 2.039 50 1 EEGF C=C(C)C(=O)O[C@H]1CC(C=O)=CCC[C@@]2(C)O[C@H]2[C@H]2OC(=O)C(=C)[C@H]12 299808509 NGGWPCQJJXMSHR-ZHEXZJMTSA-N 346.379 2.039 50 1 EEGF N#C/C(=C\c1cc(O)c(O)c([N+](=O)[O-])c1)C(=O)Nc1nccs1 1857573703 RBSYPGWONVFRDB-FPYGCLRLSA-N 332.297 2.008 50 1 EEGF N[C@H](C(=O)N/N=C/c1ccc(O)c(Br)c1)c1ccccc1 95920820 LFYFEEHPORTFLQ-RMNBPEERSA-N 348.200 2.305 50 1 EEGF in-vitro Cc1ccc(/C=N/NC(=O)Cn2nnc(/C=C/c3ccccc3)n2)cc1 1857562632 LGXIHDSZYGWSRA-IUTFFREVSA-N 346.394 2.302 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@@]23C(=O)OC[C@H]13 2356398143 MINYUKIOXDRRRQ-DSEDUUINSA-N 348.439 2.169 50 1 EEGF COC1=C/C(=C/NNC(=O)c2ccccc2-n2cccc2)C=CC1=O 34098172 CAKRFVHLJQLNNM-BUHFOSPRSA-N 335.363 2.265 50 3 EEGF COC(=O)[C@H](Cl)[C@@]1(C(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 587418838 AVMNCMSTMYATCN-XHYYPMHDSA-N 346.713 2.227 50 1 EEGF [C-]#[N+]C1=C2COCCN2C2=C(C(=O)OC2)[C@H]1c1ccc2[nH]nc(C)c2c1 144804444 RWVZNAHDKKVNTP-MRXNPFEDSA-N 348.362 2.243 50 1 EEGF C#C[C@]12C=C(C#N)C(=O)C=C1[C@@]1(C)C=C(C#N)C(=O)[C@@](C)(CO)[C@@H]1CC2 96931922 YFXDZULMXHSEGW-SEVLPDGMSA-N 346.386 2.013 50 1 EEGF C=CCOc1ccccc1/C=N/NC(=O)c1cccc(C(=O)NO)c1 95808990 HFIZDVPGFWMJCE-XDHOZWIPSA-N 339.351 2.134 50 1 EEGF OB(O)c1ccc([C@H]2Nc3ccccc3-c3ccnc4[nH]cc2c34)cc1 170123999 XIWHJAWGWMCWOS-LJQANCHMSA-N 341.179 2.425 50 1 EEGF Cc1ccc2c(n1)C(=O)C(Cl)=C(NCCBr)C2=O 102029820 JYTCBAHMWYMTLK-UHFFFAOYSA-N 329.581 2.204 50 1 EEGF C/C(=N/NC(=O)[C@@H](C)Oc1ccc([N+](=O)[O-])cc1)c1ccccn1 6556217 YUZAKZNLTPXJGT-OTWJJXBCSA-N 328.328 2.298 50 1 EEGF COc1ccc(Cl)cc1C#Cc1cc(C)ccc1OCC(=O)NN 587899519 BWLCIVZBLWXAHF-UHFFFAOYSA-N 344.798 2.426 50 1 EEGF CC(C)(O)/C=C/C=C(/C=O)[C@H]1CC[C@@]2(C)[C@H](O)CC[C@]23COC(=O)[C@H]13 136439155 QCUXRKJBHSUAJV-OSFVSHGUSA-N 348.439 2.169 50 1 EEGF O=C(CCC(=O)NN/C=C1\C=Nc2ccccc21)NCc1ccccc1 13123219 RLYPBIPUDQHADY-JQIJEIRASA-N 348.406 2.461 50 3 EEGF O=C1[C@H](Cl)[C@]2(C(=O)Nc3ccccc32)N1c1ccccc1[N+](=O)[O-] 103174359 BNCADPSEIFMMCJ-XJKSGUPXSA-N 343.726 2.396 50 1 EEGF CS(=O)(=O)N1C[C@H](CCl)c2cc(Br)c(O)cc21 27421184 LWSNDWLUFRMNCZ-LURJTMIESA-N 340.626 2.257 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@@]1(C)O)[C@@]24OO3 195304128 QEZXEMZAZAJVRG-OFZWUMGZSA-N 328.405 2.346 50 1 EEGF COc1ccc(/C=N/NC(=O)Cn2c(=O)oc3ccc(C)cc32)cc1 28868920 UMXKLXIXBGNIHY-VXLYETTFSA-N 339.351 2.062 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@]42OO3 49637495 WFIMQBUUYYWZTM-FSYARZOTSA-N 328.405 2.202 50 1 EEGF COc1ccccc1CCC(=O)NNC(=O)Nc1ccccc1OC 103202968 XXFTVHABKYXMOU-UHFFFAOYSA-N 343.383 2.489 50 1 EEGF CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 95809327 VQQCQFNBAHSWDU-XSFVSMFZSA-N 341.411 2.487 50 1 EEGF Cc1ccc(OCC(=O)NCCSSCCN(C)C)cc1 618009246 ULICJJKHFIOISI-UHFFFAOYSA-N 328.503 2.433 50 1 EEGF COc1cc2c3c(c1)O[C@](CCl)(/C(C#N)=C/N(C)C)[C@@H](C2)C3=O 587417769 PYVGZKCOXSSLKA-JXWXMKRTSA-N 332.787 2.389 50 1 EEGF N#C[C@@H](C(=O)/C(=N\NC(N)=O)[C@@H](C#N)c1ccccc1)c1ccccc1 5722373 GBRSKFAVFMUQFI-QQJQMVHRSA-N 345.362 2.195 50 1 EEGF COc1ccc2oc(C(=O)NNS(=O)(=O)c3ccccc3)cc2c1 38462880 NFVIIMVEICCLCH-UHFFFAOYSA-N 346.364 2.065 50 1 EEGF O=C(Cc1c[nH]c2ccccc12)NNC(=S)Nc1cccnc1 299855657 BEHJYDYLWJHSOU-UHFFFAOYSA-N 325.397 2.123 50 1 EEGF O=C(N/N=C\c1cccc(F)c1)c1c(O)[nH]c2ccccc2c1=O 33319123 KSLUQJNZDPPKRL-OCKHKDLRSA-N 325.299 2.137 50 1 EEGF Cc1nc(NC(=O)[C@H](Cc2ccco2)NC(=O)CCl)sc1C 35941952 VBGPOEZAKXVFKP-NSHDSACASA-N 341.820 2.258 50 1 EEGF Cc1ccc2c([C@@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)cc(=O)oc2c1 1772605401 CDCYSNFIXIDFRY-MRXNPFEDSA-N 334.335 2.351 50 1 EEGF O=C(O)COc1ccc(-c2csc(NC(=O)CCl)n2)cc1 53313335 MEUIJGLFKLMKKA-UHFFFAOYSA-N 326.761 2.451 50 1 EEGF COc1ccc(C2=C(c3ccc([S@](C)=O)cc3)C(=O)OC2=O)cc1 49756649 QJNQHAZXJWHTFU-XMMPIXPASA-N 342.372 2.427 50 1 EEGF N#CCNC(=O)[C@H](CC(Cl)Cl)NC(=O)OCc1ccccc1 100731004 KQTXVBMWFQTKHZ-NSHDSACASA-N 344.198 2.115 50 1 EEGF C=C(C=O)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(COC(C)=O)=C2[C@H]1OC(C)=O 2356440297 VUEXXQYNBHUERB-PNFRGXEZSA-N 348.395 2.168 50 1 EEGF CC(=O)C1=C(O)/C(=C(\C)Nc2ccc3oc(C)nc3c2)C(=O)OC1=O 169320157 IDUMBYDGWCQHJE-QPEQYQDCSA-N 342.307 2.307 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@]314 253714174 YYDGJYRFMZGTTH-HHGJYHCHSA-N 347.842 2.398 50 1 EEGF N#C/C(=C\c1cc(O)c(O)c(Br)c1)C(=N)C(C#N)C#N 169685026 GJJNPOJHPLSZEL-OSPBOQJBSA-N 331.129 2.450 50 1 EEGF C=C(C)O[C@@H]1C[C@](C)(O)[C@@]23CC[C@@](C)(OO2)[C@@H]3[C@@H]2OC(=O)C(=C)[C@@H]12 2356745568 KRHWRXFBYHSTFI-BZDNYCRLSA-N 336.384 2.027 50 1 EEGF Nc1cccc(C(=O)NNS(=O)(=O)c2ccc3ccccc3c2)c1 1857596918 OCIQTHRWJVZLRJ-UHFFFAOYSA-N 341.392 2.045 50 1 EEGF CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@H](O)[C@@H]1Br 29135436 DIBKKQIYKZQPKG-JSGCOSHPSA-N 337.169 2.253 50 1 EEGF Cc1ncc([N+](=O)[O-])n1CC(=O)N/N=C/c1ccc(C(C)C)cc1 96901664 SNJGJDQPMKWFQS-QGMBQPNBSA-N 329.360 2.373 50 1 EEGF OB(O)c1ccsc1[C@@H]1NCCc2cccc(-c3ccccc3)c21 962668707 OAMVSPHKFCXXTC-GOSISDBHSA-N 335.237 2.330 50 1 EEGF O=C(CCl)Nc1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 587368365 IAQAXKHCGWWLKB-UHFFFAOYSA-N 330.731 2.280 50 1 EEGF O=C(CSc1nc2ccccc2o1)N/N=C/c1cccc(O)c1O 653840627 NLPVJMKFVWHNIC-CAOOACKPSA-N 343.364 2.481 50 1 EEGF C[C@H](CO)C1=C2C3=CC=C(C=O)C[C@H](O)[C@]3(C)CC[C@@]2(CO)CC1 84603995 LYWUSVMTERQURN-ISJOWMGUSA-N 332.440 2.300 50 1 EEGF O=C(NNS(=O)(=O)c1ccccc1)c1cccc(Cl)c1F 1857544446 MEYVOIWMDCNRFA-UHFFFAOYSA-N 328.752 2.102 50 1 EEGF Cc1ncc(C=O)c(CNNC(=O)c2cc3c(s2)CCCC3)c1O 169693066 QBOVSNKLERHWNB-UHFFFAOYSA-N 345.424 2.283 50 1 EEGF COc1ccc(Cl)cc1C#Cc1ccc(OCC(=O)NN)c(C)c1 587902576 ZHCWQYOBSNYKOQ-UHFFFAOYSA-N 344.798 2.426 50 1 EEGF COC(=O)C/C=C/N(Cc1ccccc1OC)S(=O)(=O)CCl 61943365 CYOZJPUPEAQGQD-WEVVVXLNSA-N 347.820 2.100 50 3 EEGF O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)O)cc1 1659598 FJRIMDITFTXTKJ-CXUHLZMHSA-N 328.284 2.449 50 1 EEGF NNC(=O)c1cc(-c2ccccc2)nn1Cc1ccc(Cl)nc1 28870622 QMMYTSNPPYOKIJ-UHFFFAOYSA-N 327.775 2.250 50 1 EEGF C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(/C=O)[C@H](O)[C@@H](OC(=O)CCC)[C@H]12 103581946 NSSIFSOSOVNSCJ-YWNBQGKBSA-N 348.395 2.022 50 1 EEGF biogenic,in-vitro N[C@@]1(C(=O)O)CCc2cc(N(CCCl)CCCl)ccc2C1 49777008 VSVFEHBWXVVJJD-HNNXBMFYSA-N 331.243 2.241 50 1 EEGF CN1CCc2cn(C)nc2[C@@]12CC(C)(C)CC(=O)[C@H]2Br 963956394 XVQJVHYQDUXFGG-DOMZBBRYSA-N 340.265 2.256 50 1 EEGF CCCCOc1cccc(C(=O)NNS(=O)(=O)c2ccccc2)c1 1857563512 IPPMHKSTAIYWDZ-UHFFFAOYSA-N 348.424 2.489 50 1 EEGF CCC=CC1=C2CCC3=C(C(=O)OC3=O)[C@@H](CCC)[C@]2(O)OC1=O 2356722093 XYCWVVKRGCDXIK-FZKQIMNGSA-N 332.352 2.085 50 1 EEGF NNC(=O)c1ccc2nc(CCC(=O)c3ccc(F)cc3)[nH]c2c1 587163706 UVMSZIYXPHIHNQ-UHFFFAOYSA-N 326.331 2.121 50 1 EEGF N#CC1=C2C3=CC=C(N4CCSCC4)C4=CC=C[C@@H](C2=NC1=O)[C@@H]43 1857579952 GESSOJAUHWSJSK-CJNGLKHVSA-N 333.416 2.403 50 1 EEGF O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1cc2ccccc2oc1=O 199091114 CFZCHURTSSESJZ-VCHYOVAHSA-N 337.291 2.465 50 1 EEGF O=C(N/N=C/c1ccc([N+](=O)[O-])s1)c1ccc([N+](=O)[O-])c(O)c1 40950581 BZBSTDXKNPMHKM-AWNIVKPZSA-N 336.285 2.034 50 1 EEGF CC1(C)CNP(=O)(NC(=O)Nc2ccc([N+](=O)[O-])cc2)NC1 103221939 BWHHLLIGHUWSPC-UHFFFAOYSA-N 327.281 2.043 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccc(F)cc2)OO[C@@H]2C[C@@H]1CC[C@@]2(C)O 100833918 LHISGEJBLVJODQ-AEAUEXCSSA-N 344.404 2.240 50 1 EEGF CCOc1ccc(/C=N\NC(=O)CCn2nnc3ccccc32)cc1 33292844 LIOXLNGJNNIMCH-UYRXBGFRSA-N 337.383 2.370 50 1 EEGF O=C(Nc1ccccc1)[C@H](Cl)c1ccc2c(O)nc(O)nc2n1 587367576 ZQJOBDVSAJHORS-LLVKDONJSA-N 330.731 2.355 50 1 EEGF N#CC1=C(NC(=S)Nc2ccccc2)NC(=S)N2CCC[C@@H]12 103152780 SSPCCYFXOASGKF-LBPRGKRZSA-N 329.454 2.061 50 1 EEGF CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C[C@H]1F 198165075 UCKHKSBXKBGHKE-NTZNESFSSA-N 344.459 2.184 50 1 EEGF Cn1cc(C(=O)C(=O)NNc2ccc([N+](=O)[O-])cc2)c2ccccc21 13781212 SSXYBMKOKOWFSM-UHFFFAOYSA-N 338.323 2.413 50 1 EEGF C=C(C=O)[C@H]1C[C@H](COC=Cc2ccc(O)cc2)C(CO)=C1C=O 2356340678 VHBCHQFWBGEKKL-NVXWUHKLSA-N 328.364 2.259 50 1 EEGF OB(O)c1ccc([C@@H]2Nc3ccccc3-c3ccnc4[nH]cc2c34)cc1 170123996 XIWHJAWGWMCWOS-IBGZPJMESA-N 341.179 2.425 50 1 EEGF O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C\c1ccncc1 33304746 ORJFZPXOPQLCGI-MFOYZWKCSA-N 330.369 2.373 50 1 EEGF Cc1cc(C(=O)N/N=C\c2cccc(OC(=O)c3ccco3)c2)[nH]n1 33308017 UFLDJWQXONMZOY-ZDLGFXPLSA-N 338.323 2.294 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]1(C)O)[C@@]24OO3 195300630 QEZXEMZAZAJVRG-HMHPZVNXSA-N 328.405 2.346 50 1 EEGF C/C(=C\COc1cc(O)c2c3c(c(O)cc(C)c13)C(=O)OC2=O)CO 198421053 NHJQBXCLDCRFQD-FPYGCLRLSA-N 344.319 2.187 50 1 EEGF CN(C)CCNC(=O)c1cccc(N(CCCl)CCCl)c1 26964645 ILTOXYWAYLMNJH-UHFFFAOYSA-N 332.275 2.262 50 1 EEGF CCCOc1cccc(C(=O)NNS(=O)(=O)c2ccccc2)c1 1857560629 BDXXRZDGQSFVMM-UHFFFAOYSA-N 334.397 2.099 50 1 EEGF COC(=O)CN1C(=O)c2cccc3cc(N=C=S)cc(c23)C1=O 26470036 KTOWOBYEGYWFLT-UHFFFAOYSA-N 326.333 2.343 50 1 EEGF O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1ccc(Cl)s1 277384 PLHMXBHYYNWJTI-FPLHFXQWSA-N 347.827 2.381 50 3 EEGF Cc1nccn1CCC(=O)NCCCSSCCN(C)C 618009650 GJYHGUZFQYMCHI-UHFFFAOYSA-N 330.523 2.031 50 1 EEGF O=C(CBr)NCCc1nc2cc(Cl)c(F)cc2[nH]1 586970707 DTMCTPNBQRWBNI-UHFFFAOYSA-N 334.576 2.409 50 1 EEGF OB(O)c1ccsc1[C@H]1NCCc2cccc(-c3ccccc3)c21 962668824 OAMVSPHKFCXXTC-SFHVURJKSA-N 335.237 2.330 50 1 EEGF O=C(Nc1ccccc1)[C@@H](Cl)c1ccc2c(O)nc(O)nc2n1 587367577 ZQJOBDVSAJHORS-NSHDSACASA-N 330.731 2.355 50 1 EEGF CC1(C)[C@@H]2CC(=O)[C@]3(CC(=O)[C@@]4(O)[C@H]5C[C@@H](C[C@H]4OO3)C5(C)C)[C@H]1C2 169674964 POJQMSIGIPUSSL-ZFEKTCPZSA-N 348.439 2.447 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@@]42OO3 169340899 JEAMUJGJFHFTDV-XQLAAWPRSA-N 326.389 2.410 50 1 EEGF O=C(NNC(=O)c1nccnc1Cl)c1cccc(C(F)(F)F)c1 1857762737 HMCSHAYFBBGSJA-UHFFFAOYSA-N 344.680 2.224 50 1 EEGF COc1ccc(C(=O)NCCCSSCCN(C)C)c(O)c1 618007878 LWSYIAJTIYILLZ-UHFFFAOYSA-N 344.502 2.464 50 1 EEGF COc1cccc(N/C=C(\C#N)C(=O)NC(=O)Cc2ccccc2)c1 6235354 BDUKBBDHEMJBKQ-FYWRMAATSA-N 335.363 2.400 50 1 EEGF COc1cccc2nc(C(C#N)=Cc3ccc(OCC(N)=O)cc3)[nH]c12 1857588341 MIOHKYDEQWXVGV-UHFFFAOYSA-N 348.362 2.500 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@@]2(C)CC2=C(C[C@H]1CC)C(=O)OC2=O 2356657749 RUGDWJCVKKJESL-MHNGPXOMSA-N 332.352 2.229 50 1 EEGF O=[S@@](O)CCCCSSCCCCS(=O)(=O)S 73258249 IXBCSUFVXFFDNE-UHFFFAOYSA-N 338.563 2.410 50 1 EEGF CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H](O)[C@@H]1Br 40576150 SFECHFUZAGUXCD-JSGCOSHPSA-N 337.169 2.096 50 1 EEGF CO[C@H](C)COC1CCC(c2nc3ccc(C(=O)NN)cc3[nH]2)CC1 587952298 OHBZEUWCNGUYOR-LKSINWNRSA-N 346.431 2.244 50 1 EEGF CC1=Nc2ccccc2/C1=C/NNC(=O)CNC(=O)Cc1ccccc1 103768070 DHRXSXZSSXEKKJ-SFQUDFHCSA-N 348.406 2.113 50 3 EEGF O=C1[C@H](Cl)[C@]2(C(=O)Nc3ccccc32)N1c1ccc([N+](=O)[O-])cc1 103167067 SIYGTLSYNNPUKI-XJKSGUPXSA-N 343.726 2.396 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H](CC)[C@H](Br)C[C@H]2O1 2356459193 BYFHPYMVXVHPFO-DXUDUQDWSA-N 329.234 2.415 50 1 EEGF CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)NN/C=C1/C=CC=N1)CO2 15934881 YYYWWTOMMQWIMR-DDKJEQMHSA-N 327.384 2.227 50 3 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@]42OO3 58689349 JEAMUJGJFHFTDV-IEYGGJDGSA-N 326.389 2.410 50 1 EEGF CS(=O)(=O)N1C[C@@H](CCl)c2cc(Br)c(O)cc21 27421179 LWSNDWLUFRMNCZ-ZCFIWIBFSA-N 340.626 2.257 50 1 EEGF CCOC1=C/C(=C/NNC(=O)[C@@H](C)Sc2ccccn2)C=CC1=O 13119126 KNSMWEIXFJTYGO-RVROTUBLSA-N 345.424 2.126 50 3 EEGF Cn1c(=O)c(=O)n(CCCCCCCl)c2ccc([N+](=O)[O-])cc21 473137247 XHINDIBXFAQUSD-UHFFFAOYSA-N 339.779 2.408 50 1 EEGF CCOC(=O)C1=C(CCl)NC(=O)N(C(C)=O)[C@H]1c1ccccc1 38142380 FTTRTCXAIINYAQ-AWEZNQCLSA-N 336.775 2.355 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@@]314 169336929 YYDGJYRFMZGTTH-RCJCGXMHSA-N 347.842 2.398 50 1 EEGF N#CC1=C(N)[C@@H]2[C@@H](c3ccccc3)c3ccc(O)cc3O[C@H]2C=C1N 101011711 VIUWVURDHWPCKS-FHWLQOOXSA-N 331.375 2.494 50 1 EEGF CC[C@H](CO)NC(=S)NP(=O)(c1ccccc1)c1ccccc1 96909344 YSZATDBDBXKNAC-CQSZACIVSA-N 348.408 2.151 50 1 EEGF NNC(=O)c1ccc2[nH]c(C(=O)Nc3ccccc3Cl)nc2c1 587060672 RIRPFPAZJFOQOZ-UHFFFAOYSA-N 329.747 2.072 50 1 EEGF O=C(Cc1ccc(O)cc1)N/N=C1\C(=O)Nc2cccc(Cl)c21 6744640 OARFEHNJZQOTQK-UHFFFAOYSA-N 329.743 2.061 50 1 EEGF CCOC(=O)c1cc(-c2ccccc2)[nH]c1NNC(=O)CCOC 40395292 DUWKGRLNGGHVEQ-UHFFFAOYSA-N 331.372 2.338 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 100836851 PFAJNVCFGCXGRB-UKMLZYKCSA-N 326.414 2.101 50 1 EEGF CC(=O)C[C@@H]1O[C@@H]2[C@@H]3[C@H](C(=O)C=C(C)[C@H]13)[C@H](C)CO[C@]2(C)C=CC=O 2356651592 SPGKLZOENIXNTQ-HVEBPZSMSA-N 346.423 2.291 50 1 EEGF COc1ccc(C2=C(c3ccc([S@@](C)=O)cc3)C(=O)OC2=O)cc1 49756653 QJNQHAZXJWHTFU-DEOSSOPVSA-N 342.372 2.427 50 1 EEGF CN1CCc2cn(C)nc2[C@@]12CC(C)(C)CC(=O)[C@@H]2Br 963956523 XVQJVHYQDUXFGG-WFASDCNBSA-N 340.265 2.256 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@H](OC(=O)CCC)[C@@H]12 2356696187 NSSIFSOSOVNSCJ-LAVFITLUSA-N 348.395 2.022 50 1 EEGF CCOc1ccccc1OCc1nc2ccc(C(=O)NN)cc2[nH]1 587780035 KUWBRVMCQFWJGJ-UHFFFAOYSA-N 326.356 2.144 50 1 EEGF CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CC[C@@H](Cl)C3)nc21 29329561 CPJXWTLTLAMACR-MRVPVSSYSA-N 339.754 2.071 50 1 EEGF CN(C)CCSSCCCNC(=O)c1ncc(F)cc1F 621485764 KJYDDOUMBARJAW-UHFFFAOYSA-N 335.445 2.423 50 1 EEGF C[C@]1(O)CC[C@@H]2C[C@@H]1OO[C@]2(C)CS(=O)(=O)c1ccc(F)cc1 169328298 LHISGEJBLVJODQ-IPOQPSJVSA-N 344.404 2.240 50 1 EEGF O=C1C=Cc2ccccc2/C1=C/NNC(=O)c1ccc2c(c1)OCO2 33849522 ZBQYVFFGCFGTOH-GDNBJRDFSA-N 334.331 2.287 50 3 EEGF N#CC1=C(N)[C@H]2[C@H](C=C1N)Oc1cc(O)ccc1[C@H]2c1ccccc1 101011710 VIUWVURDHWPCKS-OTWHNJEPSA-N 331.375 2.494 50 1 EEGF O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2oc1=O 473107600 JLHQLVFEMXIFRJ-VCHYOVAHSA-N 337.291 2.465 50 1 EEGF COC(=O)c1cccc(/C=N/NC(=O)c2ccc(N(C)C)cc2)c1 653700243 BPXXGXBJIDEETL-XDHOZWIPSA-N 325.368 2.303 50 1 EEGF COc1ccc(C(=O)O[C@H]2CC(C)=C(C=O)[C@H]2CC=O)cc1OC 33968704 OYFYFVQAQPRUMI-CJNGLKHVSA-N 332.352 2.354 50 1 EEGF biogenic N#CC1=C(N)[C@H]2[C@@H](c3ccccc3)c3ccc(O)cc3O[C@H]2C=C1N 169346800 VIUWVURDHWPCKS-GBESFXJTSA-N 331.375 2.494 50 1 EEGF C=C(C=O)[C@@H]1C[C@@H](COC=Cc2ccc(O)cc2)C(CO)=C1C=O 2356340679 VHBCHQFWBGEKKL-RDJZCZTQSA-N 328.364 2.259 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@H](OCC(C)C)[C@@H]12 2356473209 XIQILJDZEXJZIC-VSZNYVQBSA-N 334.412 2.352 50 1 EEGF CN(C)CCSSCCNC(=O)[C@@H]1CC(=O)c2ccccc21 618008283 XEUOEMRJANIPNB-CQSZACIVSA-N 338.498 2.416 50 1 EEGF COc1ccc(O)c(C(=O)NCCSSCCN(C)C)c1 618008223 VKTSZMPDXQYJRI-UHFFFAOYSA-N 330.475 2.074 50 1 EEGF NNC(=O)c1ccc2nc(C3(c4cccc(Cl)n4)CC3)[nH]c2c1 587084818 UCLGSZGLJCVPCU-UHFFFAOYSA-N 327.775 2.295 50 1 EEGF C/C(=C\C=O)O[C@@H]1[C@H](O)c2c(ccc3ccc(=O)oc23)OC1(C)C 238749246 SIHQKLUJMQEDIR-KUSDTNGLSA-N 330.336 2.485 50 1 EEGF O=[N+]([O-])c1ccc(CO[S@@](=O)N(CCCl)CCCl)cc1 95575615 RBVQKUIUMUAGGI-FQEVSTJZSA-N 341.216 2.470 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@H](CCl)[C@H]4[C@@H](C2)N(C)CC[C@]314 253714181 YYDGJYRFMZGTTH-PWKJWWNHSA-N 347.842 2.398 50 1 EEGF CC(=O)C(OO[C@H](C(C)=O)c1cc2c3c(cccc3n1)CC2)C(C)=O 587214780 UMTJJCSFGWDQKS-LJQANCHMSA-N 341.363 2.458 50 1 EEGF COc1ccc2c(c1)[C@@]1(C=NN(C)C(=O)[C@@H]1Cl)N(C(C)C)CC2 962091103 LJABMLNKGOSGSO-DOTOQJQBSA-N 335.835 2.222 50 1 EEGF N#C/C(C(=O)c1ccc([N+](=O)[O-])cc1)=C1/NN=C2CCCCCN21 13122188 QONOULITQPPGFJ-DTQAZKPQSA-N 325.328 2.305 50 3 EEGF CN(C)S(=O)(=O)c1cccc2nc(/C=C/CBr)[nH]c12 586973449 KBYSFYPVPALUAU-QPJJXVBHSA-N 344.234 2.221 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=NN(C(C)C)C(=O)[C@@H]1Cl)O2 587382094 NROLNGPUZOTXLO-GOEBONIOSA-N 335.791 2.125 50 1 EEGF O=C(N/N=C/c1ccccc1)c1ccc(CN2CCC[C@H](O)C2)cc1 1857631108 PAKYUUZOUBAHNF-IOVUBPJKSA-N 337.423 2.407 50 1 EEGF N[C@@](S)(/C=C/c1ccc(Cl)cc1)NNC(=O)c1ccncc1 96910748 FDHCZUVBMJWIDW-PXTSUWAFSA-N 334.832 2.225 50 1 EEGF O=CCCO[P@@](=O)(NCCCl)N(CCCl)CCCl 142701248 GFWFQBKWYKETHN-SFHVURJKSA-N 339.587 2.308 50 1 EEGF COC1=C([N+](=O)[O-])/C(=C/C(C#N)=C2Nc3ccccc3N2)C=CC1=O 13124321 SNCXRFZHNFFGMJ-CSKARUKUSA-N 336.307 2.459 50 3 EEGF O=C(NNC(=O)c1ccc(Cl)cc1)C(=O)c1c[nH]c2ccccc12 72173568 BLTZDAFJCRIHBP-UHFFFAOYSA-N 341.754 2.465 50 1 EEGF CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccccn2)cc1 95809323 SFVQUMDJBDMVAG-XSFVSMFZSA-N 326.400 2.176 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccc(F)cc1 169329305 LHISGEJBLVJODQ-DDWPSWQVSA-N 344.404 2.240 50 1 EEGF O=C(Cc1cccc2ccccc12)NN/C=C1/C=CC(=O)C([N+](=O)[O-])=C1 13126734 NPTYQAJUZQPCGL-SEYXRHQNSA-N 349.346 2.187 50 3 EEGF COc1ccccc1/C=C/C=N/NC(=O)CCc1c(C)n[nH]c1O 1741144 CWIHHNWMWXQMSZ-FJIBGIISSA-N 328.372 2.180 50 1 EEGF CC(=O)C(OO[C@@H](C(C)=O)c1cc2c3c(cccc3n1)CC2)C(C)=O 587214776 UMTJJCSFGWDQKS-IBGZPJMESA-N 341.363 2.458 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@]42OO3 58520188 WFIMQBUUYYWZTM-AUXIHBAXSA-N 328.405 2.202 50 1 EEGF CS(=O)(=O)n1c2ccccc2c(=O)n1-c1ccccc1CCl 95604635 WGGZXCACNHTVPW-UHFFFAOYSA-N 336.800 2.339 50 3 EEGF CC(C)(NC(=O)CCl)c1nc2cc(Br)cnc2[nH]1 587008579 PNSGGJNPOOWRFZ-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF CCCCCC#C[C@@]1(C)O[C@@H]2OC(=O)N(C(=O)CCl)[C@@H]2CC1=O 29234699 HPWRGBNFQKVLHP-DIOULYMOSA-N 341.791 2.231 50 1 EEGF O=C1[C@@H](Cl)[C@]2(C(=O)Nc3ccccc32)N1c1ccccc1[N+](=O)[O-] 103174356 BNCADPSEIFMMCJ-CZUORRHYSA-N 343.726 2.396 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@]2(C)CC2=C(C[C@H]1CC)C(=O)OC2=O 2356657748 RUGDWJCVKKJESL-CLFVBBPSSA-N 332.352 2.229 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C(N)=O)n(C)c1)O2 587373438 QPYMSNILDTVIHQ-QGZVFWFLSA-N 347.802 2.114 50 1 EEGF CC(C)=C[C@@H]1C=C(C=O)[C@H]2CC[C@@]3(C)C[C@](O)(CC[C@@H]3O)[C@@H]2[C@H]1O 139559536 NNYDKNNENGAMBY-WVSUQSNYSA-N 334.456 2.377 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 587009638 OAXJJHXJNMSLJI-UHFFFAOYSA-N 331.706 2.475 50 1 EEGF CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCCCC(=O)O 95808444 KKJLIDRYAMKIED-GZTJUZNOSA-N 329.397 2.038 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](CO)O2 2356594377 SDDXIQONGFZHJH-QZTJIDSGSA-N 328.320 2.183 50 1 EEGF CN(C)N(Cc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1 103261043 KVVYIZYZGOTYDC-SFHVURJKSA-N 325.412 2.485 50 1 EEGF CN(C)c1ccc(/C=N/NC(=O)CN2CCc3sccc3C2)cc1 103239012 BTUALHWPHZVYMZ-YBFXNURJSA-N 342.468 2.323 50 1 EEGF COc1cc2c3c(c1)O[C@@]1(CCOC[C@@H]1Br)[C@@H](C2)C3=O 587416693 CGGQWFRWCHEPHX-WBIUFABUSA-N 339.185 2.365 50 1 EEGF COc1ccc(C(=O)N(NC(=O)c2snnc2C)C(C)(C)C)cc1 103206567 FYMKULHIBYKHNY-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF COc1ccc(/C=N/NC(=O)c2snnc2C(F)(F)F)cc1 103183178 JITBSFGWJKNYLO-OMCISZLKSA-N 330.291 2.329 50 1 EEGF CCCCCC#C[C@]1(C)O[C@@H]2OC(=O)N(C(=O)CCl)[C@@H]2CC1=O 29230600 HPWRGBNFQKVLHP-WPGHFRTFSA-N 341.791 2.231 50 1 EEGF O=C(Cc1ccc(O)cc1)N/N=C1\C(=O)Nc2cc(Cl)ccc21 72180049 VKZPRZWXXLJOSW-UHFFFAOYSA-N 329.743 2.061 50 1 EEGF CCn1c(C)nc2cc(C(=O)NN/C=C3\C=CC=C(O)C3=O)ccc21 100437426 RTFBKHLCACMBJQ-JLHYYAGUSA-N 338.367 2.064 50 3 EEGF CC(C)(O)[C@@H]1CC[C@@](C)(N=C=S)[C@H]2CC[C@@]3(C)O[C@H](O)[C@]12O3 2356388193 WAWKSTXGMZGGDY-JHYMJZMKSA-N 327.446 2.259 50 1 EEGF CCC[C@H]1C2=C(CCC3=C(C[C@H]1CC)C(=O)OC3=O)C(=O)OC2=O 85550784 OJIGDJPKCFGFKH-NXEZZACHSA-N 332.352 2.373 50 1 EEGF NC(=S)NNC(=O)COc1ccc(-c2cc3ccccc3[nH]2)cc1 82151052 MPGXSXRJJZARAQ-UHFFFAOYSA-N 340.408 2.078 50 1 EEGF O=C(Cc1ccc(Br)cc1)O[C@H]1CS[S@](=O)C1 96283347 RGXGCYKBODEBNH-DYZYQPBXSA-N 335.244 2.314 50 1 EEGF CN(C)CCSSCCC(=O)Nc1ccc(C(=O)O)c(O)c1 618007668 KOQMKLOWPJLYFL-UHFFFAOYSA-N 344.458 2.362 50 1 EEGF COc1ccc2[nH]c(C(=O)NCCSSCCN)cc2c1 618007571 GBGUMSJMSLOVGZ-UHFFFAOYSA-N 325.459 2.246 50 1 EEGF C[C@@]1(O)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 140056122 PFAJNVCFGCXGRB-HNKHHVNMSA-N 326.414 2.101 50 1 EEGF CC(=O)Nc1cccc(C(=O)NCCSSCCN(C)C)c1 618007955 OCDJKQYDFZLRID-UHFFFAOYSA-N 341.502 2.318 50 1 EEGF CCOC(=O)Cc1c(CCl)[nH]c2ccc(S(C)(=O)=O)cc12 587650072 VQASGWBUNZCPPV-UHFFFAOYSA-N 329.805 2.416 50 1 EEGF C[C@]1(O)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccc(F)cc1 100835296 LHISGEJBLVJODQ-MWNCTCPHSA-N 344.404 2.240 50 1 EEGF CCO[C@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@@H](C)C(=O)C[C@@H]([C@H]1C)[C@@]24OO3 195111381 CTFKREBDWZQSCT-ABTAZAJSSA-N 326.389 2.410 50 1 EEGF O=CCCO[P@](=O)(NCCCl)N(CCCl)CCCl 142701067 GFWFQBKWYKETHN-GOSISDBHSA-N 339.587 2.308 50 1 EEGF O=C(NN/C=C1\C=Nc2ccccc21)[C@@H]1CC(=O)N(c2ccccc2)C1 13130373 VQYQAEBPYDEOBV-FQZGENGWSA-N 346.390 2.417 50 3 EEGF Cn1c(=O)c2cccc(Cl)c2c(=O)n1CCCBr 144461116 WSAXQKJLHHSTOV-UHFFFAOYSA-N 331.597 2.139 50 1 EEGF COc1ccc([C@@H]2C[C@]34OO[C@](C)(C=C3C(=O)O2)[C@H](C)O4)cc1OC 96934022 KPWNQLYPOLDXNU-LIMWAFQUSA-N 348.351 2.454 50 1 EEGF O=C(NNC(=S)N/N=C/c1ccccn1)Nc1ccccc1Cl 3599948 ATVUFCMXMZNXIB-RQZCQDPDSA-N 348.819 2.270 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](CO)CC[C@@H]([C@H]1C)[C@]42OO3 43693363 IAWCNNYONWQQDN-TWPHGLHBSA-N 328.405 2.203 50 1 EEGF O=C(CCCCCC(=O)N/N=C/c1ccc(O)c2ccccc12)NO 95809379 DVFHQWSQLQRWNX-XDHOZWIPSA-N 343.383 2.451 50 1 EEGF CCCC(=O)OCCNC(=O)c1ccc(CCl)c([N+](=O)[O-])c1 2178320190 NHXUTADDCXURCN-UHFFFAOYSA-N 328.752 2.407 50 1 EEGF CCSCC[C@@H](N)[C@H](O)C(=O)NNc1cccc2ccccc12 27987972 NRQSTJNSQBCNME-ZBFHGGJFSA-N 333.457 2.114 50 1 EEGF C[C@@H]1CC[C@]2(C)C(C=O)=CCC[C@@H]2[C@]1(C)C[C@@H]1O[C@H](O)C(=O)[C@@]12CO2 2356475884 TYEWCIUNKYTNGK-YQLOGUAKSA-N 348.439 2.410 50 1 EEGF O=CC=Cc1cc(O)c2c(c1)[C@@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 2356604673 CGSLPFBMGQUTKF-CXAGYDPISA-N 328.320 2.225 50 1 EEGF COc1ccc(C(=O)NCCSSCCN(C)C)c(OC)c1 618008344 YQSKKZWYBXURDZ-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF COc1ccc(OCC(=O)NCCSSCCN(C)C)cc1 618008176 BOQAPYXDUSGYKX-UHFFFAOYSA-N 344.502 2.133 50 1 EEGF COc1cc2c3c(c1)O[C@](CCl)(c1cc(C(N)=O)co1)[C@@H](C2)C3=O 587423244 UIRUVWGRMZUMKQ-GTNSWQLSSA-N 347.754 2.269 50 1 EEGF C[C@@]1(O)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccc(F)cc1 169329300 LHISGEJBLVJODQ-CAPXZKIUSA-N 344.404 2.240 50 1 EEGF Cc1[nH]n(-c2ccccc2)c(=O)c1/C=N/NC(=O)c1cccc(F)c1 169330566 ZSOBICZDUUBZED-RGVLZGJSSA-N 338.342 2.377 50 1 EEGF Cc1c(C(=O)N/N=C\c2ccc(O)c(O)c2O)oc2cccc(O)c12 1911574129 LDELKHXVFGCHDM-WSVATBPTSA-N 342.307 2.328 50 1 EEGF COc1cc2c3c(c1)O[C@@]1(C=NN(C(C)C)C(=O)[C@H]1Cl)[C@@H](C2)C3=O 587422182 SDAJNBARJNRRMX-CXMBCZLWSA-N 348.786 2.025 50 1 EEGF C[C@H](CO)C1=C2C3=CC=C(C=O)C[C@H](O)[C@@]3(C)CC[C@@]2(CO)CC1 14778910 LYWUSVMTERQURN-ISHJAKKSSA-N 332.440 2.300 50 1 EEGF biogenic O=C(N/N=C\c1ccc(F)cc1)c1c(O)[nH]c2ccccc2c1=O 33319417 QURXCONTPLJOFG-OCKHKDLRSA-N 325.299 2.137 50 1 EEGF C#C/C=C/C[C@@H]1O[C@@H]2C[C@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 95912750 NOYIFPKKLJWDFK-SMUGRMHISA-N 329.234 2.415 50 1 EEGF biogenic,in-vitro CC(C)(C)OC(=O)CCCCNC(=O)CI 169348023 GLBIHMWSCNITRS-UHFFFAOYSA-N 341.189 2.050 50 1 EEGF O=C(CCCCCC(=O)N/N=C/c1ccc2ccccc2n1)NO 95809377 LTLYRROLUKCQDQ-LDADJPATSA-N 328.372 2.141 50 1 EEGF O=C(CBr)NCCc1nc2ccc3c(c2[nH]1)CCCC3 586970486 BRDSNBHNNGKERZ-UHFFFAOYSA-N 336.233 2.495 50 1 EEGF CCO[C@H]1O[C@H]2O[C@]3(C)C[C@@H](O)[C@H]4[C@@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 195286855 VCMOVYRZBUORCV-XQDOSMROSA-N 328.405 2.202 50 1 EEGF Cc1nnc(Sc2ccc(/C=N/NC(=O)c3ccccn3)o2)n1C 95808846 GXERQPQIKHKCHB-RQZCQDPDSA-N 342.384 2.027 50 1 EEGF NCCSSCCNC(=O)c1cc(-c2ccccc2)ncn1 618007541 CEDOLMYYQQOOMW-UHFFFAOYSA-N 334.470 2.214 50 1 EEGF Cc1ccc2oc(=O)cc(CC(=O)N/N=C/c3ccccc3O)c2c1 40846538 CCVPPKLLPWTHBE-RGVLZGJSSA-N 336.347 2.500 50 1 EEGF O=C1COc2ccccc2N1CCCn1cc(CCCCl)nn1 299821620 KAKIRVFRNAVUCE-UHFFFAOYSA-N 334.807 2.265 50 1 EEGF C=C(C)[C@@H]1CC[C@]23CO[C@]4(OO2)C2=C(C(=O)C(C)=C[C@@H]1[C@@H]23)[C@H](O)[C@H]4C 238784141 AINNPETUGJFTND-ZNBIGWPYSA-N 344.407 2.468 50 1 EEGF COC(C)(C)[C@H](Br)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 586970218 BXWVQVVDIGICLL-RXMQYKEDSA-N 334.605 2.231 50 1 EEGF C=CCC1=CC=C/C(=C\NNC(=O)C(=O)Nc2ccc(C)cc2)C1=O 13119316 OTBJUZNPSZOSRT-NTCAYCPXSA-N 337.379 2.080 50 3 EEGF CN([C@@H]1CCN2CCc3ccccc3[C@@H]2C1)S(=O)(=O)CCl 29212625 DHYKCYRKURDGEG-HIFRSBDPSA-N 328.865 2.206 50 1 EEGF O=C1[C@@H](Cl)[C@@]2(C(=O)Nc3ccccc32)N1c1ccc([N+](=O)[O-])cc1 103167065 SIYGTLSYNNPUKI-CJNGLKHVSA-N 343.726 2.396 50 1 EEGF Cc1c(C(=O)N/N=C/c2ccccc2)[n+]([O-])cn1Cc1ccccc1 96922803 QQOHGFVPODMNJP-UDWIEESQSA-N 334.379 2.242 50 1 EEGF COc1cc(-c2nc3ccc(C(=O)NN)cc3[nH]2)cc(Cl)c1O 587046234 NSNCRDWTGMYHOA-UHFFFAOYSA-N 332.747 2.201 50 1 EEGF CC(C)COc1cccc(C(=O)NNS(=O)(=O)c2ccccc2)c1 1857566704 UQPIIWMZDZWNBY-UHFFFAOYSA-N 348.424 2.345 50 1 EEGF N[C@@]1(C(=O)O)CCc2cccc(N(CCCl)CCCl)c2C1 49777344 DCALVZNJOJZUFO-HNNXBMFYSA-N 331.243 2.241 50 1 EEGF COc1cc(/C=C/C(=O)N/N=C/c2ccccc2)cc([N+](=O)[O-])c1O 84722798 BEALHAMHOUUVQH-DHELDDLOSA-N 341.323 2.473 50 1 EEGF CC1(C)CNP(=O)(NC(=O)Nc2cccc([N+](=O)[O-])c2)NC1 103221936 AROMULFWUBGHIF-UHFFFAOYSA-N 327.281 2.043 50 1 EEGF O=[N+]([O-])c1cccc(NCc2ccc3sc(B(O)O)cc3c2)c1 170095924 XVMINMUHFBYDMD-UHFFFAOYSA-N 328.158 2.101 50 1 EEGF O=C(CCCC[C@@H]1CCSS1)NCCCCS(=O)(=O)O 1772575540 AUFOYOYAWBEMDY-LLVKDONJSA-N 341.520 2.485 50 1 EEGF COc1cc2c3c(c1)O[C@@](/C=C/N1CCOCC1)(CCl)[C@@H](C2)C3=O 587417089 JDQGEYIGDXEKDG-IMBDGTDHSA-N 349.814 2.266 50 1 EEGF NNC(=O)c1ccc2nc([C@@H]3Cc4cc(Cl)ccc4O3)[nH]c2c1 587079289 CCGGSGZONUYGJR-AWEZNQCLSA-N 328.759 2.496 50 1 EEGF O=C1[C@@H](Cl)[C@]2(C(=O)Nc3ccccc32)N1c1ccc([N+](=O)[O-])cc1 103167063 SIYGTLSYNNPUKI-CZUORRHYSA-N 343.726 2.396 50 1 EEGF COc1ccc(Cl)cc1C#Cc1cc(C(=O)NN)cc([N+](=O)[O-])c1 587904473 MUSFRIDBPPXHMF-UHFFFAOYSA-N 345.742 2.260 50 1 EEGF CCOc1ccc2c(NNC(=O)[C@@H]3CSCN3)cc(C)nc2c1 71341041 KNHJYWXHPNQFNE-HNNXBMFYSA-N 332.429 2.048 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc2c(c1)OCCO2 95808717 XNFXGQREWAXUTQ-CPNJWEJPSA-N 348.399 2.422 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@@H](C)[C@@H](O)C[C@@H]([C@H]1C)[C@@]42OO3 169368265 WFIMQBUUYYWZTM-UBKXYPPBSA-N 328.405 2.202 50 1 EEGF C/C(=N\NC(=O)Cn1c(=O)c(C)nc2ccccc21)c1ccccc1 207930276 ACJDVXRZZGVBNB-FYJGNVAPSA-N 334.379 2.245 50 1 EEGF CC(=N)/C(C#N)=C(\O)CSc1nnc(Cc2ccccc2F)n1N 103109530 WKQLYJZSJSPQFF-DFRZIUGFSA-N 346.391 2.189 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@@]42OO3 169340901 JEAMUJGJFHFTDV-RRIGHJONSA-N 326.389 2.410 50 1 EEGF O=[P@@]1(N(CCCl)CCCl)NC[C@@H](Br)CO1 1559318 FANXZPANFQUGNC-MLXNANBUSA-N 339.985 2.257 50 1 EEGF O=CC=Cc1cc(O)c2c(c1)[C@H](CO)[C@H](c1ccc(O)c(O)c1)O2 2356604675 CGSLPFBMGQUTKF-GUYCJALGSA-N 328.320 2.225 50 1 EEGF CC(=CCOc1cc(O)c2c3c(c(O)cc(C)c13)C(=O)OC2=O)CO 2356468698 NHJQBXCLDCRFQD-UHFFFAOYSA-N 344.319 2.187 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 2356549958 NTXXGPYGMQQSML-QZTJIDSGSA-N 328.320 2.183 50 1 EEGF C=C(C)O[C@@H]1C[C@](C)(O)[C@@]23CC[C@@](C)(OO2)[C@@H]3[C@@H]2OC(=O)C(=C)[C@H]12 2356745570 KRHWRXFBYHSTFI-GXFNJKDBSA-N 336.384 2.027 50 1 EEGF NNC(=O)c1ccc2nc(-c3ccc(N)cc3C(F)(F)F)[nH]c2c1 587095741 STIFTLJGWBZZGT-UHFFFAOYSA-N 335.289 2.434 50 1 EEGF NNC(=O)N1N=C(c2cccc3ccccc23)C[C@@]1(O)C(F)(F)F 200297765 ZEOIMJIXHJMVPA-CQSZACIVSA-N 338.289 2.084 50 1 EEGF Cc1nn2c(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)c(C)nc2s1 13005009 ITFUEFZTCVVNHO-VIZOYTHASA-N 344.356 2.080 50 1 EEGF COc1ccc(OC)c(/C=N\NC(=O)CCc2c(C)n[nH]c2C)c1 13109321 FRODHSDZOAQUQX-ZDLGFXPLSA-N 330.388 2.127 50 1 EEGF COC(C)(C)[C@@H](Br)c1nc2ccc(C(=O)NN)cc2[nH]1 586971675 WGCLBMRPTMGMGS-JTQLQIEISA-N 341.209 2.027 50 1 EEGF N#CCNC(=O)[C@@H](CC(Cl)Cl)NC(=O)OCc1ccccc1 100731005 KQTXVBMWFQTKHZ-LLVKDONJSA-N 344.198 2.115 50 1 EEGF O=C1CC[C@@H](C(=O)N/N=C/c2cccc(C(F)(F)F)c2Cl)N1 1911578311 NLRXREXUJYDYIW-YSITYURMSA-N 333.697 2.088 50 1 EEGF CC/N=C1\C[C@@H]2Oc3cc(O)c(O)cc3C[C@H]2C(NCC)=C1C#N 169718726 HJAILSWFRFAYEF-LKNHSIGMSA-N 327.384 2.269 50 1 EEGF C=C[C@]1(C)[C@@H](C(=C)C=O)[C@@H](OCC(C)C)[C@@H]2C(=C)C(=O)O[C@@H]2[C@@H]1O 238772636 MPMVQQPKRNZSDV-QQPKDZIPSA-N 334.412 2.064 50 1 EEGF CC1=NN(c2ccccc2)C(=O)/C1=C/NNC(=O)c1cccc(F)c1 100506128 ASRLIVTTZJFSRW-LFIBNONCSA-N 338.342 2.367 50 3 EEGF Cc1ccc(S(=O)(=O)N(C)NC(=O)/C=C/c2ccccc2)cc1 28756138 HTBIUXPPSGXXTN-JLHYYAGUSA-N 330.409 2.360 50 1 EEGF C#C/C=C\C[C@@H](O)[C@H]1C[C@@H]2O[C@@H]([C@@H](Br)CC)C[C@@H]2O1 238748280 IGGWUQFVBHRWOH-RMDNDNTRSA-N 329.234 2.415 50 1 EEGF N#C[C@@H](C(=O)/C(=N\NC(N)=O)[C@H](C#N)c1ccccc1)c1ccccc1 5722372 GBRSKFAVFMUQFI-RIUBGZBCSA-N 345.362 2.195 50 1 EEGF CC(C)c1ccc2c(c1)=C1CCCC(NNC(=O)c3ccncc3)=C1N=2 13126801 ATMLRAOLGDOCPD-UHFFFAOYSA-N 346.434 2.319 50 3 EEGF O=C(CCCCC(=O)N/N=C/c1ccc(Br)s1)NO 95809397 JSPLGYAXWLRQSL-NTUHNPAUSA-N 348.222 2.027 50 1 EEGF CSC1=C(C#N)C(=S)N=C(N)[C@@H]1C(=O)Nc1ccc(C)cc1 6522552 SEHNHLRJEZEOPM-LLVKDONJSA-N 330.438 2.389 50 1 EEGF CC1(C)O[C@]2(C)[C@H]3C[C@H]4O[C@]2(C[C@H]1Br)O[C@@]4(C)C[C@@H]3O 166797795 JAWMXSKLDOVARM-WBDGJRKNSA-N 347.249 2.362 50 1 EEGF COc1ccc([C@H]2C[C@]34OO[C@](C)(C=C3C(=O)O2)[C@@H](C)O4)cc1OC 96934023 KPWNQLYPOLDXNU-ONUGHKICSA-N 348.351 2.454 50 1 EEGF O=C1CCc2cc3nc(-c4ccc5c(c4)C(=O)OC5=O)[nH]c3cc2N1 586906035 HBDYIPXUURPQAH-UHFFFAOYSA-N 333.303 2.425 50 1 EEGF CC1=Nc2ccccc2/C1=C/NNC(=O)CNC(=O)c1cccs1 104004439 WAERSHUMEVFYSR-UKTHLTGXSA-N 340.408 2.246 50 3 EEGF O=C(CCCN1C(=O)c2ccccc2C1=O)N/N=C\c1ccccc1 28654758 QNIGNXOCGOFFOD-MOSHPQCFSA-N 335.363 2.213 50 1 EEGF CC(=O)Nc1ccc(N2N=C3COC(C)(C)C=C3C(C#N)=C2N)cc1 13838690 DUYSNOAWFUWUEH-UHFFFAOYSA-N 337.383 2.250 50 1 EEGF CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)C[C@@H]1F 170069615 UCKHKSBXKBGHKE-LOWVWBTDSA-N 344.459 2.184 50 1 EEGF CCO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@@]1(C)O)[C@]42OO3 253853780 QEZXEMZAZAJVRG-YIRYDISDSA-N 328.405 2.346 50 1 EEGF O=C(N/N=C/c1ccc(O)c(O)c1O)c1cc2ccccc2cc1O 141632194 WCLLSLADGFEHTN-DJKKODMXSA-N 338.319 2.426 50 1 EEGF NC(=O)N/N=C/c1cn(-c2ccc(C(=O)O)cc2)nc1-c1ccccc1 1772656716 RMBLXDBKOUOMFZ-KEBDBYFISA-N 349.350 2.240 50 1 EEGF CNCCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@]42OO3 43919877 UZPOTTLIUZBCEZ-FQXXIRCGSA-N 341.448 2.430 50 1 EEGF CO[C@@H](C)COC1CCC(c2nc3ccc(C(=O)NN)cc3[nH]2)CC1 587952297 OHBZEUWCNGUYOR-DCBWTQNWSA-N 346.431 2.244 50 1 EEGF C#CC=CC[C@@H]1O[C@H]2C[C@H]1O[C@H](CC)[C@@H](Br)C[C@H]2O 2356501089 NOYIFPKKLJWDFK-VRPMWHRCSA-N 329.234 2.415 50 1 EEGF CC/N=C1\C[C@H]2Oc3cc(O)c(O)cc3C[C@@H]2C(NCC)=C1C#N 169718725 HJAILSWFRFAYEF-SQOPULLQSA-N 327.384 2.269 50 1 EEGF CCO[C@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@@H](C)C(=O)C[C@@H]([C@H]1C)[C@@]24OO3 195111368 CTFKREBDWZQSCT-ORCMLXAYSA-N 326.389 2.410 50 1 EEGF C=C(C=O)[C@@H]1CC[C@H](C)[C@H]2CC(=O)C(COC(C)=O)=C2[C@@H]1OC(C)=O 2356440299 VUEXXQYNBHUERB-VGQSVSGKSA-N 348.395 2.168 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 5759778 NTXXGPYGMQQSML-MCXKQELZSA-N 328.320 2.183 50 1 EEGF endogenous,in-man NNC(=O)c1ccc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c2c1 587017127 RYXIHOHXYSTEFW-LBPRGKRZSA-N 329.385 2.141 50 1 EEGF CCN(CC)C1=CC(=O)/C(=C/NNC(=O)Cc2cccs2)C=C1 13120100 FELGQVMIQAHGNI-OUKQBFOZSA-N 331.441 2.160 50 3 EEGF O=C1C=CC=C/C1=C\NNC(=O)C1(O)c2ccccc2-c2ccccc21 13118998 IFUKMVBYHAIGPS-BUHFOSPRSA-N 344.370 2.103 50 3 EEGF COc1ccc(CC(=O)NCCSSCCN(C)C)cc1 618007800 ITGGHHGTPROICF-UHFFFAOYSA-N 328.503 2.297 50 1 EEGF CCOC1=C/C(=C/NNC(=O)[C@H](C)Sc2ccccn2)C=CC1=O 13119127 KNSMWEIXFJTYGO-OWRWYXLESA-N 345.424 2.126 50 3 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]1(C)O)[C@]42OO3 138505162 QEZXEMZAZAJVRG-KDJXQKOPSA-N 328.405 2.346 50 1 EEGF CCCN1N=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)[C@@H](Cl)C1=O 587382942 UQCDRNPOLHNWQJ-GOEBONIOSA-N 335.791 2.127 50 1 EEGF C[C@H](Br)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 587008034 GKEODWGZLJOCRZ-ZETCQYMHSA-N 332.223 2.269 50 1 EEGF COc1cc2c3c(c1)O[C@@]1(C=NN(C(C)C)C(=O)[C@@H]1Cl)[C@@H](C2)C3=O 587422185 SDAJNBARJNRRMX-KCTSRDHCSA-N 348.786 2.025 50 1 EEGF C[C@H](Br)C(=O)Nc1ccc(C2=NNC(=O)C[C@H]2C)cc1 27881557 BJBIKCDDHROHFL-BDAKNGLRSA-N 338.205 2.269 50 1 EEGF C[C@H](CO)C1=C2CC=C(C=O)[C@@H]3C(=O)[C@@H](O)[C@@H](C)[C@@H]3C[C@]2(C)CC1 685935805 NDSSXIGJWWQDCU-YRVIXWPMSA-N 332.440 2.443 50 1 EEGF biogenic,in-vitro COC1=C/C(=C/NNC(=O)c2ccc(-n3cccc3)cc2)C=CC1=O 15973999 PCWGMTYHQDLKGC-BUHFOSPRSA-N 335.363 2.265 50 3 EEGF COc1cccc(C(=O)NN(C(=O)c2snnc2C)C(C)(C)C)c1 103214514 IBIYWALKDABCKS-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF COBN1CC[C@H](Cl)[C@H]1C=CCc1ccc(C(=O)OC)s1 2356629942 WBEBIWGZXCXPAQ-NWDGAFQWSA-N 327.642 2.228 50 1 EEGF C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OCCO)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 84757220 WUMHEFZEBHPMTB-XQLAAWPRSA-N 328.405 2.203 50 1 EEGF COc1ccc(-c2cc(CNC(=O)CBr)on2)cc1 95553026 YLPYWSQHMVEBIT-UHFFFAOYSA-N 325.162 2.361 50 1 EEGF CN(C)CCSSCCCNC(=O)COc1ccc(O)cc1 618012654 UVQGJSSJBUNTQY-UHFFFAOYSA-N 344.502 2.220 50 1 EEGF COc1cccc(OC)c1C(=O)NCCSSCCN(C)C 618007973 OYRLJXDSOFEXHM-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF COc1cc2c3c(c1)O[C@](CBr)(C(C)=O)[C@@H](C2)C3=O 587415551 ULIPPTFORRHMFT-IINYFYTJSA-N 325.158 2.165 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C\N1CCOCC1)(CCl)O2 587373112 PTWXHOOOSVNMCL-KYVUIXNKSA-N 336.819 2.366 50 1 EEGF N#CC1=C(N)[C@@H]2[C@H](C=C1N)Oc1cc(O)ccc1[C@H]2c1ccccc1 195093347 VIUWVURDHWPCKS-IPMKNSEASA-N 331.375 2.494 50 1 EEGF CN(C)CCSSCCNC(=O)Cc1ccc2c(c1)OCO2 618009058 RBGGUNVPZHZEPN-UHFFFAOYSA-N 342.486 2.017 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C(N)=O)co1)O2 587371232 FAWYYVBZXWLKMR-MRXNPFEDSA-N 334.759 2.369 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]24OO3)[C@@]1(C)O 169358881 QEZXEMZAZAJVRG-QKJVELJUSA-N 328.405 2.346 50 1 EEGF O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1snnc1C(F)(F)F 103183166 JQWIOTDLKLSVDM-PJQLUOCWSA-N 345.262 2.229 50 1 EEGF C=C[C@@H](O)C#CC#C[C@@H](O)/C=C/CCCCCCCC(=O)OC(C)=O 44404127 VBSFNLTXMGJZMI-DUKJBESISA-N 346.423 2.278 50 1 EEGF Cn1c(CCCC(=O)O)nc2ccc(N(CCO)CCCl)cc21 206709719 SUYJVZYRKDCTIS-UHFFFAOYSA-N 339.823 2.018 50 1 EEGF CCOC(=O)C(=O)[C@@H](Cl)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 587371208 DSJMSPNAFBNHFS-ZBFHGGJFSA-N 339.775 2.041 50 1 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1C(=O)O 95809811 XXOJFDXWTRAJPB-LDADJPATSA-N 334.372 2.349 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C(N)=O)n(C)c1)O2 587373435 QPYMSNILDTVIHQ-KRWDZBQOSA-N 347.802 2.114 50 1 EEGF Cc1ccc2c(c1)/C(=N/NC(=O)c1cc3ccccc3oc1=O)C(=O)N2 103285653 QZZMKHDXAMHPJS-UHFFFAOYSA-N 347.330 2.188 50 1 EEGF CCOc1cc(-c2cccc(F)c2)nn1-c1cccc(C(=O)NN)n1 587872292 SXVZJPXQYGSBDX-UHFFFAOYSA-N 341.346 2.076 50 1 EEGF COc1ccc(Cl)cc1C#Cc1cc(C(=O)NN)ccc1OC 587899679 FDVNVNXZRVGSOQ-UHFFFAOYSA-N 330.771 2.361 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H]([C@@H](Br)CC)C[C@H]2O1 2356423630 IGGWUQFVBHRWOH-UQGHGMQMSA-N 329.234 2.415 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@]1(C)O)[C@]42OO3 43379838 QEZXEMZAZAJVRG-ZNWFLGFFSA-N 328.405 2.346 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@H]1c1ccccc1O 5838365 OWSHVQCLIWFXCE-JKSUJKDBSA-N 330.771 2.157 50 1 EEGF CN(/N=C/c1cnn2ccc(C#N)cc12)C(=O)c1cccc([N+](=O)[O-])c1 73198319 CUFHYKVWHFYLLP-VXLYETTFSA-N 348.322 2.220 50 1 EEGF O=C(NO)c1ccc(C(=O)N/N=C/c2ccc3ccccc3c2O)cc1 95808733 WHOJQWJUPBRNAE-RGVLZGJSSA-N 349.346 2.428 50 1 EEGF O=C1C=CC(=O)c2c1ccc1c2O[C@@H](CI)C1 169350643 JNMVXSIPRYHLFL-MRVPVSSYSA-N 340.116 2.360 50 1 EEGF CN1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O 587499814 NBNFZMUHXVXBTD-WBVHZDCISA-N 332.787 2.335 50 1 EEGF COc1cc2c3c(c1)O[C@@](CCl)(/C(C#N)=C/N(C)C)[C@@H](C2)C3=O 587417768 PYVGZKCOXSSLKA-IFBHPICJSA-N 332.787 2.389 50 1 EEGF CC1=NN=C(C)C1=NNc1sc2c(c1C(=O)NN)CCCCC2 1857646200 IMUAWMJBKNIQDJ-UHFFFAOYSA-N 332.433 2.239 50 1 EEGF CCOC(=O)c1sc(N)c(C(=O)NNc2nc(C)cs2)c1C 40835781 KYIJEHUQUXIGPL-UHFFFAOYSA-N 340.430 2.337 50 1 EEGF Cc1[nH]c(C(=O)CCl)c(C)c1-c1ccc2c(O)nc(O)nc2n1 587365419 CRUUMGWKTJXANU-UHFFFAOYSA-N 332.747 2.469 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@@]24OO3)[C@@]1(C)O 195304117 QEZXEMZAZAJVRG-ZYOVEWDWSA-N 328.405 2.346 50 1 EEGF Cn1cc(/C=N/NC(=O)c2cccc(C(=O)NO)c2)c2ccccc21 95809311 YLZNHVVLGIUSRV-VXLYETTFSA-N 336.351 2.061 50 1 EEGF O=C1[C@H](Cl)[C@@]2(C(=O)Nc3ccccc32)N1c1ccc([N+](=O)[O-])cc1 103167069 SIYGTLSYNNPUKI-BBRMVZONSA-N 343.726 2.396 50 1 EEGF O=C1[C@@H](Cl)[C@@]2(C(=O)Nc3ccccc32)N1c1ccccc1[N+](=O)[O-] 103174358 BNCADPSEIFMMCJ-CJNGLKHVSA-N 343.726 2.396 50 1 EEGF C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(/C=O)[C@H](O)[C@@H](OCC(C)C)[C@@H]12 238753836 XIQILJDZEXJZIC-XCFZRETESA-N 334.412 2.352 50 1 EEGF NNC(=O)c1ccc2nc(-c3ncoc3CCC(F)(F)F)[nH]c2c1 587091772 ISFOBCZCKMEWJI-UHFFFAOYSA-N 339.277 2.316 50 1 EEGF O=C/C=C\c1cc(O)c2c(c1)[C@H](CO)[C@H](c1ccc(O)c(O)c1)O2 13312764 CGSLPFBMGQUTKF-HPOCFTDUSA-N 328.320 2.225 50 1 EEGF endogenous,in-man CC(=O)C[C@@H]1O[C@@H]2[C@H]3[C@@H]1C(C)=CC(=O)[C@@H]3[C@@H](C)CO[C@@]2(C)C=CC=O 2356651594 SPGKLZOENIXNTQ-VNOQEFEBSA-N 346.423 2.291 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H]([C@H](Br)CC)C[C@@H]2O1 2356423631 IGGWUQFVBHRWOH-XZBVAUNFSA-N 329.234 2.415 50 1 EEGF CCO[C@@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]1(C)O)[C@]42OO3 136949871 QEZXEMZAZAJVRG-JMKZCTDVSA-N 328.405 2.346 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@@H](O)[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 299818440 VCMOVYRZBUORCV-URYRUMFYSA-N 328.405 2.202 50 1 EEGF COc1ccccc1[C@H]1[C@@H](Cl)C(=O)N1NC(=O)Cc1ccccc1 5838434 HCZAJKQTRNGOQV-SJORKVTESA-N 344.798 2.460 50 1 EEGF Cc1ccc2c(ccc3nc(CCNC(=O)CBr)[nH]c32)n1 586971183 ODAIHILSOBIWCM-UHFFFAOYSA-N 347.216 2.473 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccccc2)OO[C@@H]2C[C@@H]1CC[C@@]2(C)O 100834568 PFAJNVCFGCXGRB-LCGIIJARSA-N 326.414 2.101 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@H](OC(=O)CCC)[C@H]12 2356696188 NSSIFSOSOVNSCJ-NRSFXHEJSA-N 348.395 2.022 50 1 EEGF COC(C)(C)[C@H](Br)c1nc2c(O)nc(S)nc2[nH]1 586971616 USYBLGNXXADJKZ-RXMQYKEDSA-N 333.211 2.208 50 1 EEGF CN(NC(=O)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 13781213 COEHNWRMZHFUOQ-UHFFFAOYSA-N 338.323 2.426 50 1 EEGF C[C@@]1(O)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccc(F)cc1 169329303 LHISGEJBLVJODQ-KSYCFECVSA-N 344.404 2.240 50 1 EEGF COc1cc(OC)cc(C(=O)NCCSSCCN(C)C)c1 618007822 JRVBJKODSMZCIE-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF O=C1C=CC([N+](=O)[O-])=C/C1=C\NNC(=O)c1cccc2ccccc12 15837334 JTSUNGHSDLEVKK-ACCUITESSA-N 335.319 2.258 50 3 EEGF N[C@H](CCCCNC(=O)CCCC[C@H]1CCSS1)C(=O)O 12494653 COTIXRRJLCSLLS-NWDGAFQWSA-N 334.507 2.399 50 1 EEGF endogenous,in-man COc1ccccc1NCC(=O)NN/C=C1\C(=O)C=Cc2ccccc21 13126903 SBNSVUOKFCQIKY-VBKFSLOCSA-N 349.390 2.365 50 3 EEGF COC(=O)CCCCCCC(=O)N/N=C/c1ccc(C(=O)O)cc1 95809080 BAHNAYNJDYAQIL-LDADJPATSA-N 334.372 2.349 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)C[C@H](O)[C@H]4[C@@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 253951420 VCMOVYRZBUORCV-DXJVVYSCSA-N 328.405 2.202 50 1 EEGF O=C(N/N=C/c1ccccc1O)c1c[nH]c2c(F)cccc2c1=O 653857563 XBSSEXRYMLOYCL-DNTJNYDQSA-N 325.299 2.137 50 1 EEGF N#CC1=C(N)[C@H]2[C@@H](C=C1N)Oc1cc(O)ccc1[C@@H]2c1ccccc1 101011715 VIUWVURDHWPCKS-QYZOEREBSA-N 331.375 2.494 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@@H]3COC(=O)[C@]312 2356695108 TVXYJSQJIDMDKV-YMBUTIGBSA-N 348.439 2.169 50 1 EEGF Cc1c(-c2nc3cc(C(=O)NN)ccc3[nH]2)oc2c1[C@@H](O)CCC2 586905730 ZZBPAXBKXHKPLS-LBPRGKRZSA-N 326.356 2.105 50 1 EEGF CC(C)Oc1cccc(C(=O)NNS(=O)(=O)c2ccccc2)c1 1857541088 PKVCHAKXMMUDIM-UHFFFAOYSA-N 334.397 2.097 50 1 EEGF CCCN1N=C[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@H](Cl)C1=O 587423304 WODSKEVBVQPWIM-JGFGOQIWSA-N 348.786 2.027 50 1 EEGF N#CC(=C\c1cccs1)/C=C1\SC(=S)N(CC(=O)O)C1=O 103229583 BSGZLUCSZJTESD-AKVKBJFPSA-N 336.419 2.484 50 1 EEGF COC(C)(C)[C@@H](Br)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 586970220 BXWVQVVDIGICLL-YFKPBYRVSA-N 334.605 2.231 50 1 EEGF C=C(C)C(=O)O[C@@H]1CC(C=O)=CCC[C@]2(C)O[C@@H]2[C@@H]2OC(=O)C(=C)[C@H]12 2356562083 NGGWPCQJJXMSHR-HLTONANMSA-N 346.379 2.039 50 1 EEGF CN(C)CCSSCCC(=O)Nc1ccc(C(=O)O)cc1O 618007612 HXDMHUHCUFMHNB-UHFFFAOYSA-N 344.458 2.362 50 1 EEGF CC(C)CN(NC(=O)OC(C)(C)C)c1nc(C#N)ncc1[N+](=O)[O-] 58592416 RPMHCWZMKHHQPG-UHFFFAOYSA-N 336.352 2.159 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOC[C@H]1Br)O2 587372293 KCMKWSNWMGGNOY-TZMCWYRMSA-N 326.190 2.465 50 1 EEGF O=C1C=CC(=O)c2c1ccc1c2O[C@H](CI)C1 169350642 JNMVXSIPRYHLFL-QMMMGPOBSA-N 340.116 2.360 50 1 EEGF NNC(=O)c1ccc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2c1 587126012 JAYVHOYNXGFMND-UHFFFAOYSA-N 342.321 2.107 50 1 EEGF COc1ccc(Cl)cc1C#Cc1cccc(OCC(=O)NN)c1 587905125 LZWRZMFBFMEFDK-UHFFFAOYSA-N 330.771 2.117 50 1 EEGF O=C(CSc1nc2ccccc2o1)NN/C=C1/C=CC(=O)C(O)=C1 13126564 VMYIHDLEKWLKPN-NTMALXAHSA-N 343.364 2.005 50 3 EEGF COc1cc2c3c(c1)O[C@]1(CCOC[C@@H]1Br)[C@@H](C2)C3=O 587416690 CGGQWFRWCHEPHX-ITDIGPHOSA-N 339.185 2.365 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@H](CCl)[C@H]4[C@H](C2)N(C)CC[C@]314 195008876 YYDGJYRFMZGTTH-KTYAGFEHSA-N 347.842 2.398 50 1 EEGF COc1ccc2c3c1O[C@H]1C(=O)C[C@@H](CCl)[C@@H]4[C@@H](C2)N(C)CC[C@]341 169336926 YYDGJYRFMZGTTH-CNAHBDDSSA-N 347.842 2.398 50 1 EEGF CN(C)CCSSCCNC(=O)Nc1ccc(C#N)nc1 618007754 OARGDJSTJJNPLY-UHFFFAOYSA-N 325.463 2.018 50 1 EEGF CC(=CC=O)O[C@@H]1[C@@H](O)c2c(ccc3ccc(=O)oc23)OC1(C)C 2356641513 SIHQKLUJMQEDIR-DOTOQJQBSA-N 330.336 2.485 50 1 EEGF O=C(CCCC[C@H]1CCSS1)NCCCS(=O)(=O)O 1772570985 SZYIEKXYLQGLFW-JTQLQIEISA-N 327.493 2.095 50 1 EEGF O=[P@]1(N(CCCl)CCCl)OCC[C@H](O)N1CCCl 29318984 RAXABQCFPAWRSY-NIVTXAMTSA-N 339.587 2.154 50 1 EEGF C=C1C(=O)O[C@@H]2C=C(C)CCC=C(C=O)[C@H](O)[C@@H](OCC(C)C)[C@H]12 2356473207 XIQILJDZEXJZIC-BDXSIMOUSA-N 334.412 2.352 50 1 EEGF O=C(CCCN1C(=O)c2ccccc2C1=O)N/N=C\C1=CCCC1 28654799 QLLNPSDFDXRFLT-UNOMPAQXSA-N 325.368 2.275 50 1 EEGF COc1ccc(Cl)cc1C#Cc1ccc(OCC(=O)NN)cc1 587907228 HIMJNVQNCBDUSA-UHFFFAOYSA-N 330.771 2.117 50 1 EEGF Cc1cc(=O)oc2cc(NC(=O)[C@@](C)(O)CBr)ccc12 13609027 VKUMMPARISKUCS-AWEZNQCLSA-N 340.173 2.186 50 1 EEGF N#CC1=C(C#N)C(=O)[C@@H](Cl)C(=NCCCc2ccccc2)C1=O 2356842063 MKOGNADWXOYSGB-AWEZNQCLSA-N 325.755 2.163 50 1 EEGF O=C(N/N=C/c1ccccc1O)c1c[nH]c2ccc(F)cc2c1=O 1911579466 FANCCXBYTYTGAL-DNTJNYDQSA-N 325.299 2.137 50 1 EEGF C=CCOc1ccccc1/C=N/NC(=O)c1ccc(C(=O)NO)cc1 95809700 CKLGUXSUSRGWCT-XDHOZWIPSA-N 339.351 2.134 50 1 EEGF O=C1c2cccc(O)c2C(=O)c2c(O)cc(CNCCCl)cc21 53150905 VPJCVANRDWMOBX-UHFFFAOYSA-N 331.755 2.202 50 1 EEGF COc1ccccc1[C@@H]1[C@@H](Cl)C(=O)N1NC(=O)Cc1ccccc1 5838422 HCZAJKQTRNGOQV-IAGOWNOFSA-N 344.798 2.460 50 1 EEGF CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CC[C@H](Cl)C3)nc21 29329565 CPJXWTLTLAMACR-QMMMGPOBSA-N 339.754 2.071 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@]23COC(=O)[C@@H]13 2356518435 QCUXRKJBHSUAJV-DSEDUUINSA-N 348.439 2.169 50 1 EEGF COc1ccc2c3c1O[C@@H]1C(=O)C[C@@H](CCl)[C@H]4[C@@H](C2)N(C)CC[C@]314 253714185 YYDGJYRFMZGTTH-UMJFATCLSA-N 347.842 2.398 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@]1(C)O)[C@@]24OO3 169358732 QEZXEMZAZAJVRG-DIWFMKARSA-N 328.405 2.346 50 1 EEGF O=C(N/N=C/CCC/C=N/NC(=O)c1cccs1)c1ccncc1 1857655105 ZBBSRSPTRAKOPU-GCBPPVMSSA-N 343.412 2.445 50 1 EEGF O=C/C=C\c1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](CO)O2 14557594 SDDXIQONGFZHJH-MCXKQELZSA-N 328.320 2.183 50 1 EEGF endogenous,in-man CC(C)(C)C(=O)/C(C#N)=C/N1CCN(C(=O)c2ccco2)C1=S 40977379 WWBVLLASSIROJP-ZHACJKMWSA-N 331.397 2.345 50 1 EEGF CCC[C@H]1C2=C(CCC3=C(C[C@@H]1CC)C(=O)OC3=O)C(=O)OC2=O 85550787 OJIGDJPKCFGFKH-VHSXEESVSA-N 332.352 2.373 50 1 EEGF O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1nc2ccccc2[nH]1 1911582623 VCTSLVAFFYVDHO-DEDYPNTBSA-N 349.394 2.163 50 1 EEGF O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1ccc(Cl)s1 4867040 PLHMXBHYYNWJTI-GAORZPSPSA-N 347.827 2.381 50 3 EEGF COCc1cnc(C#N)nc1N(CC(C)C)NC(=O)OC(C)(C)C 58568372 SZIIDXHUMMTERT-UHFFFAOYSA-N 335.408 2.397 50 1 EEGF O=C(CNc1cccc(Br)c1)N/N=C/c1ccncc1 201287840 IMHZPGSAJFPMPX-GIJQJNRQSA-N 333.189 2.406 50 1 EEGF COc1cccc(C(=O)NCCCSSCCN(C)C)c1O 618007871 LRHSZQKNYWKKED-UHFFFAOYSA-N 344.502 2.464 50 1 EEGF COc1cc2cc[n+](C)c3c2c(c1OC)[C@@H](Br)OC3=O 28525364 KEIVQJZVBOSYMT-ZDUSSCGKSA-N 339.165 2.245 50 1 EEGF O=C(CCCc1ccc(F)cc1)NNCc1ccc(O)c(O)c1O 1772630033 ZGJRSKNKWWSLSJ-UHFFFAOYSA-N 334.347 2.086 50 1 EEGF Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N1CCOCC1)(CCl)O2 587373113 PTWXHOOOSVNMCL-RCAFFNEUSA-N 336.819 2.366 50 1 EEGF COc1cc(C2=CC(=C3C=CC(=O)C=C3)NC(N)=C2C#N)ccc1O 104026211 NMWZWPXOXRZRLP-UHFFFAOYSA-N 333.347 2.030 50 3 EEGF COc1cc2c3c(c1)O[C@](/C=C/N1CCOCC1)(CCl)[C@@H](C2)C3=O 587417083 JDQGEYIGDXEKDG-AMVWBUNWSA-N 349.814 2.266 50 1 EEGF C[C@@H]1CC[C@]2(C)C(C=O)=CCC[C@@H]2[C@]1(C)C[C@@H]1O[C@@H](O)C(=O)[C@@]12CO2 2356475882 TYEWCIUNKYTNGK-RNZAJSCTSA-N 348.439 2.410 50 1 EEGF COC(=O)[C@@]1([C@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 587371472 DXHXYLUGIOWIEV-RTHLEPHNSA-N 342.189 2.238 50 1 EEGF O=C/C=C/c1ccc2c(c1)O[C@H](CO)[C@@H](c1ccc(O)c(O)c1)O2 17175010 NTXXGPYGMQQSML-ZHEVZCJESA-N 328.320 2.183 50 1 EEGF Cc1nc2ccccc2n(CC(=O)N/N=C/Cc2ccccc2)c1=O 138866083 WALLSCOFYYXQMR-UDWIEESQSA-N 334.379 2.050 50 1 EEGF C=C(C=O)[C@H]1C[C@@H](COC=Cc2ccc(O)cc2)C(CO)=C1C=O 2356340677 VHBCHQFWBGEKKL-DOTOQJQBSA-N 328.364 2.259 50 1 EEGF CCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@@]1(C)O)[C@]42OO3 139023514 QEZXEMZAZAJVRG-GTNNPJQESA-N 328.405 2.346 50 1 EEGF Cc1nnsc1C(=O)NNC(=S)Nc1ccc(Cl)cc1 7958231 WBLFKLCTYDLITH-UHFFFAOYSA-N 327.822 2.131 50 1 EEGF OB(O)c1ccc(-c2nc3ccc4n[nH]cc4c3c3c2CCCC3)cc1 1857545926 IENAHFGOROGKTB-UHFFFAOYSA-N 343.195 2.337 50 1 EEGF CCOCCOC(=O)/C(C#N)=C(/C)NCc1cnc(Cl)s1 38317454 PWRLAZHNVUUDHU-LUAWRHEFSA-N 329.809 2.263 50 1 EEGF CN(C)CCSSCCN(C)C(=O)COc1ccc(O)cc1 618009434 CYQCFMDLQLRKIJ-UHFFFAOYSA-N 344.502 2.172 50 1 EEGF N[C@H](CCCCNC(=O)CCCC[C@@H]1CCSS1)C(=O)O 12494640 COTIXRRJLCSLLS-VXGBXAGGSA-N 334.507 2.399 50 1 EEGF endogenous,in-man CCOC(=O)C[C@@H]1CC[C@]2(OCCC[C@H]2CC(=O)OCC)OO1 299827375 GHPFIDWYRPTEMF-XEZPLFJOSA-N 330.377 2.126 50 1 EEGF CCC=CC1=C2CCC3=C(C(=O)OC3=O)[C@H](CCC)[C@@]2(O)OC1=O 2356722095 XYCWVVKRGCDXIK-UGSOOPFHSA-N 332.352 2.085 50 1 EEGF COC1=CC=C/C(=C\NNC(=O)NC23CC4CC(CC(C4)C2)C3)C1=O 12725867 RSIRVIGRXOENAZ-RVDMUPIBSA-N 343.427 2.312 50 3 EEGF C[C@@H]1CC[C@H]2[C@H](Cn3ccnc3)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]32OO4 43911371 NZOBFHPRHGUZAL-LGLJPOHYSA-N 348.399 2.272 50 1 EEGF C[C@H]1CC(=O)NN=C1c1ccc(NC(=O)[C@@H](C)Br)cc1 27881539 BJBIKCDDHROHFL-DTWKUNHWSA-N 338.205 2.269 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@]24OO3)[C@]1(C)O 169358731 QEZXEMZAZAJVRG-XDIZTRCRSA-N 328.405 2.346 50 1 EEGF O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@@H]1c1ccccc1O 5838373 OWSHVQCLIWFXCE-HOTGVXAUSA-N 330.771 2.157 50 1 EEGF C#CCSc1nc(NNC(N)=O)c(C#N)c(-c2ccc(C)cc2)n1 215894839 TYNAXHYVOQYJNW-UHFFFAOYSA-N 338.396 2.044 50 1 EEGF Cc1nc(NC(=O)[C@@H](Cc2ccco2)NC(=O)CCl)sc1C 35941951 VBGPOEZAKXVFKP-LLVKDONJSA-N 341.820 2.258 50 1 EEGF C=C1C[C@H](O)[C@H](Br)C(C)(C)[C@@]12C=C[C@](O)(CO)CC2 2356824593 GWKDEWRFZLOGGJ-DDHJSBNISA-N 331.250 2.157 50 1 EEGF COC(C)(C)[C@H](Br)c1nc2ccc(C(=O)NN)cc2[nH]1 586971676 WGCLBMRPTMGMGS-SNVBAGLBSA-N 341.209 2.027 50 1 EEGF CC(C)(O)C=CC=C(C=O)[C@@H]1CC[C@]2(C)[C@H](O)CC[C@@H]3COC(=O)[C@@]312 2356695106 TVXYJSQJIDMDKV-KMJHBWPFSA-N 348.439 2.169 50 1 EEGF COc1ccc(/C=N\NC(=O)CNC2=CC(=O)CC(C)(C)C2)cc1 101778481 VUPYIIMCIUWDLW-JAIQZWGSSA-N 329.400 2.008 50 1 EEGF C[C@@H]1C(=O)N(C(=O)CCl)[C@H]2CC[C@@H](C(=O)OCc3ccccc3)[C@H]12 27518685 LHKIDMCVMWJFKQ-AEIGPULVSA-N 349.814 2.368 50 1 EEGF N#C/C(C1=NC(=O)c2ccccc21)=C1/Nc2ccccc2N1CCO 103980731 OBJGVYFCUPVTHP-NBVRZTHBSA-N 330.347 2.289 50 3 EEGF CCOc1ccc([C@H]2C[C@H]2C(=O)NNC(=O)c2ccncc2)cc1 49110834 XZLCAXJGTXAHSN-HZPDHXFCSA-N 325.368 2.045 50 1 EEGF CC[C@]1([C@@H](Cl)C(=O)OC)NC[C@H]2CC(=O)N(C)c3cccc1c32 963038588 WLUNXLXQIXQZHS-PHEKWQANSA-N 336.819 2.126 50 1 EEGF C[C@@H]([C@H]1C(=O)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3)[N+](=O)[O-] 44388467 HCFKFIURHYVHFM-PCGCTMMYSA-N 341.360 2.040 50 1 EEGF CN(C)c1ccc(/C=N/NC(=O)c2snnc2C(F)(F)F)cc1 103183170 OBSUVXYWOUUKEN-REZTVBANSA-N 343.334 2.387 50 1 EEGF CCCN1N=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)[C@H](Cl)C1=O 587382946 UQCDRNPOLHNWQJ-ZBFHGGJFSA-N 335.791 2.127 50 1 EEGF CC(C)=C[C@@H]1C=C(C=O)[C@H]2CC[C@@]3(C)C[C@@]4(O[C@@H]4C[C@H]3O)[C@@H]2[C@H]1O 166433720 GFEUOMWJSRIDTL-HMZNJHAASA-N 332.440 2.393 50 1 EEGF COc1cc2c3c(c1)O[C@@](CBr)(C(C)=O)[C@@H](C2)C3=O 587415549 ULIPPTFORRHMFT-HZMBPMFUSA-N 325.158 2.165 50 1 EEGF COc1ccc2c(c1)C[C@H](c1nc3ccc(C(=O)NN)cc3[nH]1)CC2 587947659 ZRFQFVYXJSGXOY-GFCCVEGCSA-N 336.395 2.448 50 1 EEGF CC[C@@H]1C=C2C(=O)OC(=O)[C@]2(C)CC2=C(C(=O)OC2=O)[C@H](CC)C1 2356337069 UQDSFYQHSIUJQU-XVYUCKLSSA-N 332.352 2.229 50 1 EEGF COBN1CC[C@@H](Cl)[C@@H]1C=CCc1ccc(C(=O)OC)s1 2356629941 WBEBIWGZXCXPAQ-NEPJUHHUSA-N 327.642 2.228 50 1 EEGF Cc1c(-c2nc3cc(C(=O)NN)ccc3[nH]2)oc2c1[C@H](O)CCC2 586905729 ZZBPAXBKXHKPLS-GFCCVEGCSA-N 326.356 2.105 50 1 EEGF O=C(CSc1nnc(-c2ccncc2)o1)N/N=C/c1cccs1 103232013 WQGFFRGOTNDGLK-LZYBPNLTSA-N 345.409 2.436 50 1 EEGF CCOCCOC(=O)/C(C#N)=C(\NCc1ccc(OC)nc1)C(C)C 38230543 FVWQJQLFMPGNRI-ICFOKQHNSA-N 347.415 2.193 50 1 EEGF C/C(=N\NC(=O)NNC(=O)Nc1ccccc1Cl)c1ccccn1 43260974 MPHIIVGFJMUAIK-VXLYETTFSA-N 346.778 2.495 50 1 EEGF O=C(NN/C=C1/C=CC(=O)C(O)=C1)NC12CC3CC(CC(C3)C1)C2 13130522 IHRJFWHVHWPZHX-KHPPLWFESA-N 329.400 2.224 50 3 EEGF COc1ccccc1C(=O)N(NC(=O)c1snnc1C)C(C)(C)C 103206570 RQWBAQGGSLGIBI-UHFFFAOYSA-N 348.428 2.441 50 1 EEGF C[C@@]1(CS(=O)(=O)c2ccccc2)OO[C@@H]2C[C@@H]1CC[C@@]2(C)O 100836848 PFAJNVCFGCXGRB-XZDPQHSOSA-N 326.414 2.101 50 1 EEGF Cc1cc(O)c2c3c(c(O)c4c(c13)O[C@](C)(O)C4(C)C)C(=O)OC2=O 2356801816 QVOBPXACBGUACY-SFHVURJKSA-N 344.319 2.249 50 1 EEGF COc1cc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc2c1OCO2 34042717 CNUUTJDROFSROH-MRXNPFEDSA-N 337.335 2.224 50 1 EEGF O=C(N/N=C/c1c(-c2ccccc2)no[n+]1[O-])c1ccc(Cl)cc1 169352100 PKIKKPUHKGTKJU-VCHYOVAHSA-N 342.742 2.392 50 1 EEGF OB(O)c1cccc(-c2nc3ccc4n[nH]cc4c3c3c2CCCC3)c1 1857543677 GXLCGYBDEYQDNK-UHFFFAOYSA-N 343.195 2.337 50 1 EEGF O=C(NO)c1ccc(C(=O)N/N=C/c2ccc3ccccc3n2)cc1 95808179 QQINICSDSPXFFZ-YBFXNURJSA-N 334.335 2.118 50 1 EEGF COc1cccc(C(=O)NCCSSCCN(C)C)c1OC 618007963 ORUUAHJVVRZKBK-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(C(=O)NN)cc3[nH]2)cc1 587935139 GMTLZMKYQLRZBX-QFYYESIMSA-N 340.383 2.012 50 1 EEGF O=C(Cc1ccc(O)c(Cl)c1)N/N=C1\C(=O)Nc2ccccc21 72179243 WBKDJFKSQMMWDV-UHFFFAOYSA-N 329.743 2.061 50 1 EEGF CN(C)CCSSCCCNC(=O)Cc1ccc(O)cc1 618008259 WGEYIIACUKPFBL-UHFFFAOYSA-N 328.503 2.384 50 1 EEGF CCC=CC1=C2CCC3=C(C(=O)OC3=O)[C@H](CCC)[C@]2(O)OC1=O 2356722094 XYCWVVKRGCDXIK-SCLBCKFNSA-N 332.352 2.085 50 1 EEGF CCN(CC)c1ncnc2c1ncn2[C@H]1C[C@@H]2[C@@H](Cl)C[C@H]1[C@H]2CO 473120609 OUAPVRLNNDSGCQ-PEDHHIEDSA-N 349.866 2.469 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2ccnc(Br)c2[nH]1 587007887 ICXOORXIDVJGDZ-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF O=C(CCl)Nc1ccccc1-c1ccc2c(O)nc(O)nc2n1 587369134 WGSLQYFHDCYLCT-UHFFFAOYSA-N 330.731 2.280 50 1 EEGF C[C@]1(CS(=O)(=O)c2ccc(F)cc2)OO[C@H]2C[C@@H]1CC[C@@]2(C)O 58668534 LHISGEJBLVJODQ-DANNLKNASA-N 344.404 2.240 50 1 EEGF CCO[C@@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@]1(C)O)[C@@]24OO3 169358733 QEZXEMZAZAJVRG-YFSAXICGSA-N 328.405 2.346 50 1 EEGF C[C@@H](NC(=O)c1ccccc1C(=O)c1ccc2ccccc2c1)B(O)O 170139071 HDJHRFHFUBGUTO-CYBMUJFWSA-N 347.179 2.201 50 1 EEGF C=C(C)C(=O)O[C@@H]1CC(C=O)=CCC[C@]2(C)O[C@@H]2[C@H]2OC(=O)C(=C)[C@H]21 2356562088 NGGWPCQJJXMSHR-TVEAVKIZSA-N 346.379 2.039 50 1 EEGF Cc1c(C(=O)N/N=C/c2ccco2)nnn1Nc1ccc(Cl)cc1 40878315 XZPYKJBHSBCUBH-RQZCQDPDSA-N 344.762 2.472 50 1 EEGF COc1ccc(C(=O)NCCSSCCN(C)C)c(O)c1 618007937 NTJJLXMVTUFOPL-UHFFFAOYSA-N 330.475 2.074 50 1 EEGF CC(C)(NC(=O)CCl)c1nc2cncc(Br)c2[nH]1 587007588 GMDCGQHBFKZHSK-UHFFFAOYSA-N 331.601 2.311 50 1 EEGF O=C(N/N=C/c1ccc(O)cc1)c1c[nH]c2c(F)cccc2c1=O 653890256 GNGBVJPJLXHUQU-DNTJNYDQSA-N 325.299 2.137 50 1 EEGF O=[P@]1(N(CCCl)CCCl)OCC[C@@H](O)N1CCCl 29318979 RAXABQCFPAWRSY-DYBLOJMWSA-N 339.587 2.154 50 1 EEGF COc1ccc(OC)c(C(=O)NCCSSCCN(C)C)c1 618007958 OGALGMLODVBTER-UHFFFAOYSA-N 344.502 2.377 50 1 EEGF COc1ccc2nc(-c3nc4cc(C(=O)NN)ccc4[nH]3)sc2c1 587035169 MMYJYKFFCGLWFM-UHFFFAOYSA-N 339.380 2.452 50 1 EEGF C#CC=CC[C@H](O)[C@@H]1C[C@@H]2O[C@H]([C@@H](Br)CC)C[C@@H]2O1 2356423629 IGGWUQFVBHRWOH-LZXPERKUSA-N 329.234 2.415 50 1 EEGF COC(C)(C)[C@@H](Br)c1nc2c(O)nc(S)nc2[nH]1 586971618 USYBLGNXXADJKZ-YFKPBYRVSA-N 333.211 2.208 50 1 EEGF COc1cccc(NC(=O)NNC(=O)CCc2ccccc2OC)c1 103202973 IDIGWBKBMXCKKS-UHFFFAOYSA-N 343.383 2.489 50 1 EEGF COc1ccc(C(=O)N/N=C/c2c(C)nc3ccccn23)cc1OC 95556601 MWVMUSOFHCHRJR-YBFXNURJSA-N 338.367 2.424 50 1 EEGF COBN1CC[C@H](Cl)[C@H]1CCCc1ccc(C(=O)OC)s1 2356704737 GFUALJXBCRMIQS-NWDGAFQWSA-N 329.658 2.452 50 1 EEGF O=C(CN1CCN(c2ccccc2)CC1)N/N=C/c1cccc(F)c1 61704711 CCVDVKPRKZTDLC-KGENOOAVSA-N 340.402 2.098 50 3 EEGF COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc2c1OCO2 34042718 CNUUTJDROFSROH-INIZCTEOSA-N 337.335 2.224 50 1 EEGF Cc1ccc(C2OOC(c3ccc(C(=O)NCCO)cc3)OO2)cc1 72175422 FZZUKDFZRKHACM-UHFFFAOYSA-N 345.351 2.325 50 1 EEGF COc1ccc2c(c1OC)[C@@]13C=C(C#N)CC[C@@]1(O)[C@@H](C2)N(C)CC3 13648774 MNCVRVFRFKEAMM-NSISKUIASA-N 340.423 2.177 50 1 EEGF O=c1[nH]c2cc([N+](=O)[O-])ccc2n(CCCCCCCl)c1=O 473136265 OYKBGWKLZPNNAI-UHFFFAOYSA-N 325.752 2.397 50 1 EEGF O=C(NN/C=C1\C=NN=C1c1ccccc1)c1ccc([N+](=O)[O-])cc1 13126662 DQXRIAXNAKSTDW-SDNWHVSQSA-N 335.323 2.202 50 3 EEGF O=C(O)CCC(=O)O[C@]12CCCC[C@@H]1[C@@H]1CCCC[C@@]1(O)OO2 169314781 NMOQQEQDHSENLC-OJDYBEQGSA-N 328.361 2.122 50 1 EEGF O=C(Cc1ccc(Br)cc1)O[C@H]1CS[S@@](=O)C1 96283345 RGXGCYKBODEBNH-BTDLBPIBSA-N 335.244 2.314 50 1 EEGF CN(C)CCSSCCNC(=O)c1ccc2[nH]nc(C#N)c2c1 618017339 JOUUPAUVSPZMPU-UHFFFAOYSA-N 349.485 2.107 50 1 EEGF CC[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc(C)cc2B(O)O)N1 962944742 FCDHNRUYFXTDMS-ORAYPTAESA-N 334.228 2.170 50 1 EEGF CCO[C@H]1O[C@H]2O[C@]3(C)CC[C@H]4[C@@H](C=O)CC[C@@H]([C@H]1C)[C@@]24OO3 195244719 JEAMUJGJFHFTDV-FJQAHZGZSA-N 326.389 2.410 50 1 EEGF O=C(Cc1ccc(Br)cc1)O[C@@H]1CS[S@@](=O)C1 96283344 RGXGCYKBODEBNH-QGHHPUGFSA-N 335.244 2.314 50 1 EEGF COc1cc2c3c(c1)O[C@@](/C=C\N1CCOCC1)(CCl)[C@@H](C2)C3=O 587417087 JDQGEYIGDXEKDG-DFCTYKRISA-N 349.814 2.266 50 1 EEGF N#CC1=C(N)[C@@H]2[C@@H](C=C1N)Oc1cc(O)ccc1[C@H]2c1ccccc1 195093361 VIUWVURDHWPCKS-GUDVDZBRSA-N 331.375 2.494 50 1 EEGF O=C1OC(=O)c2cc(-c3nc4nc(Br)c[nH]c-4n3)ccc21 586909203 WMHNNXVQOLPOHY-UHFFFAOYSA-N 345.112 2.045 50 1 EEGF COc1ccc(O)c(/C=N/NC(=O)c2cc3ccccc3oc2=O)c1 1857573326 VSWGDTVWEOEFSQ-VXLYETTFSA-N 338.319 2.271 50 1 EEGF O=CC=Cc1ccc2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](CO)O2 2356594378 SDDXIQONGFZHJH-ROUUACIJSA-N 328.320 2.183 50 1 EEGF O=C(N/N=C/c1cnc[nH]1)c1cnc2c(C(F)(F)F)cccc2c1O 73138502 IDPUZVHSPWKFQO-RREIPUBJSA-N 349.272 2.446 50 1 EEGF C#CCOC(=O)[C@]1(C)c2[nH]c3ccccc3c2CCN1C(=O)CCl 96174902 FCBGSDAUOVDSHM-SFHVURJKSA-N 344.798 2.183 50 1 EEGF CN(C)CCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1 1772638838 YTXLHPNMTLRESI-CPNJWEJPSA-N 327.384 2.097 50 1 EEGF O=C(Cl)CC(=O)c1c(CO)oc2cc(Br)cnc12 587274378 UHXPNSLGSQSFFL-UHFFFAOYSA-N 332.537 2.421 50 1 EEGF